data_2yz0_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 2yz0 _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' ' ' LEU . . . . . . . . . . . . . 11.0 mt . . . . . 0 C--O 1.231 0.129 0 CA-C-O 120.845 0.355 . . . . 72.540000000000006 110.954 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 -53.02 -32.18 45.26 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.156 -0.475 . . . . 75.140000000000001 110.834 179.868 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 62.8 mm-40 -64.84 -38.42 90.92 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.193 -0.458 . . . . 63.100000000000001 110.893 -179.84 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 20.7 m-85 -64.16 -25.18 67.97 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.183 -0.462 . . . . 74.120000000000005 110.946 -179.887 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -58.98 -37.4 76.72 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.142 -0.481 . . . . 75.430000000000007 110.926 -179.957 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 1.6 mm-40 -65.91 -43.35 88.44 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.125 -0.489 . . . . 74.129999999999995 110.909 179.978 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 4.3 mp -67.22 -43.24 88.44 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 116.135 -0.484 . . . . 71.310000000000002 111.152 179.968 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 81.7 mt-30 -64.69 -46.28 83.03 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.152 -0.476 . . . . 73.209999999999994 110.911 179.965 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 38.9 t -60.96 -38.84 87.33 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.182 -0.463 . . . . 72.219999999999999 110.847 -179.931 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 1.5 m-20 -58.79 -33.87 70.83 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.172 -0.467 . . . . 74.030000000000001 110.899 -179.878 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 15.6 mt-10 -67.71 -38.59 83.81 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.16 -0.473 . . . . 73.329999999999998 110.865 -179.954 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . 0.471 HD12 ' N ' ' A' ' 19' ' ' LEU . 9.8 mp -61.48 -51.68 67.67 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.176 -0.466 . . . . 75.030000000000001 110.932 179.989 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 2.5 pt-20 -68.86 -34.6 75.73 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.192 -0.458 . . . . 75.310000000000002 110.895 179.958 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -65.35 -45.79 82.77 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.142 -0.481 . . . . 72.530000000000001 111.114 179.948 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . 0.478 ' N ' HD13 ' A' ' 22' ' ' ILE . 0.5 OUTLIER -77.2 -34.59 21.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.186 -0.461 . . . . 73.340000000000003 111.14 179.944 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -53.39 -35.59 60.53 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.177 -0.465 . . . . 75.400000000000006 110.841 179.98 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -66.79 -31.43 72.06 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.167 -0.47 . . . . 72.150000000000006 110.863 -179.77 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 5.0 mt -79.72 -45.09 23.3 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.163 -0.472 . . . . 75.430000000000007 111.112 179.943 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 38.4 m-85 -111.51 45.73 1.18 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.187 -0.46 . . . . 74.310000000000002 110.928 -179.988 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -40.85 -40.56 1.39 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.131 -0.486 . . . . 73.319999999999993 110.884 179.909 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 11.4 m-20 -106.07 -27.2 11.27 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.204 -0.453 . . . . 75.120000000000005 110.887 179.942 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 10.7 m-20 -85.05 29.57 0.64 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.196 -0.456 . . . . 73.040000000000006 110.853 179.998 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' PHE . . . . . 0.545 ' C ' ' CD1' ' A' ' 30' ' ' PHE . 0.3 OUTLIER -113.21 146.04 39.98 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.229 -0.442 . . . . 74.230000000000004 110.853 -179.929 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 42.5 m -122.89 132.9 54.38 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.117 -0.492 . . . . 72.049999999999997 111.17 -179.928 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -98.33 114.72 27.12 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.257 -0.428 . . . . 75.200000000000003 110.852 179.923 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . 0.461 ' CD2' ' HA ' ' A' ' 48' ' ' PHE . 0.3 OUTLIER -120.53 -16.47 8.31 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.147 -0.479 . . . . 74.040000000000006 110.951 -179.982 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 C--N 1.33 -0.273 0 CA-C-N 116.154 -0.476 . . . . 74.540000000000006 111.14 179.918 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 45' ' ' GLN . . . . . 0.482 ' O ' ' CB ' ' A' ' 46' ' ' ILE . 32.0 tt0 . . . . . 0 C--O 1.23 0.063 0 CA-C-O 120.798 0.332 . . . . 74.319999999999993 110.957 . . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 46' ' ' ILE . . . . . 0.482 ' CB ' ' O ' ' A' ' 45' ' ' GLN . 0.0 OUTLIER 84.1 -28.26 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.147 -0.479 . . . . 72.430000000000007 111.134 179.958 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . 0.494 ' N ' HD12 ' A' ' 47' ' ' ILE . 0.2 OUTLIER -43.32 148.3 0.21 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.157 -0.474 . . . . 74.209999999999994 111.12 179.866 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 48' ' ' PHE . . . . . 0.461 ' HA ' ' CD2' ' A' ' 33' ' ' LEU . 5.8 p90 -156.53 158.05 36.48 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.197 -0.456 . . . . 70.019999999999996 110.909 179.933 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . 0.402 ' HG2' ' CG ' ' A' ' 67' ' ' HIS . 40.1 mt-10 -108.99 152.0 25.56 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.128 -0.487 . . . . 73.230000000000004 110.846 -179.891 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 23.2 mm -131.46 137.03 56.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.157 -0.474 . . . . 71.420000000000002 111.101 179.963 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 75.9 m -84.67 124.3 31.33 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.164 -0.471 . . . . 74.420000000000002 111.104 179.974 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 20.7 mt -126.8 159.55 33.49 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.222 -0.445 . . . . 75.450000000000003 110.886 179.95 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 53' ' ' ARG . . . . . 0.414 ' C ' HD21 ' A' ' 125' ' ' LEU . 0.1 OUTLIER -179.88 168.23 1.31 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.166 -0.47 . . . . 74.450000000000003 110.931 179.944 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 54' ' ' SER . . . . . 0.463 ' N ' HD21 ' A' ' 125' ' ' LEU . 16.3 p -56.14 -173.26 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.22 -0.445 . . . . 75.340000000000003 110.869 -179.808 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 18.1 m -94.21 -28.1 4.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.135 -0.484 . . . . 74.200000000000003 111.105 179.94 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 1.6 t0 -121.55 -164.07 1.11 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.224 -0.444 . . . . 71.530000000000001 110.862 179.966 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 3.1 mmmm -118.39 -12.88 9.82 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.196 -0.456 . . . . 74.420000000000002 110.89 179.987 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . 0.552 ' HA ' ' C ' ' A' ' 59' ' ' PRO . 68.1 mt-10 -121.38 145.51 42.61 Favored Pre-proline 0 C--N 1.329 -0.287 0 CA-C-O 121.636 0.732 . . . . 73.040000000000006 110.895 179.972 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 59' ' ' PRO . . . . . 0.552 ' C ' ' HA ' ' A' ' 58' ' ' GLU . 53.7 Cg_endo -69.75 -9.42 10.98 Favored 'Cis proline' 0 C--O 1.231 0.172 0 C-N-CA 122.701 -1.791 . . . . 73.099999999999994 112.326 0.035 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 21.7 m -146.31 178.96 1.06 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.241 -0.436 . . . . 75.329999999999998 111.134 179.91 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . 0.458 ' O ' ' C ' ' A' ' 62' ' ' SER . 15.2 tt0 -108.04 -18.43 13.79 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.169 -0.469 . . . . 65.150000000000006 110.886 -179.933 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 62' ' ' SER . . . . . 0.458 ' C ' ' O ' ' A' ' 61' ' ' GLU . 0.9 OUTLIER 33.8 77.56 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.167 -0.47 . . . . 72.209999999999994 110.87 -179.794 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -102.87 126.76 50.15 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.143 -0.48 . . . . 73.129999999999995 110.849 -179.804 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 64' ' ' ILE . . . . . . . . . . . . . 21.1 mt -140.24 143.29 29.88 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 116.175 -0.466 . . . . 73.450000000000003 111.102 179.947 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 92.1 m -106.98 118.94 38.02 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.169 -0.469 . . . . 63.240000000000002 111.083 179.99 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 1.7 mp -100.09 114.0 27.03 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.198 -0.456 . . . . 71.430000000000007 110.924 179.913 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 67' ' ' HIS . . . . . 0.439 ' CE1' HD11 ' A' ' 33' ' ' LEU . 7.5 t60 -108.4 113.28 26.22 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.233 -0.44 . . . . 75.430000000000007 110.798 179.888 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 68' ' ' PHE . . . . . 0.554 ' CE1' HG22 ' A' ' 114' ' ' ILE . 0.0 OUTLIER -103.98 139.96 38.38 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.197 -0.456 . . . . 74.409999999999997 110.866 -179.937 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -119.66 119.46 33.79 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.135 -0.484 . . . . 75.230000000000004 111.108 179.94 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 70' ' ' MET . . . . . 0.423 ' HE3' ' CG1' ' A' ' 114' ' ' ILE . 2.5 mmt -84.25 89.41 7.33 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.223 -0.444 . . . . 74.409999999999997 110.919 179.946 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -45.02 157.76 0.32 Allowed Pre-proline 0 C--N 1.33 -0.274 0 CA-C-O 121.583 0.706 . . . . 71.129999999999995 111.124 -179.903 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.77 2.87 3.15 Favored 'Trans proline' 0 C--N 1.341 0.173 0 C-N-CA 122.643 2.229 . . . . 73.209999999999994 112.368 179.899 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 73' ' ' MET . . . . . 0.486 ' O ' ' CB ' ' A' ' 76' ' ' TYR . 0.0 OUTLIER -117.7 -26.38 6.58 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.23 -0.441 . . . . 74.030000000000001 110.879 179.918 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 74' ' ' TYR . . . . . 0.637 ' CD1' ' C ' ' A' ' 74' ' ' TYR . 0.0 OUTLIER -47.14 148.71 1.95 Allowed Pre-proline 0 C--N 1.328 -0.327 0 CA-C-O 121.712 0.768 . . . . 65.219999999999999 110.915 -179.862 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 75' ' ' PRO . . . . . 0.55 ' C ' ' HA ' ' A' ' 74' ' ' TYR . 54.1 Cg_endo -69.78 -13.46 12.44 Favored 'Cis proline' 0 C--N 1.342 0.185 0 C-N-CA 122.67 -1.804 . . . . 75.239999999999995 112.361 -0.009 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 76' ' ' TYR . . . . . 0.486 ' CB ' ' O ' ' A' ' 73' ' ' MET . 9.4 t80 -34.95 -46.3 0.3 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.207 -0.452 . . . . 71.010000000000005 110.867 -179.866 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 66.7 p -111.58 177.7 4.57 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.14 -0.482 . . . . 75.450000000000003 111.16 -179.953 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -98.33 135.03 21.39 Favored Pre-proline 0 C--N 1.328 -0.327 0 CA-C-O 121.578 0.704 . . . . 72.239999999999995 111.058 179.893 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 79' ' ' PRO . . . . . 0.426 ' HG3' ' CD1' ' A' ' 113' ' ' ILE . 53.5 Cg_endo -69.74 -167.27 0.22 Allowed 'Trans proline' 0 C--N 1.341 0.159 0 C-N-CA 122.667 2.245 . . . . 61.5 112.374 179.97 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -131.09 127.23 37.72 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.259 -0.428 . . . . 73.329999999999998 110.853 -179.97 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 10.0 mm -119.54 140.59 43.03 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.144 -0.48 . . . . 74.329999999999998 111.202 179.9 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . 0.454 ' HG3' ' CD ' ' A' ' 84' ' ' LYS . 1.0 OUTLIER -146.27 137.92 24.79 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.229 -0.441 . . . . 71.540000000000006 110.908 179.969 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 83' ' ' PHE . . . . . 0.421 ' C ' ' HD2' ' A' ' 84' ' ' LYS . 9.9 m-85 -93.48 140.0 30.08 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.158 -0.474 . . . . 71.340000000000003 110.871 -179.919 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 84' ' ' LYS . . . . . 0.463 ' O ' ' N ' ' A' ' 86' ' ' VAL . 10.6 mmmt -123.78 172.0 9.2 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.14 -0.482 . . . . 74.129999999999995 110.914 179.956 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 85' ' ' ASN . . . . . 0.482 ' N ' HD21 ' A' ' 85' ' ' ASN . 1.5 m-80 62.8 -74.19 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.23 -0.441 . . . . 74.109999999999999 110.947 179.971 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 86' ' ' VAL . . . . . 0.463 ' N ' ' O ' ' A' ' 84' ' ' LYS . 3.5 m 41.54 91.15 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.158 -0.473 . . . . 75.219999999999999 111.078 179.859 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -97.19 -85.72 0.35 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.179 -0.464 . . . . 72.540000000000006 110.893 179.979 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -52.58 -46.38 66.87 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.222 -0.444 . . . . 74.299999999999997 110.865 -179.943 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 89' ' ' VAL . . . . . 0.458 HG21 ' N ' ' A' ' 90' ' ' MET . 0.7 OUTLIER -60.45 141.38 17.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.221 -0.445 . . . . 73.329999999999998 111.154 179.926 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 90' ' ' MET . . . . . 0.458 ' N ' HG21 ' A' ' 89' ' ' VAL . 7.6 mtm -95.71 -54.76 3.24 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.181 -0.463 . . . . 75.140000000000001 110.895 179.979 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 91' ' ' ASP . . . . . 0.432 ' OD1' ' C ' ' A' ' 90' ' ' MET . 1.3 p-10 175.36 -34.58 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.184 -0.462 . . . . 63.5 110.874 179.911 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -54.55 -40.27 68.53 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.238 -0.437 . . . . 74.219999999999999 110.826 -179.77 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 93' ' ' GLN . . . . . 0.566 ' HG3' ' CZ ' ' A' ' 128' ' ' PHE . 1.5 mp0 -70.98 -37.46 72.74 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.134 -0.484 . . . . 70.430000000000007 110.95 -179.979 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . 0.435 ' CD2' HG13 ' A' ' 86' ' ' VAL . 39.5 mt -65.58 -49.21 69.68 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.187 -0.461 . . . . 75.120000000000005 110.941 179.95 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 41.2 mt-30 -65.91 -34.02 77.17 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.141 -0.481 . . . . 75.219999999999999 110.904 179.937 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 96' ' ' MET . . . . . . . . . . . . . 2.3 ttp -60.08 -41.15 91.83 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.194 -0.457 . . . . 75.230000000000004 110.839 -179.971 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 97' ' ' LEU . . . . . 0.448 ' O ' ' CD1' ' A' ' 101' ' ' PHE . 34.3 mt -65.99 -39.69 90.52 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.201 -0.454 . . . . 74.109999999999999 110.871 -179.941 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 98' ' ' LYS . . . . . 0.413 ' HD3' ' CZ ' ' A' ' 83' ' ' PHE . 3.2 mmtp -55.31 -39.33 69.8 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.19 -0.459 . . . . 74.430000000000007 110.892 179.846 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -66.24 -37.84 86.46 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.239 -0.437 . . . . 73.140000000000001 110.89 -179.917 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 2.4 mm-40 -74.14 -24.57 59.44 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.113 -0.494 . . . . 64.239999999999995 110.818 -179.924 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 101' ' ' PHE . . . . . 0.557 ' CD2' HD13 ' A' ' 117' ' ' ILE . 10.8 m-30 -59.38 -26.88 65.48 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.222 -0.444 . . . . 74.049999999999997 110.935 -179.929 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.27 -42.98 64.97 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.107 -0.497 . . . . 73.540000000000006 110.899 179.968 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.76 -40.87 84.0 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.213 -0.449 . . . . 64.340000000000003 110.917 179.862 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 104' ' ' ILE . . . . . 0.409 HD13 ' CG ' ' A' ' 120' ' ' PHE . 2.6 mt -63.55 -47.6 90.74 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.225 -0.443 . . . . 74.439999999999998 111.111 179.863 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 105' ' ' HIS . . . . . 0.478 ' O ' ' N ' ' A' ' 109' ' ' ARG . 28.2 t-80 -62.89 -42.51 99.8 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.148 -0.478 . . . . 71.510000000000005 110.888 179.912 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -56.52 -40.9 75.81 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.164 -0.471 . . . . 74.019999999999996 110.865 -179.924 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 107' ' ' THR . . . . . 0.402 ' CG2' ' O ' ' A' ' 104' ' ' ILE . 8.0 t -80.47 -31.18 37.42 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.222 -0.444 . . . . 71.109999999999999 111.146 -179.97 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -103.9 21.91 15.48 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.201 -0.454 . . . . 73.420000000000002 110.877 -179.901 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 109' ' ' ARG . . . . . 0.478 ' N ' ' O ' ' A' ' 105' ' ' HIS . 0.0 OUTLIER -62.0 84.9 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.125 -0.488 . . . . 72.150000000000006 110.846 -179.93 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 110' ' ' GLY . . . . . 0.446 ' HA2' ' CB ' ' A' ' 75' ' ' PRO . . . 134.19 -23.15 3.7 Favored Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.705 -0.759 . . . . 65.219999999999999 112.452 179.988 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 111' ' ' GLN . . . . . . . . . . . . . 2.6 pt20 -109.06 -171.81 1.92 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.757 0.313 . . . . 75.519999999999996 110.894 -179.858 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 20.1 mt-10 -66.03 134.55 53.13 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.181 -0.463 . . . . 75.540000000000006 110.905 -179.987 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 113' ' ' ILE . . . . . 0.426 ' CD1' ' HG3' ' A' ' 79' ' ' PRO . 24.8 pt -123.23 -7.8 7.88 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.172 -0.467 . . . . 75.230000000000004 111.154 179.915 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 114' ' ' ILE . . . . . 0.554 HG22 ' CE1' ' A' ' 68' ' ' PHE . 28.6 mm -64.18 -44.19 97.46 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.161 -0.472 . . . . 73.409999999999997 111.101 179.865 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 115' ' ' PHE . . . . . . . . . . . . . 28.2 t80 -72.08 -36.9 69.65 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.194 -0.457 . . . . 75.120000000000005 110.864 179.99 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 50.2 mm-40 -65.93 -47.63 74.08 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.165 -0.47 . . . . 72.129999999999995 110.868 -179.927 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 117' ' ' ILE . . . . . 0.557 HD13 ' CD2' ' A' ' 101' ' ' PHE . 0.9 OUTLIER -64.26 -41.55 92.74 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.19 -0.459 . . . . 73.239999999999995 111.127 179.965 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 118' ' ' THR . . . . . 0.475 ' N ' ' CG2' ' A' ' 117' ' ' ILE . 71.1 p -68.03 -42.55 80.44 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.192 -0.458 . . . . 74.329999999999998 111.14 179.975 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 2.8 m -66.88 -43.48 83.4 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.249 -0.432 . . . . 54.25 110.861 -179.859 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 120' ' ' PHE . . . . . 0.409 ' CG ' HD13 ' A' ' 104' ' ' ILE . 0.3 OUTLIER -61.78 -47.65 84.23 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.115 -0.493 . . . . 73.219999999999999 110.871 -179.941 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 73.4 p -67.81 -40.76 83.83 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.13 -0.486 . . . . 61.140000000000001 111.116 -179.893 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 47.6 tt0 -64.3 -48.8 74.26 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.203 -0.453 . . . . 72.150000000000006 110.896 -179.94 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 123' ' ' GLU . . . . . 0.54 ' CG ' ' N ' ' A' ' 124' ' ' LYS . 3.5 pt-20 -61.84 -50.54 71.85 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.194 -0.457 . . . . 75.099999999999994 110.855 -179.929 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 124' ' ' LYS . . . . . 0.54 ' N ' ' CG ' ' A' ' 123' ' ' GLU . 0.0 OUTLIER -65.6 -37.18 85.88 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.159 -0.473 . . . . 72.239999999999995 110.871 -179.991 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 125' ' ' LEU . . . . . 0.463 HD21 ' N ' ' A' ' 54' ' ' SER . 1.1 tp -64.34 -51.5 63.09 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.249 -0.432 . . . . 71.540000000000006 110.912 179.901 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -57.2 -45.4 83.82 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.212 -0.449 . . . . 62.409999999999997 110.878 179.86 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 127' ' ' GLU . . . . . 0.46 ' HG3' ' N ' ' A' ' 128' ' ' PHE . 0.4 OUTLIER -61.27 -29.39 69.82 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.218 -0.446 . . . . 74.219999999999999 110.851 -179.885 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 128' ' ' PHE . . . . . 0.566 ' CZ ' ' HG3' ' A' ' 93' ' ' GLN . 0.3 OUTLIER . . . . . 0 C--N 1.329 -0.323 0 CA-C-N 116.18 -0.463 . . . . 74.140000000000001 110.863 -179.942 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 24.4 mt . . . . . 0 C--O 1.231 0.101 0 CA-C-O 120.798 0.333 . . . . 73.510000000000005 110.93 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -49.93 -34.08 19.47 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.195 -0.457 . . . . 73.120000000000005 110.868 179.794 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 7.0 mm100 -68.11 -39.26 82.84 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.181 -0.463 . . . . 75.019999999999996 110.847 -179.863 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 18.2 m-85 -58.9 -27.41 65.2 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.229 -0.441 . . . . 70.409999999999997 110.927 -179.858 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -60.72 -37.12 80.66 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.146 -0.479 . . . . 74.120000000000005 110.907 -179.906 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 3.1 mm-40 -58.58 -43.35 89.44 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.142 -0.481 . . . . 72.120000000000005 110.901 179.974 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 3.1 mp -66.06 -43.02 92.56 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.123 -0.489 . . . . 75.109999999999999 111.157 179.963 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 73.0 mt-30 -62.62 -42.2 99.45 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.165 -0.47 . . . . 73.150000000000006 110.907 179.943 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -61.1 -42.02 97.76 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.187 -0.46 . . . . 73.230000000000004 110.89 -179.948 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 1.5 m-20 -59.04 -33.72 71.08 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.165 -0.47 . . . . 61.100000000000001 110.9 -179.889 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 1.7 mt-10 -64.74 -37.89 89.15 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.18 -0.464 . . . . 73.239999999999995 110.866 -179.966 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . 0.56 HD11 ' CE1' ' A' ' 48' ' ' PHE . 7.2 mp -66.15 -51.61 56.27 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.159 -0.473 . . . . 73.329999999999998 110.93 -179.989 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -68.74 -33.35 73.76 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.171 -0.468 . . . . 74.439999999999998 110.925 179.923 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -66.44 -50.57 62.92 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.109 -0.496 . . . . 74.150000000000006 111.121 179.919 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . 0.482 ' N ' HD12 ' A' ' 22' ' ' ILE . 0.5 OUTLIER -73.37 -37.15 50.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.201 -0.454 . . . . 73.239999999999995 111.176 179.968 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 30.8 mtp180 -52.79 -34.5 53.72 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.131 -0.486 . . . . 71.400000000000006 110.918 179.937 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -66.75 -31.2 71.69 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.187 -0.461 . . . . 61.200000000000003 110.844 -179.799 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 3.5 mt -85.08 -44.5 17.33 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.142 -0.481 . . . . 65.230000000000004 111.123 179.926 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 27.7 m-85 -107.06 42.76 1.25 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.202 -0.453 . . . . 74.340000000000003 110.888 -179.925 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 1.9 mtm -41.29 -45.82 3.06 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.096 -0.502 . . . . 75.140000000000001 110.902 179.891 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -101.68 -14.23 17.46 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.202 -0.453 . . . . 70.200000000000003 110.878 179.928 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 3.1 m-20 -97.66 21.03 10.92 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.182 -0.463 . . . . 72.519999999999996 110.873 179.984 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' PHE . . . . . 0.491 ' CE2' ' CD2' ' A' ' 48' ' ' PHE . 5.4 t80 -109.87 137.23 47.95 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.204 -0.453 . . . . 73.310000000000002 110.878 -179.916 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 59.3 m -116.51 134.8 54.43 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.134 -0.485 . . . . 73.109999999999999 111.156 -179.914 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . 0.456 ' O ' ' CG ' ' A' ' 32' ' ' ASP . 0.0 OUTLIER -99.22 117.34 33.47 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.225 -0.443 . . . . 74.420000000000002 110.867 179.89 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . 0.451 ' CD2' ' HA ' ' A' ' 48' ' ' PHE . 0.2 OUTLIER -121.19 -21.4 6.42 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.194 -0.457 . . . . 73.299999999999997 110.918 -179.972 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 34' ' ' THR . . . . . 0.422 ' N ' ' CD2' ' A' ' 33' ' ' LEU . 0.6 OUTLIER . . . . . 0 C--N 1.329 -0.302 0 CA-C-N 116.204 -0.453 . . . . 74.430000000000007 111.108 179.918 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 45' ' ' GLN . . . . . 0.494 ' O ' ' CG ' ' A' ' 45' ' ' GLN . 15.7 tt0 . . . . . 0 C--O 1.231 0.114 0 CA-C-O 120.807 0.337 . . . . 72.209999999999994 110.908 . . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 46' ' ' ILE . . . . . 0.477 ' CB ' ' O ' ' A' ' 45' ' ' GLN . 0.2 OUTLIER 83.57 -29.55 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.21 -0.45 . . . . 74.420000000000002 111.163 -179.991 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . 0.505 ' N ' HD12 ' A' ' 47' ' ' ILE . 0.2 OUTLIER -45.1 146.14 0.44 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.151 -0.477 . . . . 73.140000000000001 111.145 179.827 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 48' ' ' PHE . . . . . 0.56 ' CE1' HD11 ' A' ' 19' ' ' LEU . 5.3 p90 -150.82 163.09 39.47 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.157 -0.474 . . . . 74.409999999999997 110.881 179.964 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 33.5 mt-10 -108.87 149.57 28.93 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.147 -0.478 . . . . 61.009999999999998 110.863 -179.9 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 6.2 mm -131.74 136.27 57.35 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.138 -0.483 . . . . 73.150000000000006 111.098 179.982 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 50.7 m -83.75 130.96 34.95 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.172 -0.467 . . . . 72.209999999999994 111.157 179.947 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 12.6 mt -133.46 156.44 47.73 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.221 -0.445 . . . . 74.200000000000003 110.898 179.962 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -175.09 168.06 3.45 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.207 -0.451 . . . . 74.120000000000005 110.916 179.977 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 1.7 m -60.88 168.21 2.47 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.207 -0.452 . . . . 74.530000000000001 110.859 -179.837 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 35.0 m -80.54 -29.58 12.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.137 -0.483 . . . . 74.310000000000002 111.089 179.943 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -114.56 -169.69 1.59 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.214 -0.448 . . . . 72.329999999999998 110.873 179.944 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 5.1 mmmt -115.64 -21.93 9.45 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.2 -0.455 . . . . 73.530000000000001 110.92 179.998 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . 0.536 ' HA ' ' C ' ' A' ' 59' ' ' PRO . 8.3 pt-20 -113.6 144.49 31.47 Favored Pre-proline 0 C--N 1.33 -0.258 0 CA-C-O 121.65 0.738 . . . . 75.299999999999997 110.913 179.932 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 59' ' ' PRO . . . . . 0.536 ' C ' ' HA ' ' A' ' 58' ' ' GLU . 53.6 Cg_endo -69.77 -7.39 9.97 Favored 'Cis proline' 0 C--N 1.341 0.144 0 C-N-CA 122.646 -1.814 . . . . 75.310000000000002 112.348 -0.036 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 60' ' ' VAL . . . . . 0.47 ' HB ' ' ND2' ' A' ' 88' ' ' ASN . 13.2 m -154.37 -179.92 0.3 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.176 -0.465 . . . . 74.310000000000002 111.122 179.877 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . 0.464 ' O ' ' C ' ' A' ' 62' ' ' SER . 1.2 pt-20 -112.83 -16.25 12.77 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.171 -0.468 . . . . 62.32 110.909 -179.953 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 62' ' ' SER . . . . . 0.464 ' C ' ' O ' ' A' ' 61' ' ' GLU . 0.3 OUTLIER 33.14 91.54 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.126 -0.488 . . . . 71.049999999999997 110.867 -179.825 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 3.9 m -102.93 123.13 45.97 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.106 -0.497 . . . . 62.329999999999998 110.88 -179.832 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 64' ' ' ILE . . . . . . . . . . . . . 13.9 mt -138.15 150.94 24.74 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.142 -0.481 . . . . 74.049999999999997 111.156 179.944 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 39.1 m -120.89 115.17 22.71 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.18 -0.464 . . . . 71.409999999999997 111.124 179.942 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . 0.569 HD23 ' CD1' ' A' ' 83' ' ' PHE . 19.2 mt -90.95 110.77 22.02 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.192 -0.458 . . . . 74.430000000000007 110.944 179.96 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 9.1 t60 -100.92 114.52 28.46 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.21 -0.45 . . . . 74.329999999999998 110.855 179.892 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 68' ' ' PHE . . . . . 0.513 ' CE1' HG23 ' A' ' 114' ' ' ILE . 0.0 OUTLIER -105.17 141.13 37.26 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.195 -0.457 . . . . 73.400000000000006 110.885 -179.953 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -120.5 117.14 26.89 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.133 -0.485 . . . . 64.310000000000002 111.066 179.94 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 70' ' ' MET . . . . . 0.413 ' HE2' ' CG1' ' A' ' 114' ' ' ILE . 1.4 mmt -84.11 93.72 8.19 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.192 -0.458 . . . . 75.129999999999995 110.881 179.986 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -51.13 159.2 1.08 Allowed Pre-proline 0 C--N 1.329 -0.283 0 CA-C-O 121.582 0.706 . . . . 73.010000000000005 111.154 -179.922 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.72 -4.5 14.12 Favored 'Trans proline' 0 C--O 1.231 0.174 0 C-N-CA 122.711 2.274 . . . . 74.209999999999994 112.339 179.973 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 73' ' ' MET . . . . . 0.476 ' O ' ' CB ' ' A' ' 76' ' ' TYR . 0.0 OUTLIER -109.28 -24.21 11.2 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.203 -0.453 . . . . 72.299999999999997 110.852 179.942 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 74' ' ' TYR . . . . . 0.651 ' CD1' ' C ' ' A' ' 74' ' ' TYR . 0.0 OUTLIER -48.29 150.75 2.1 Favored Pre-proline 0 C--N 1.328 -0.342 0 CA-C-O 121.688 0.756 . . . . 74.430000000000007 110.931 -179.859 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 75' ' ' PRO . . . . . 0.562 ' HA ' ' CD2' ' A' ' 74' ' ' TYR . 54.2 Cg_endo -69.72 -11.69 11.89 Favored 'Cis proline' 0 C--N 1.341 0.171 0 C-N-CA 122.698 -1.792 . . . . 73.439999999999998 112.367 -0.124 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 76' ' ' TYR . . . . . 0.476 ' CB ' ' O ' ' A' ' 73' ' ' MET . 10.4 t80 -35.27 -52.88 0.62 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.221 -0.445 . . . . 64.010000000000005 110.969 -179.943 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 53.2 p -101.39 175.3 5.62 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.087 -0.506 . . . . 75.510000000000005 111.139 -179.961 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -98.86 131.36 25.74 Favored Pre-proline 0 C--N 1.329 -0.288 0 CA-C-O 121.554 0.692 . . . . 75.310000000000002 111.079 179.884 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.77 176.84 6.23 Favored 'Trans proline' 0 C--N 1.341 0.171 0 C-N-CA 122.668 2.246 . . . . 74.109999999999999 112.369 179.957 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 2.0 tt0 -111.66 133.44 53.91 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.234 -0.439 . . . . 70.310000000000002 110.951 179.996 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 81' ' ' ILE . . . . . 0.443 ' CG2' HD21 ' A' ' 66' ' ' LEU . 10.0 mm -124.08 127.25 73.37 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.157 -0.474 . . . . 74.340000000000003 111.182 179.988 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . 0.467 ' HG3' ' CD ' ' A' ' 84' ' ' LYS . 7.3 pt-20 -135.07 142.13 46.24 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.22 -0.445 . . . . 74.140000000000001 110.902 179.975 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 83' ' ' PHE . . . . . 0.569 ' CD1' HD23 ' A' ' 66' ' ' LEU . 31.1 m-85 -93.23 140.88 29.04 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.165 -0.471 . . . . 72.400000000000006 110.839 -179.884 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 84' ' ' LYS . . . . . 0.472 ' O ' ' N ' ' A' ' 86' ' ' VAL . 9.7 mmmt -123.66 170.36 10.55 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.137 -0.483 . . . . 74.400000000000006 110.936 179.964 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 85' ' ' ASN . . . . . 0.452 ' C ' HG22 ' A' ' 86' ' ' VAL . 2.7 m-80 62.92 -73.38 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.22 -0.446 . . . . 73.310000000000002 110.891 179.946 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 86' ' ' VAL . . . . . 0.472 ' N ' ' O ' ' A' ' 84' ' ' LYS . 6.4 m 34.94 90.67 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.131 -0.486 . . . . 75.099999999999994 111.166 179.942 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -101.92 -84.74 0.44 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.17 -0.468 . . . . 72.400000000000006 110.911 -179.954 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 88' ' ' ASN . . . . . 0.47 ' ND2' ' HB ' ' A' ' 60' ' ' VAL . 27.8 m120 -49.5 -40.21 36.72 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.185 -0.461 . . . . 74.349999999999994 110.856 -179.913 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 2.4 p -68.17 139.08 21.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.167 -0.47 . . . . 71.420000000000002 111.119 179.909 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 90' ' ' MET . . . . . . . . . . . . . 5.4 mtm -87.22 -67.43 0.82 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.155 -0.475 . . . . 74.019999999999996 110.892 179.91 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -178.77 -30.44 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.21 -0.45 . . . . 73.329999999999998 110.832 179.954 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -53.79 -42.72 68.63 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.198 -0.456 . . . . 74.510000000000005 110.861 -179.775 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -69.92 -40.11 75.73 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.136 -0.484 . . . . 73.450000000000003 110.94 -179.985 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . 0.466 ' CD2' HG12 ' A' ' 86' ' ' VAL . 0.1 OUTLIER -59.52 -46.3 89.26 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.208 -0.451 . . . . 64.329999999999998 110.95 179.997 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 9.9 mm-40 -64.89 -38.88 92.45 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.129 -0.487 . . . . 75.140000000000001 110.951 179.907 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 96' ' ' MET . . . . . 0.561 ' SD ' ' CE1' ' A' ' 128' ' ' PHE . 19.8 ttp -61.06 -36.96 80.99 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.178 -0.465 . . . . 72.420000000000002 110.856 179.965 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 97' ' ' LEU . . . . . 0.591 ' O ' ' CD1' ' A' ' 101' ' ' PHE . 90.3 mt -62.2 -42.45 99.3 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.221 -0.445 . . . . 75.439999999999998 110.902 -179.942 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 98' ' ' LYS . . . . . 0.567 ' HA ' ' CD2' ' A' ' 101' ' ' PHE . 13.2 mmtm -54.86 -44.56 74.11 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.181 -0.463 . . . . 72.319999999999993 110.872 179.845 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 66.3 m -57.63 -39.23 76.5 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.253 -0.43 . . . . 60.130000000000003 110.836 -179.897 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 3.6 mm-40 -71.36 -26.67 62.9 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.177 -0.465 . . . . 72.400000000000006 110.879 -179.928 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 101' ' ' PHE . . . . . 0.591 ' CD1' ' O ' ' A' ' 97' ' ' LEU . 8.7 m-30 -59.38 -30.36 68.37 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.147 -0.479 . . . . 74.140000000000001 110.937 -179.963 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 1.4 tmpt? -71.56 -40.76 69.77 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.113 -0.494 . . . . 75.530000000000001 110.882 179.98 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 3.2 tmmm? -70.35 -43.25 70.57 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.227 -0.442 . . . . 70.329999999999998 110.88 179.913 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 3.0 mt -62.36 -47.5 92.74 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.202 -0.454 . . . . 74.150000000000006 111.159 179.861 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 105' ' ' HIS . . . . . 0.409 ' O ' ' N ' ' A' ' 109' ' ' ARG . 14.4 t-80 -62.53 -41.78 99.09 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.151 -0.477 . . . . 74.319999999999993 110.874 179.851 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 1.1 t-20 -58.03 -42.35 85.13 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.218 -0.446 . . . . 73.340000000000003 110.902 -179.978 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 8.0 t -77.95 -35.55 50.24 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.157 -0.474 . . . . 71.319999999999993 111.159 -179.996 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 19.8 m -103.97 29.96 5.51 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.21 -0.45 . . . . 73.329999999999998 110.865 -179.871 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 109' ' ' ARG . . . . . 0.409 ' N ' ' O ' ' A' ' 105' ' ' HIS . 26.1 ttt180 -72.13 80.64 0.96 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.133 -0.485 . . . . 75.549999999999997 110.872 -179.956 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 141.15 -9.23 2.72 Favored Glycine 0 N--CA 1.452 -0.254 0 C-N-CA 120.699 -0.763 . . . . 73.400000000000006 112.477 -179.971 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 111' ' ' GLN . . . . . . . . . . . . . 9.2 pt20 -126.44 -161.68 1.08 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.761 0.315 . . . . 52.219999999999999 110.921 -179.873 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 33.7 mt-10 -70.86 134.22 47.12 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.219 -0.446 . . . . 72.530000000000001 110.862 -179.95 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 113' ' ' ILE . . . . . . . . . . . . . 31.1 pt -126.65 -11.31 4.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.149 -0.478 . . . . 73.299999999999997 111.161 179.972 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 114' ' ' ILE . . . . . 0.513 HG23 ' CE1' ' A' ' 68' ' ' PHE . 33.7 mm -61.87 -45.72 98.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.156 -0.475 . . . . 75.519999999999996 111.136 179.855 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 115' ' ' PHE . . . . . . . . . . . . . 13.1 t80 -72.51 -32.65 66.32 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.171 -0.468 . . . . 74.439999999999998 110.932 179.9 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 42.9 mm-40 -67.45 -47.65 69.53 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.105 -0.498 . . . . 74.450000000000003 110.901 -179.971 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 117' ' ' ILE . . . . . 0.523 HD11 ' CG ' ' A' ' 101' ' ' PHE . 0.8 OUTLIER -64.15 -41.92 93.95 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.142 -0.481 . . . . 71.430000000000007 111.111 179.979 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 118' ' ' THR . . . . . 0.478 ' N ' ' CG2' ' A' ' 117' ' ' ILE . 46.7 p -67.85 -42.43 81.37 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.201 -0.454 . . . . 72.319999999999993 111.158 179.958 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 6.8 m -66.14 -43.96 85.54 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.245 -0.434 . . . . 75.25 110.838 -179.842 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -62.11 -49.97 73.8 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.161 -0.472 . . . . 73.329999999999998 110.883 -179.979 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 53.5 p -63.28 -39.3 94.21 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.141 -0.481 . . . . 65.150000000000006 111.169 -179.96 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -64.49 -46.33 83.49 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.201 -0.454 . . . . 73.25 110.945 179.999 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 4.8 pt-20 -70.99 -38.19 72.71 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.219 -0.446 . . . . 73.450000000000003 110.842 -179.968 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 124' ' ' LYS . . . . . 0.439 ' CE ' ' HA ' ' A' ' 124' ' ' LYS . 0.2 OUTLIER -74.51 -29.93 61.59 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.218 -0.446 . . . . 74.530000000000001 110.902 -179.999 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -68.34 -46.36 70.38 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.221 -0.445 . . . . 74.340000000000003 110.92 179.945 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 6.4 m-20 -59.84 -37.43 79.23 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.214 -0.448 . . . . 70.239999999999995 110.85 179.819 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 3.0 mm-40 -60.41 -49.74 76.36 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.198 -0.455 . . . . 74.519999999999996 110.947 -179.931 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 128' ' ' PHE . . . . . 0.561 ' CE1' ' SD ' ' A' ' 96' ' ' MET . 11.3 m-85 . . . . . 0 C--N 1.329 -0.323 0 CA-C-N 116.124 -0.489 . . . . 73.099999999999994 110.856 -179.949 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 44.2 mt . . . . . 0 C--O 1.232 0.148 0 CA-C-O 120.817 0.341 . . . . 74.510000000000005 110.93 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -49.96 -30.6 10.72 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.217 -0.447 . . . . 73.140000000000001 110.847 179.863 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 5.1 mm100 -68.09 -40.01 82.72 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.213 -0.449 . . . . 73.049999999999997 110.884 -179.902 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 22.8 m-85 -61.9 -26.95 68.47 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.197 -0.456 . . . . 74.430000000000007 110.88 -179.805 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -58.96 -37.66 77.28 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.158 -0.474 . . . . 72.109999999999999 110.937 -179.958 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 2.2 mm-40 -63.07 -42.9 99.78 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.167 -0.47 . . . . 71.310000000000002 110.877 -179.97 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 3.8 mp -65.92 -41.99 91.03 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.163 -0.471 . . . . 75.230000000000004 111.126 179.989 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 47.5 mt-30 -65.42 -44.02 88.68 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.199 -0.455 . . . . 75.109999999999999 110.897 179.944 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 1.7 t -62.35 -38.29 88.93 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.203 -0.453 . . . . 75.150000000000006 110.924 -179.952 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 1.6 m-20 -58.08 -33.9 69.56 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.126 -0.488 . . . . 75.299999999999997 110.896 -179.921 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 4.1 mt-10 -67.14 -39.1 86.51 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.165 -0.471 . . . . 75.140000000000001 110.859 -179.946 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . 0.415 ' CD2' HG13 ' A' ' 46' ' ' ILE . 8.7 mp -63.87 -51.25 65.48 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.203 -0.453 . . . . 63.229999999999997 110.869 -179.941 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -68.51 -35.84 78.04 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.184 -0.462 . . . . 73.329999999999998 110.886 179.938 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -66.64 -50.36 63.21 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.133 -0.485 . . . . 74.430000000000007 111.137 179.907 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . 0.467 ' N ' HD13 ' A' ' 22' ' ' ILE . 0.8 OUTLIER -73.12 -34.67 45.73 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.235 -0.439 . . . . 75.310000000000002 111.132 179.927 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -52.8 -35.46 56.91 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.17 -0.468 . . . . 64.109999999999999 110.891 179.977 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 53.3 p -67.18 -31.44 71.84 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.155 -0.475 . . . . 72.219999999999999 110.855 -179.782 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . 0.559 HD11 ' CE1' ' A' ' 115' ' ' PHE . 3.5 mt -83.84 -44.16 18.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.134 -0.484 . . . . 75.439999999999998 111.119 179.954 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' TYR . . . . . 0.437 ' CE2' HG21 ' A' ' 50' ' ' ILE . 19.8 m-85 -106.7 45.68 0.97 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.174 -0.466 . . . . 72.319999999999993 110.941 -179.982 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER -46.7 -54.88 8.73 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.117 -0.492 . . . . 74.519999999999996 110.9 179.919 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -96.49 -11.79 25.06 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.198 -0.456 . . . . 75.430000000000007 110.882 179.975 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -101.86 25.79 8.23 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.2 -0.454 . . . . 75.510000000000005 110.875 179.99 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 3.9 t80 -111.41 134.65 52.84 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.205 -0.452 . . . . 74.129999999999995 110.865 -179.9 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 24.2 m -110.7 132.46 54.18 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.138 -0.483 . . . . 70.299999999999997 111.175 -179.947 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -95.73 114.28 26.0 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.228 -0.442 . . . . 75.019999999999996 110.89 179.936 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . 0.546 ' CD1' ' C ' ' A' ' 33' ' ' LEU . 0.2 OUTLIER -124.95 -0.13 7.92 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.174 -0.467 . . . . 62.200000000000003 110.88 -179.891 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 34' ' ' THR . . . . . 0.439 ' N ' HD13 ' A' ' 33' ' ' LEU . 1.4 m . . . . . 0 C--N 1.33 -0.261 0 CA-C-N 116.187 -0.461 . . . . 71.400000000000006 111.151 179.915 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 45' ' ' GLN . . . . . 0.458 ' O ' ' CB ' ' A' ' 46' ' ' ILE . 24.3 tt0 . . . . . 0 C--O 1.231 0.12 0 CA-C-O 120.76 0.314 . . . . 74.140000000000001 110.937 . . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 46' ' ' ILE . . . . . 0.476 HG22 ' N ' ' A' ' 47' ' ' ILE . 0.0 OUTLIER 82.43 -34.19 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.179 -0.464 . . . . 74.310000000000002 111.166 179.978 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . 0.496 HD11 ' N ' ' A' ' 47' ' ' ILE . 0.2 OUTLIER -34.94 148.66 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.181 -0.463 . . . . 61.240000000000002 111.101 179.843 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 48' ' ' PHE . . . . . 0.456 ' HA ' ' CD1' ' A' ' 33' ' ' LEU . 14.3 p90 -159.43 158.0 31.25 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.165 -0.47 . . . . 63.399999999999999 110.909 179.889 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . 0.473 ' CG ' ' HB2' ' A' ' 67' ' ' HIS . 5.7 mt-10 -109.61 160.74 16.01 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.157 -0.474 . . . . 75.040000000000006 110.94 -179.949 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . 0.437 HG21 ' CE2' ' A' ' 26' ' ' TYR . 19.0 mm -137.61 139.04 43.93 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 116.148 -0.478 . . . . 75.310000000000002 111.161 179.987 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 24.1 m -85.26 117.07 23.98 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.186 -0.461 . . . . 75.099999999999994 111.134 179.979 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 17.1 mt -121.59 161.08 23.03 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.234 -0.439 . . . . 75.129999999999995 110.939 179.932 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -177.51 178.79 1.0 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.23 -0.441 . . . . 70.349999999999994 110.915 179.906 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -64.89 175.48 1.5 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.201 -0.454 . . . . 74.209999999999994 110.85 -179.75 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 16.4 m -80.69 -29.45 11.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.155 -0.475 . . . . 70.200000000000003 111.081 179.962 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 1.7 t0 -117.02 -169.13 1.59 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.201 -0.454 . . . . 43.530000000000001 110.901 179.954 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . 0.472 ' CD ' ' N ' ' A' ' 57' ' ' LYS . 0.0 OUTLIER -117.55 -12.62 10.34 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.257 -0.429 . . . . 73.140000000000001 110.88 -179.985 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . 0.531 ' HA ' ' C ' ' A' ' 59' ' ' PRO . 9.8 pt-20 -126.06 150.98 71.0 Favored Pre-proline 0 C--N 1.329 -0.294 0 CA-C-O 121.639 0.733 . . . . 73.420000000000002 110.924 179.895 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 59' ' ' PRO . . . . . 0.531 ' C ' ' HA ' ' A' ' 58' ' ' GLU . 53.7 Cg_endo -69.77 -5.94 9.17 Favored 'Cis proline' 0 C--N 1.342 0.191 0 C-N-CA 122.686 -1.798 . . . . 75.230000000000004 112.349 0.041 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 33.4 m -140.75 172.32 11.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.25 -0.432 . . . . 74.200000000000003 111.165 179.93 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . 0.447 ' O ' ' C ' ' A' ' 62' ' ' SER . 5.4 tt0 -102.45 -21.97 14.14 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.163 -0.471 . . . . 74.430000000000007 110.86 -179.979 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 62' ' ' SER . . . . . 0.447 ' C ' ' O ' ' A' ' 61' ' ' GLU . 41.7 m 34.0 90.78 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.181 -0.463 . . . . 55.009999999999998 110.889 -179.784 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 10.4 p -118.61 123.05 44.04 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.124 -0.489 . . . . 64.209999999999994 110.869 -179.836 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 64' ' ' ILE . . . . . 0.457 HD13 ' CG2' ' A' ' 89' ' ' VAL . 30.1 mt -133.05 139.31 49.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.093 -0.503 . . . . 75.319999999999993 111.125 179.976 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 65' ' ' THR . . . . . 0.45 ' N ' HG22 ' A' ' 64' ' ' ILE . 20.4 m -104.53 116.87 32.85 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.176 -0.465 . . . . 74.150000000000006 111.157 179.959 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . 0.556 ' HB3' ' CE2' ' A' ' 68' ' ' PHE . 1.4 mp -94.48 109.97 21.81 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.247 -0.433 . . . . 75.409999999999997 110.915 179.977 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 67' ' ' HIS . . . . . 0.485 ' CE1' HD21 ' A' ' 33' ' ' LEU . 1.9 t60 -97.4 109.96 22.61 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.18 -0.464 . . . . 73.140000000000001 110.833 179.875 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 68' ' ' PHE . . . . . 0.556 ' CE2' ' HB3' ' A' ' 66' ' ' LEU . 0.0 OUTLIER -105.11 139.97 38.98 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.206 -0.452 . . . . 73.5 110.839 -179.896 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -123.87 128.39 49.42 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.148 -0.478 . . . . 64.519999999999996 111.07 179.943 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 70' ' ' MET . . . . . 0.425 ' CE ' ' CD1' ' A' ' 114' ' ' ILE . 0.0 OUTLIER -96.32 103.42 15.32 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.23 -0.441 . . . . 65.329999999999998 110.882 179.953 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -57.33 161.17 5.82 Favored Pre-proline 0 C--N 1.33 -0.272 0 CA-C-O 121.564 0.697 . . . . 72.519999999999996 111.134 -179.935 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.8 -4.19 13.55 Favored 'Trans proline' 0 C--N 1.342 0.195 0 C-N-CA 122.692 2.261 . . . . 75.140000000000001 112.346 179.93 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 73' ' ' MET . . . . . 0.5 ' O ' ' CB ' ' A' ' 76' ' ' TYR . 0.0 OUTLIER -111.85 -24.26 10.09 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.199 -0.455 . . . . 74.319999999999993 110.891 179.92 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 74' ' ' TYR . . . . . 0.635 ' CD1' ' C ' ' A' ' 74' ' ' TYR . 0.0 OUTLIER -47.98 149.9 2.25 Favored Pre-proline 0 C--N 1.329 -0.319 0 CA-C-O 121.638 0.732 . . . . 75.439999999999998 110.924 -179.865 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 75' ' ' PRO . . . . . 0.559 ' HA ' ' CD2' ' A' ' 74' ' ' TYR . 53.7 Cg_endo -69.79 -12.34 12.22 Favored 'Cis proline' 0 C--N 1.341 0.165 0 C-N-CA 122.696 -1.793 . . . . 75.120000000000005 112.302 -0.041 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 76' ' ' TYR . . . . . 0.5 ' CB ' ' O ' ' A' ' 73' ' ' MET . 9.4 t80 -33.95 -47.31 0.26 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.264 -0.425 . . . . 72.040000000000006 110.934 -179.925 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 72.0 p -105.8 179.68 4.2 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.121 -0.491 . . . . 70.319999999999993 111.105 -179.964 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -100.74 129.95 26.44 Favored Pre-proline 0 C--N 1.329 -0.309 0 CA-C-O 121.638 0.733 . . . . 75.030000000000001 111.108 179.84 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 79' ' ' PRO . . . . . 0.417 ' HG3' ' CD1' ' A' ' 113' ' ' ILE . 53.9 Cg_endo -69.75 -175.18 1.07 Allowed 'Trans proline' 0 C--N 1.342 0.203 0 C-N-CA 122.685 2.256 . . . . 72.310000000000002 112.353 179.992 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . 0.411 ' HG3' ' N ' ' A' ' 81' ' ' ILE . 0.4 OUTLIER -124.18 141.2 52.26 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.26 -0.427 . . . . 73.230000000000004 110.871 -179.981 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 81' ' ' ILE . . . . . 0.411 ' N ' ' HG3' ' A' ' 80' ' ' GLU . 8.0 mm -133.02 143.89 38.12 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.141 -0.481 . . . . 74.409999999999997 111.096 179.983 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . 0.497 ' HG3' ' CD ' ' A' ' 84' ' ' LYS . 4.4 pt-20 -149.02 143.65 26.22 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.156 -0.475 . . . . 70.430000000000007 110.916 179.906 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 83' ' ' PHE . . . . . 0.564 ' CE1' HD13 ' A' ' 97' ' ' LEU . 10.3 m-85 -96.21 136.85 36.13 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.167 -0.469 . . . . 74.310000000000002 110.898 -179.904 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 84' ' ' LYS . . . . . 0.497 ' CD ' ' HG3' ' A' ' 82' ' ' GLU . 12.8 mmmt -123.99 169.02 12.05 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.201 -0.454 . . . . 73.329999999999998 110.941 179.964 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 85' ' ' ASN . . . . . 0.56 ' N ' HD21 ' A' ' 85' ' ' ASN . 1.0 OUTLIER 64.26 -72.46 0.06 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.249 -0.432 . . . . 74.540000000000006 110.888 179.942 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 86' ' ' VAL . . . . . 0.455 ' C ' ' O ' ' A' ' 85' ' ' ASN . 6.8 m 33.76 90.84 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.18 -0.464 . . . . 74.140000000000001 111.101 179.904 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -99.95 -53.65 3.1 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.173 -0.467 . . . . 71.209999999999994 110.934 179.995 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 20.9 t30 -85.4 20.88 1.89 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.206 -0.452 . . . . 63.340000000000003 110.866 -179.954 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 89' ' ' VAL . . . . . 0.457 ' CG2' HD13 ' A' ' 64' ' ' ILE . 2.8 t -130.81 154.62 40.96 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.175 -0.466 . . . . 74.319999999999993 111.133 179.918 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 90' ' ' MET . . . . . . . . . . . . . 3.0 mtm -108.31 -69.44 0.85 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.19 -0.459 . . . . 73.310000000000002 110.933 179.874 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 9.8 p-10 -170.82 -33.41 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.183 -0.462 . . . . 72.310000000000002 110.88 179.959 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 4.1 m -54.34 -46.47 72.93 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.197 -0.456 . . . . 74.230000000000004 110.869 -179.788 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 93' ' ' GLN . . . . . 0.424 ' HB2' ' CG1' ' A' ' 89' ' ' VAL . 4.1 mp0 -68.74 -38.78 80.39 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.131 -0.486 . . . . 74.349999999999994 110.897 -179.942 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 8.2 mp -57.86 -49.16 77.63 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.185 -0.461 . . . . 74.439999999999998 110.931 179.977 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 74.2 mt-30 -66.08 -37.33 85.53 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.144 -0.48 . . . . 74.140000000000001 110.9 179.956 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 96' ' ' MET . . . . . . . . . . . . . 32.8 ttp -59.76 -41.27 90.66 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.205 -0.452 . . . . 74.209999999999994 110.884 179.958 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 97' ' ' LEU . . . . . 0.564 HD13 ' CE1' ' A' ' 83' ' ' PHE . 87.6 mt -61.76 -44.8 96.18 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.21 -0.45 . . . . 75.129999999999995 110.945 -179.982 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 98' ' ' LYS . . . . . 0.472 ' HA ' ' CD2' ' A' ' 101' ' ' PHE . 5.5 mmtp -58.47 -34.98 71.48 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.169 -0.469 . . . . 74.239999999999995 110.893 179.81 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -63.89 -42.76 97.4 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.183 -0.462 . . . . 74.219999999999999 110.86 -179.847 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 69.5 mm-40 -71.0 -24.56 62.41 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.114 -0.494 . . . . 73.540000000000006 110.837 -179.948 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 101' ' ' PHE . . . . . 0.564 ' CD1' ' O ' ' A' ' 97' ' ' LEU . 10.5 m-30 -59.57 -38.23 80.61 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.146 -0.479 . . . . 75.519999999999996 110.864 -179.905 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.28 -44.0 95.72 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.166 -0.47 . . . . 75.019999999999996 110.867 -179.988 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -67.36 -42.88 82.73 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.247 -0.433 . . . . 74.439999999999998 110.888 179.881 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 104' ' ' ILE . . . . . 0.479 HD11 ' CG ' ' A' ' 120' ' ' PHE . 3.4 mt -61.82 -47.68 92.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.245 -0.434 . . . . 73.120000000000005 111.158 179.855 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 105' ' ' HIS . . . . . 0.454 ' O ' ' N ' ' A' ' 109' ' ' ARG . 64.6 t-80 -62.97 -41.2 99.47 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.135 -0.484 . . . . 65.150000000000006 110.888 179.864 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 1.4 m-80 -56.82 -40.47 76.06 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.199 -0.455 . . . . 73.530000000000001 110.87 -179.941 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 107' ' ' THR . . . . . 0.413 ' CG2' ' O ' ' A' ' 104' ' ' ILE . 5.2 t -81.26 -26.31 35.88 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.212 -0.449 . . . . 74.409999999999997 111.112 -179.971 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 39.3 p -111.31 26.84 10.26 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.251 -0.431 . . . . 64.219999999999999 110.848 -179.813 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 109' ' ' ARG . . . . . 0.454 ' N ' ' O ' ' A' ' 105' ' ' HIS . 13.4 ttt-85 -68.34 76.55 0.26 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.154 -0.476 . . . . 75.310000000000002 110.868 -179.928 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 145.09 -20.22 1.94 Allowed Glycine 0 N--CA 1.451 -0.343 0 C-N-CA 120.78 -0.724 . . . . 72.019999999999996 112.501 -179.986 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 111' ' ' GLN . . . . . . . . . . . . . 7.3 pt20 -114.54 -170.2 1.69 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.749 0.309 . . . . 74.420000000000002 110.91 -179.877 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 32.8 mt-10 -62.3 128.92 38.34 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.204 -0.453 . . . . 75.420000000000002 110.874 -179.962 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 113' ' ' ILE . . . . . 0.417 ' CD1' ' HG3' ' A' ' 79' ' ' PRO . 21.2 pt -120.67 -15.08 7.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.133 -0.485 . . . . 73.439999999999998 111.098 179.999 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 114' ' ' ILE . . . . . 0.494 ' O ' ' CG2' ' A' ' 118' ' ' THR . 35.0 mm -60.11 -43.64 93.33 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.175 -0.466 . . . . 74.310000000000002 111.166 179.816 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 115' ' ' PHE . . . . . 0.559 ' CE1' HD11 ' A' ' 25' ' ' ILE . 22.0 t80 -72.31 -35.35 68.61 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.176 -0.465 . . . . 65.340000000000003 110.925 179.929 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 56.6 mm-40 -67.89 -47.62 68.3 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.096 -0.502 . . . . 74.430000000000007 110.929 -179.97 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 117' ' ' ILE . . . . . 0.562 HD12 ' CD2' ' A' ' 101' ' ' PHE . 1.1 tt -64.27 -40.45 89.11 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.133 -0.485 . . . . 74.299999999999997 111.15 179.947 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 118' ' ' THR . . . . . 0.494 ' CG2' ' O ' ' A' ' 114' ' ' ILE . 62.5 p -67.43 -43.38 81.32 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.181 -0.463 . . . . 74.019999999999996 111.149 179.978 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 1.7 t -67.83 -32.02 72.27 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.189 -0.459 . . . . 70.010000000000005 110.841 -179.867 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 120' ' ' PHE . . . . . 0.479 ' CG ' HD11 ' A' ' 104' ' ' ILE . 0.4 OUTLIER -76.01 -39.64 55.32 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.155 -0.475 . . . . 75.5 110.893 -179.932 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 121' ' ' THR . . . . . 0.437 ' CG2' HD23 ' A' ' 66' ' ' LEU . 14.8 p -69.36 -41.65 76.29 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.14 -0.482 . . . . 75.510000000000005 111.134 -179.933 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 122' ' ' GLN . . . . . 0.442 ' CG ' ' N ' ' A' ' 123' ' ' GLU . 9.0 pt20 -68.25 -46.97 69.01 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.227 -0.442 . . . . 75.510000000000005 110.904 -179.976 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 123' ' ' GLU . . . . . 0.442 ' N ' ' CG ' ' A' ' 122' ' ' GLN . 5.7 pt-20 -60.36 -36.61 78.41 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.197 -0.456 . . . . 73.25 110.869 -179.916 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 124' ' ' LYS . . . . . 0.457 ' CE ' ' HA ' ' A' ' 124' ' ' LYS . 0.0 OUTLIER -77.03 -38.54 52.62 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.146 -0.479 . . . . 74.420000000000002 110.921 179.969 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 125' ' ' LEU . . . . . 0.412 ' CD1' ' HB3' ' A' ' 62' ' ' SER . 2.3 tp -67.69 -43.2 80.69 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.203 -0.453 . . . . 74.420000000000002 110.938 179.927 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -63.19 -43.13 99.08 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.157 -0.474 . . . . 75.120000000000005 110.836 179.875 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 127' ' ' GLU . . . . . 0.457 ' HG3' ' N ' ' A' ' 128' ' ' PHE . 0.0 OUTLIER -67.22 -29.25 68.86 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.208 -0.451 . . . . 73.530000000000001 110.915 -179.912 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 128' ' ' PHE . . . . . 0.457 ' N ' ' HG3' ' A' ' 127' ' ' GLU . 0.2 OUTLIER . . . . . 0 C--N 1.329 -0.285 0 CA-C-N 116.117 -0.492 . . . . 73.439999999999998 110.916 -179.966 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 36.6 mt . . . . . 0 C--O 1.231 0.083 0 CA-C-O 120.847 0.356 . . . . 75.430000000000007 110.965 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 33.6 t70 -54.89 -30.04 57.14 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.191 -0.459 . . . . 72.439999999999998 110.819 179.843 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . 0.406 ' HA ' ' NE2' ' A' ' 10' ' ' GLN . 4.2 mm-40 -66.27 -33.81 76.59 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.207 -0.451 . . . . 73.120000000000005 110.916 -179.915 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' TYR . . . . . 0.543 ' CE1' ' HD2' ' A' ' 75' ' ' PRO . 14.1 m-85 -64.37 -26.93 68.68 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.211 -0.45 . . . . 74.120000000000005 110.904 -179.864 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -59.58 -37.01 77.39 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.15 -0.477 . . . . 75.109999999999999 110.899 -179.854 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 2.9 mm-40 -61.45 -45.94 92.17 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.152 -0.476 . . . . 74.239999999999995 110.92 179.976 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 4.9 mp -67.79 -45.05 85.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.141 -0.481 . . . . 75.209999999999994 111.163 179.945 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . 0.498 ' NE2' ' O ' ' A' ' 71' ' ' THR . 86.8 mt-30 -61.29 -45.36 94.8 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.124 -0.489 . . . . 74.310000000000002 110.907 179.966 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 2.8 t -61.18 -41.92 97.64 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.182 -0.463 . . . . 75.510000000000005 110.891 -179.941 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 2.5 m-20 -57.63 -33.51 68.34 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.196 -0.456 . . . . 74.099999999999994 110.913 -179.919 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . 0.417 ' HG2' ' CD1' ' A' ' 114' ' ' ILE . 2.9 mt-10 -65.51 -41.2 93.45 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.181 -0.463 . . . . 75.409999999999997 110.897 179.987 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . 0.563 HD13 ' CD1' ' A' ' 48' ' ' PHE . 8.9 mp -61.74 -51.84 66.72 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.109 -0.496 . . . . 74.150000000000006 110.921 -179.958 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -68.85 -37.41 79.11 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.192 -0.458 . . . . 74.25 110.901 179.912 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -61.01 -50.58 72.77 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.162 -0.472 . . . . 50.310000000000002 111.109 179.916 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . 0.465 HD11 ' N ' ' A' ' 22' ' ' ILE . 0.6 OUTLIER -75.0 -36.09 37.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.236 -0.438 . . . . 73.299999999999997 111.168 179.968 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 18.7 mtp180 -52.63 -34.22 50.3 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.16 -0.473 . . . . 74.230000000000004 110.858 179.973 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -66.29 -33.55 75.99 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.219 -0.446 . . . . 65.109999999999999 110.847 -179.782 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . 0.565 HD13 ' CE1' ' A' ' 115' ' ' PHE . 3.3 mt -81.71 -44.9 20.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.12 -0.491 . . . . 73.219999999999999 111.139 179.97 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 21.4 m-85 -109.01 46.03 1.0 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.182 -0.463 . . . . 74.120000000000005 110.883 -179.948 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 3.2 mtm -41.7 -59.32 1.69 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.138 -0.483 . . . . 71.549999999999997 110.902 179.895 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 1.5 t70 -84.38 -25.12 29.35 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.197 -0.456 . . . . 73.129999999999995 110.834 179.968 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -85.38 30.75 0.6 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.234 -0.439 . . . . 73.420000000000002 110.851 -179.998 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 6.0 t80 -117.14 139.47 50.7 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.205 -0.452 . . . . 73.430000000000007 110.835 -179.879 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 60.5 m -118.33 135.12 54.5 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.092 -0.504 . . . . 64.200000000000003 111.168 -179.916 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 12.6 t70 -99.92 117.17 33.66 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.256 -0.429 . . . . 75.310000000000002 110.891 179.872 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . 0.492 ' CD2' ' HA ' ' A' ' 48' ' ' PHE . 1.2 pt? -118.58 -28.69 5.61 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.182 -0.463 . . . . 73.409999999999997 110.935 -179.98 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 34' ' ' THR . . . . . 0.418 ' N ' HD22 ' A' ' 33' ' ' LEU . 0.2 OUTLIER . . . . . 0 C--N 1.33 -0.251 0 CA-C-N 116.209 -0.45 . . . . 72.239999999999995 111.128 179.957 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 45' ' ' GLN . . . . . 0.407 ' O ' ' CB ' ' A' ' 46' ' ' ILE . 11.7 tt0 . . . . . 0 C--O 1.231 0.126 0 CA-C-O 120.758 0.313 . . . . 74.230000000000004 110.911 . . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 46' ' ' ILE . . . . . 0.407 ' CB ' ' O ' ' A' ' 45' ' ' GLN . 0.0 OUTLIER 78.71 -7.87 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.225 -0.443 . . . . 75.129999999999995 111.132 179.976 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . 0.48 HG22 ' CB ' ' A' ' 69' ' ' ALA . 0.2 OUTLIER -53.12 147.1 2.27 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.18 -0.464 . . . . 73.239999999999995 111.119 179.829 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 48' ' ' PHE . . . . . 0.563 ' CD1' HD13 ' A' ' 19' ' ' LEU . 25.6 p90 -153.06 153.03 32.03 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.178 -0.464 . . . . 73.049999999999997 110.878 179.954 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 12.4 mt-10 -108.36 150.83 26.82 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.158 -0.474 . . . . 73.409999999999997 110.904 -179.954 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . 0.429 HG23 ' N ' ' A' ' 51' ' ' THR . 11.5 mm -132.43 138.58 51.89 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.127 -0.488 . . . . 74.129999999999995 111.145 -179.991 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 51' ' ' THR . . . . . 0.429 ' N ' HG23 ' A' ' 50' ' ' ILE . 96.8 m -85.86 127.36 34.56 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.177 -0.465 . . . . 70.239999999999995 111.141 179.984 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 17.7 mt -128.02 164.5 22.22 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.19 -0.459 . . . . 73.099999999999994 110.883 179.965 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -178.62 172.21 1.44 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.134 -0.484 . . . . 71.540000000000006 110.886 179.933 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -66.53 173.71 3.21 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.187 -0.461 . . . . 74.209999999999994 110.836 -179.798 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 29.0 m -85.22 -27.35 6.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.146 -0.479 . . . . 74.340000000000003 111.14 179.92 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -114.72 -172.7 2.17 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.13 -0.486 . . . . 73.420000000000002 110.859 179.938 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 4.1 mmmm -116.24 -22.4 8.88 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.177 -0.465 . . . . 73.140000000000001 110.897 179.979 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . 0.53 ' HA ' ' C ' ' A' ' 59' ' ' PRO . 1.5 pt-20 -113.06 143.05 28.41 Favored Pre-proline 0 C--N 1.329 -0.31 0 CA-C-O 121.701 0.762 . . . . 75.450000000000003 110.899 179.931 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 59' ' ' PRO . . . . . 0.53 ' C ' ' HA ' ' A' ' 58' ' ' GLU . 53.5 Cg_endo -69.79 -13.2 12.43 Favored 'Cis proline' 0 C--N 1.342 0.189 0 C-N-CA 122.624 -1.823 . . . . 72.439999999999998 112.31 0.033 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 60' ' ' VAL . . . . . 0.434 ' HB ' ' CG ' ' A' ' 88' ' ' ASN . 8.5 m -149.49 176.26 0.92 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.263 -0.426 . . . . 71.230000000000004 111.076 179.939 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . 0.458 ' O ' ' C ' ' A' ' 62' ' ' SER . 0.9 OUTLIER -112.46 -16.24 12.93 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.128 -0.487 . . . . 75.540000000000006 110.882 179.994 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 62' ' ' SER . . . . . 0.461 ' CB ' HD23 ' A' ' 125' ' ' LEU . 0.4 OUTLIER 33.67 91.12 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.174 -0.467 . . . . 72.349999999999994 110.849 -179.806 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 32.8 t -103.31 122.79 45.53 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.143 -0.48 . . . . 75.340000000000003 110.821 -179.803 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 64' ' ' ILE . . . . . . . . . . . . . 17.7 mt -137.19 143.05 35.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.164 -0.471 . . . . 72.439999999999998 111.121 179.937 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 15.4 m -107.84 115.03 29.4 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.207 -0.451 . . . . 75.120000000000005 111.13 179.945 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . 0.567 HD21 ' CE1' ' A' ' 83' ' ' PHE . 12.3 mt -91.02 110.14 21.4 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.218 -0.446 . . . . 75.420000000000002 110.88 179.962 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 8.7 t60 -100.78 114.64 28.6 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.191 -0.459 . . . . 72.150000000000006 110.866 179.849 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 68' ' ' PHE . . . . . 0.452 ' CE1' HG21 ' A' ' 114' ' ' ILE . 0.0 OUTLIER -103.66 139.79 38.46 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.254 -0.43 . . . . 75.219999999999999 110.909 -179.942 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 69' ' ' ALA . . . . . 0.48 ' CB ' HG22 ' A' ' 47' ' ' ILE . . . -120.04 120.81 37.37 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.182 -0.463 . . . . 73.239999999999995 111.131 179.933 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 70' ' ' MET . . . . . 0.497 ' HE1' ' CD1' ' A' ' 114' ' ' ILE . 12.6 mmt -85.45 104.3 15.12 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.241 -0.436 . . . . 72.150000000000006 110.875 179.995 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 71' ' ' THR . . . . . 0.498 ' O ' ' NE2' ' A' ' 15' ' ' GLN . 0.7 OUTLIER -59.93 158.12 26.83 Favored Pre-proline 0 C--N 1.329 -0.303 0 CA-C-O 121.593 0.711 . . . . 64.019999999999996 111.163 -179.938 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.76 1.05 4.78 Favored 'Trans proline' 0 C--N 1.342 0.213 0 C-N-CA 122.646 2.231 . . . . 55.549999999999997 112.356 179.94 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 73' ' ' MET . . . . . 0.479 ' O ' ' CB ' ' A' ' 76' ' ' TYR . 0.5 OUTLIER -116.67 -25.57 7.32 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.248 -0.433 . . . . 74.430000000000007 110.894 179.934 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 74' ' ' TYR . . . . . 0.62 ' CD1' ' C ' ' A' ' 74' ' ' TYR . 0.1 OUTLIER -46.6 147.61 2.02 Favored Pre-proline 0 C--N 1.329 -0.324 0 CA-C-O 121.664 0.745 . . . . 75.25 110.956 -179.933 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 75' ' ' PRO . . . . . 0.545 ' C ' ' HA ' ' A' ' 74' ' ' TYR . 53.4 Cg_endo -69.77 -14.86 12.55 Favored 'Cis proline' 0 C--N 1.342 0.184 0 C-N-CA 122.636 -1.818 . . . . 75.200000000000003 112.333 -0.049 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 76' ' ' TYR . . . . . 0.479 ' CB ' ' O ' ' A' ' 73' ' ' MET . 9.0 t80 -34.16 -45.33 0.21 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.202 -0.454 . . . . 72.219999999999999 110.938 -179.941 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 51.9 p -114.97 163.45 15.56 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.099 -0.5 . . . . 73.319999999999993 111.163 -179.976 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -85.7 132.64 43.72 Favored Pre-proline 0 C--N 1.329 -0.326 0 CA-C-O 121.585 0.707 . . . . 72.340000000000003 111.09 179.865 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 79' ' ' PRO . . . . . 0.44 ' HG3' ' CD1' ' A' ' 113' ' ' ILE . 54.0 Cg_endo -69.71 -170.72 0.41 Allowed 'Trans proline' 0 C--N 1.341 0.165 0 C-N-CA 122.714 2.276 . . . . 75.129999999999995 112.367 -179.993 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . 0.421 ' HG3' ' N ' ' A' ' 81' ' ' ILE . 0.3 OUTLIER -124.36 140.11 53.26 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.242 -0.435 . . . . 73.319999999999993 110.924 179.955 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 81' ' ' ILE . . . . . 0.421 ' N ' ' HG3' ' A' ' 80' ' ' GLU . 6.4 mm -130.42 137.07 57.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.127 -0.488 . . . . 64.519999999999996 111.152 179.957 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . 0.467 ' HG3' ' CD ' ' A' ' 84' ' ' LYS . 6.0 pt-20 -140.04 144.09 36.71 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.174 -0.466 . . . . 74.150000000000006 110.888 179.942 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 83' ' ' PHE . . . . . 0.567 ' CE1' HD21 ' A' ' 66' ' ' LEU . 58.6 m-85 -94.3 140.63 29.54 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.142 -0.481 . . . . 72.409999999999997 110.892 -179.918 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 84' ' ' LYS . . . . . 0.471 ' O ' ' N ' ' A' ' 86' ' ' VAL . 10.4 mmmt -124.2 169.62 11.55 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.172 -0.467 . . . . 72.120000000000005 110.904 179.932 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 85' ' ' ASN . . . . . 0.572 ' N ' HD21 ' A' ' 85' ' ' ASN . 1.0 OUTLIER 61.78 -74.69 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.216 -0.447 . . . . 64.450000000000003 110.95 179.982 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 86' ' ' VAL . . . . . 0.471 ' N ' ' O ' ' A' ' 84' ' ' LYS . 3.4 m 41.73 90.87 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.167 -0.469 . . . . 74.430000000000007 111.147 179.896 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 87' ' ' GLN . . . . . 0.472 ' NE2' ' OD1' ' A' ' 88' ' ' ASN . 0.2 OUTLIER -104.06 -95.92 0.32 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.167 -0.47 . . . . 74.540000000000006 110.989 179.957 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 88' ' ' ASN . . . . . 0.472 ' OD1' ' NE2' ' A' ' 87' ' ' GLN . 32.0 m120 -45.76 -36.04 4.79 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.183 -0.462 . . . . 63.450000000000003 110.891 -180.0 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 3.2 p -63.94 149.97 10.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.16 -0.473 . . . . 63.229999999999997 111.106 179.942 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 90' ' ' MET . . . . . . . . . . . . . 29.8 mtm -98.75 -74.29 0.59 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.194 -0.457 . . . . 74.319999999999993 110.887 179.914 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 7.7 p-10 176.4 -32.34 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.276 -0.42 . . . . 71.329999999999998 110.85 179.932 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -54.43 -45.86 73.12 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.213 -0.449 . . . . 73.400000000000006 110.823 -179.759 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -70.84 -38.97 73.22 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.165 -0.47 . . . . 74.439999999999998 110.893 -179.928 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . 0.447 HD21 ' CG ' ' A' ' 83' ' ' PHE . 21.4 mt -58.87 -47.43 84.93 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.208 -0.451 . . . . 73.510000000000005 110.912 -179.979 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 26.4 mt-30 -61.06 -34.56 75.08 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.166 -0.47 . . . . 71.329999999999998 110.91 179.941 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 96' ' ' MET . . . . . 0.498 ' SD ' ' CE1' ' A' ' 128' ' ' PHE . 9.2 ttp -61.25 -37.94 84.89 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.212 -0.449 . . . . 75.239999999999995 110.838 -179.992 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 97' ' ' LEU . . . . . 0.571 ' O ' ' CD1' ' A' ' 101' ' ' PHE . 27.8 mt -64.32 -43.07 95.8 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.224 -0.444 . . . . 74.230000000000004 110.93 179.994 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 5.0 mmtp -55.06 -38.51 68.12 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.227 -0.442 . . . . 73.409999999999997 110.91 179.82 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -70.19 -42.14 72.8 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.196 -0.456 . . . . 73.129999999999995 110.854 -179.903 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 6.0 mt-10 -66.69 -24.3 66.24 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.149 -0.478 . . . . 62.310000000000002 110.899 -179.953 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 101' ' ' PHE . . . . . 0.571 ' CD1' ' O ' ' A' ' 97' ' ' LEU . 9.4 m-30 -60.1 -31.12 69.74 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.138 -0.483 . . . . 75.439999999999998 110.905 -179.95 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.01 -40.76 87.37 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.148 -0.478 . . . . 71.109999999999999 110.877 179.948 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 1.6 mppt? -67.9 -42.95 80.39 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.226 -0.443 . . . . 74.400000000000006 110.92 179.853 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 2.3 mt -62.17 -47.59 92.39 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.218 -0.446 . . . . 73.219999999999999 111.1 179.879 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 105' ' ' HIS . . . . . . . . . . . . . 7.7 t-80 -62.93 -42.83 99.93 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.16 -0.473 . . . . 75.319999999999993 110.815 179.94 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -56.49 -41.76 77.18 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.218 -0.446 . . . . 74.439999999999998 110.927 -179.954 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 9.3 t -81.74 -23.63 36.58 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.147 -0.479 . . . . 74.230000000000004 111.157 -179.999 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 24.2 m -107.93 26.39 10.41 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.236 -0.438 . . . . 74.200000000000003 110.883 -179.89 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -65.73 86.04 0.08 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.113 -0.494 . . . . 74.230000000000004 110.845 -179.907 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 119.75 38.89 0.68 Allowed Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.779 -0.724 . . . . 62.420000000000002 112.464 -179.996 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 111' ' ' GLN . . . . . . . . . . . . . 10.9 pt20 -171.42 -176.43 1.85 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.735 0.302 . . . . 70.450000000000003 110.893 -179.914 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 63.1 mt-10 -60.57 131.59 51.2 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.214 -0.448 . . . . 74.219999999999999 110.911 -179.966 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 113' ' ' ILE . . . . . 0.44 ' CD1' ' HG3' ' A' ' 79' ' ' PRO . 7.6 pt -127.02 -5.53 4.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.187 -0.461 . . . . 75.239999999999995 111.137 179.969 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 114' ' ' ILE . . . . . 0.497 ' CD1' ' HE1' ' A' ' 70' ' ' MET . 3.6 mp -68.3 -46.61 80.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.185 -0.461 . . . . 73.239999999999995 111.134 179.828 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 115' ' ' PHE . . . . . 0.565 ' CE1' HD13 ' A' ' 25' ' ' ILE . 12.5 t80 -69.13 -33.83 74.07 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.187 -0.46 . . . . 73.409999999999997 110.853 179.954 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 51.9 mm-40 -68.06 -44.72 75.72 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.191 -0.459 . . . . 74.25 110.886 -179.949 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 117' ' ' ILE . . . . . 0.496 HD12 ' CG ' ' A' ' 101' ' ' PHE . 0.4 OUTLIER -66.41 -41.2 88.37 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 116.192 -0.458 . . . . 74.340000000000003 111.147 179.982 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 118' ' ' THR . . . . . 0.474 ' N ' ' CG2' ' A' ' 117' ' ' ILE . 69.8 p -67.88 -43.08 80.16 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.162 -0.472 . . . . 73.540000000000006 111.177 179.906 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -66.49 -31.59 72.41 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.209 -0.451 . . . . 71.129999999999995 110.907 -179.878 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -77.73 -44.73 26.86 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.091 -0.504 . . . . 75.120000000000005 110.912 -179.988 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 121' ' ' THR . . . . . 0.43 ' CG2' HD11 ' A' ' 66' ' ' LEU . 18.8 p -66.17 -45.42 80.97 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.167 -0.47 . . . . 55.130000000000003 111.203 -179.979 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 3.6 pp0? -60.91 -38.12 84.64 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.187 -0.46 . . . . 75.129999999999995 110.894 179.978 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 123' ' ' GLU . . . . . 0.497 ' CG ' ' N ' ' A' ' 124' ' ' LYS . 1.6 pt-20 -74.12 -48.26 30.7 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.228 -0.442 . . . . 73.430000000000007 110.894 -179.944 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 124' ' ' LYS . . . . . 0.497 ' N ' ' CG ' ' A' ' 123' ' ' GLU . 0.0 OUTLIER -63.5 -28.51 70.0 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.084 -0.507 . . . . 74.340000000000003 110.865 179.986 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 125' ' ' LEU . . . . . 0.498 ' C ' ' CD2' ' A' ' 125' ' ' LEU . 1.4 tt -68.36 -51.64 42.12 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.208 -0.451 . . . . 71.409999999999997 110.928 179.947 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 26.8 t70 -60.31 -37.19 79.79 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.208 -0.451 . . . . 74.510000000000005 110.882 179.837 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 1.6 mm-40 -60.18 -48.68 80.69 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.185 -0.461 . . . . 75.140000000000001 110.838 -179.895 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 128' ' ' PHE . . . . . 0.498 ' CE1' ' SD ' ' A' ' 96' ' ' MET . 7.4 m-85 . . . . . 0 C--N 1.328 -0.333 0 CA-C-N 116.152 -0.477 . . . . 75.439999999999998 110.874 -179.907 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 23.4 mt . . . . . 0 C--O 1.231 0.126 0 CA-C-O 120.771 0.319 . . . . 74.219999999999999 110.912 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 6.3 m-20 -50.96 -34.59 29.51 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.251 -0.432 . . . . 73.409999999999997 110.86 179.827 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 36.6 mm-40 -66.33 -36.38 82.76 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.178 -0.465 . . . . 74.540000000000006 110.897 -179.892 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 17.9 m-85 -65.2 -26.05 67.97 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.168 -0.469 . . . . 74.450000000000003 110.919 -179.857 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -58.73 -37.59 76.51 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.106 -0.497 . . . . 75.109999999999999 110.927 -179.871 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 1.1 mm-40 -58.26 -41.68 84.78 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.104 -0.498 . . . . 70.230000000000004 110.898 179.987 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 2.3 mp -68.08 -40.16 82.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.208 -0.451 . . . . 73.310000000000002 111.141 179.939 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . 0.602 ' OE1' ' CE1' ' A' ' 74' ' ' TYR . 12.6 mm-40 -62.76 -45.04 94.55 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.133 -0.485 . . . . 64.120000000000005 110.87 179.989 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 3.2 t -58.52 -44.51 89.57 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.163 -0.471 . . . . 65.409999999999997 110.889 -179.925 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -57.58 -33.51 68.25 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.217 -0.447 . . . . 72.140000000000001 110.911 -179.931 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 2.0 mm-40 -66.05 -37.69 86.47 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.179 -0.464 . . . . 63.299999999999997 110.896 -179.979 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . 0.457 HD21 ' CG1' ' A' ' 46' ' ' ILE . 9.2 mp -65.7 -51.39 59.71 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.128 -0.487 . . . . 63.219999999999999 110.929 -179.995 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 2.0 pt-20 -68.25 -32.58 72.87 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.207 -0.452 . . . . 60.030000000000001 110.902 179.902 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -66.05 -49.92 65.99 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.143 -0.48 . . . . 73.329999999999998 111.103 179.952 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . 0.476 ' N ' HD13 ' A' ' 22' ' ' ILE . 0.7 OUTLIER -77.01 -34.58 22.03 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.226 -0.443 . . . . 74.349999999999994 111.153 179.966 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . 0.403 ' CG ' ' O ' ' A' ' 19' ' ' LEU . 26.6 mtp180 -52.34 -34.45 47.37 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.184 -0.462 . . . . 75.129999999999995 110.913 179.935 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -67.16 -35.02 78.79 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.187 -0.461 . . . . 74.329999999999998 110.86 -179.758 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . 0.555 HD13 ' CD1' ' A' ' 115' ' ' PHE . 3.2 mt -80.61 -44.4 21.65 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.093 -0.503 . . . . 75.120000000000005 111.132 179.895 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 19.9 m-85 -110.73 45.89 1.11 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.208 -0.451 . . . . 64.030000000000001 110.92 -179.941 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 3.1 mtm -43.49 -57.23 3.2 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.127 -0.488 . . . . 74.209999999999994 110.887 179.884 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 5.4 m-20 -81.84 -35.94 28.85 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.203 -0.453 . . . . 71.409999999999997 110.883 179.949 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -80.62 44.03 0.7 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.218 -0.446 . . . . 73.430000000000007 110.827 -179.983 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 10.1 t80 -129.15 123.72 32.85 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.233 -0.44 . . . . 74.549999999999997 110.921 -179.937 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 20.3 m -113.17 135.03 54.26 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.171 -0.468 . . . . 74.430000000000007 111.101 -179.882 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -95.94 113.99 25.67 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.216 -0.447 . . . . 52.109999999999999 110.868 179.924 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . 0.594 ' CD2' ' N ' ' A' ' 34' ' ' THR . 0.1 OUTLIER -113.36 -18.74 11.96 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.162 -0.472 . . . . 73.219999999999999 110.93 -179.935 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 34' ' ' THR . . . . . 0.594 ' N ' ' CD2' ' A' ' 33' ' ' LEU . 2.5 m . . . . . 0 C--N 1.33 -0.266 0 CA-C-N 116.163 -0.471 . . . . 73.329999999999998 111.143 179.94 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 45' ' ' GLN . . . . . 0.519 ' O ' ' CB ' ' A' ' 46' ' ' ILE . 0.3 OUTLIER . . . . . 0 C--O 1.232 0.147 0 CA-C-O 120.764 0.316 . . . . 74.239999999999995 110.907 . . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 46' ' ' ILE . . . . . 0.519 ' CB ' ' O ' ' A' ' 45' ' ' GLN . 0.1 OUTLIER 87.52 -18.01 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.214 -0.448 . . . . 75.549999999999997 111.184 -179.971 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . 0.539 ' N ' ' CD1' ' A' ' 47' ' ' ILE . 0.1 OUTLIER -38.28 147.2 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.164 -0.471 . . . . 74.109999999999999 111.139 179.811 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 1.9 p90 -162.02 160.93 28.19 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.149 -0.478 . . . . 74.430000000000007 110.871 179.975 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 18.8 mt-10 -110.61 155.61 22.12 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.153 -0.476 . . . . 72.329999999999998 110.929 -179.948 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 9.2 mm -135.44 142.28 40.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.2 -0.454 . . . . 73.530000000000001 111.142 179.935 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 89.7 m -88.12 139.18 30.77 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.168 -0.469 . . . . 74.219999999999999 111.167 179.938 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 17.4 mt -141.12 162.63 35.04 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.232 -0.44 . . . . 75.25 110.918 179.957 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 53' ' ' ARG . . . . . 0.456 ' C ' ' CD2' ' A' ' 125' ' ' LEU . 0.0 OUTLIER -178.27 173.76 1.38 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.179 -0.464 . . . . 74.420000000000002 110.817 179.969 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 10.9 p -67.46 -173.6 0.32 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.192 -0.458 . . . . 61.439999999999998 110.888 -179.801 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 34.0 m -94.13 -28.94 4.21 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.169 -0.468 . . . . 62.020000000000003 111.148 179.935 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -113.54 -173.8 2.34 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.123 -0.489 . . . . 62.350000000000001 110.861 179.941 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -117.61 -13.56 10.25 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.188 -0.46 . . . . 74.319999999999993 110.878 179.986 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . 0.546 ' HA ' ' C ' ' A' ' 59' ' ' PRO . 5.9 pt-20 -122.67 144.11 41.69 Favored Pre-proline 0 C--N 1.329 -0.296 0 CA-C-O 121.637 0.732 . . . . 75.310000000000002 110.85 -179.975 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 59' ' ' PRO . . . . . 0.546 ' C ' ' HA ' ' A' ' 58' ' ' GLU . 53.9 Cg_endo -69.76 -5.18 8.73 Favored 'Cis proline' 0 C--N 1.342 0.2 0 C-N-CA 122.663 -1.807 . . . . 74.150000000000006 112.316 -0.042 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 60' ' ' VAL . . . . . 0.415 HG21 ' CG ' ' A' ' 88' ' ' ASN . 14.9 m -154.9 -179.5 0.25 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.256 -0.429 . . . . 72.099999999999994 111.17 179.912 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . 0.429 ' O ' ' C ' ' A' ' 62' ' ' SER . 1.2 pt-20 -118.91 -12.8 9.53 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.193 -0.458 . . . . 71.430000000000007 110.843 179.989 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 62' ' ' SER . . . . . 0.435 ' HB3' ' CD1' ' A' ' 125' ' ' LEU . 7.8 t 35.51 90.78 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.206 -0.452 . . . . 74.310000000000002 110.841 -179.811 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 6.4 t -104.87 123.04 47.02 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.117 -0.492 . . . . 75.010000000000005 110.85 -179.83 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 64' ' ' ILE . . . . . . . . . . . . . 20.7 mt -136.2 132.18 49.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.121 -0.491 . . . . 74.519999999999996 111.088 179.992 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 87.0 m -95.84 113.96 25.65 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.218 -0.446 . . . . 75.439999999999998 111.1 179.95 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 11.8 mt -94.54 112.62 24.39 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.236 -0.438 . . . . 75.439999999999998 110.913 179.906 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 2.6 t60 -108.78 112.0 24.05 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.188 -0.46 . . . . 71.540000000000006 110.811 179.864 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 68' ' ' PHE . . . . . 0.562 ' CE1' HG23 ' A' ' 114' ' ' ILE . 0.0 OUTLIER -102.95 145.11 30.34 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.181 -0.463 . . . . 73.120000000000005 110.878 -179.946 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 69' ' ' ALA . . . . . 0.477 ' CB ' HG21 ' A' ' 47' ' ' ILE . . . -122.32 110.74 16.05 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.135 -0.484 . . . . 70.239999999999995 111.124 179.911 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 70' ' ' MET . . . . . 0.469 ' CE ' HD12 ' A' ' 114' ' ' ILE . 3.9 mmt -76.04 86.46 2.94 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.222 -0.444 . . . . 65.319999999999993 110.848 -179.998 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -40.34 156.57 0.18 Allowed Pre-proline 0 C--N 1.33 -0.274 0 CA-C-O 121.579 0.704 . . . . 70.140000000000001 111.145 -179.944 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.73 1.47 4.38 Favored 'Trans proline' 0 C--N 1.341 0.161 0 C-N-CA 122.687 2.258 . . . . 62.409999999999997 112.368 179.923 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 73' ' ' MET . . . . . 0.501 ' O ' ' CB ' ' A' ' 76' ' ' TYR . 0.0 OUTLIER -118.25 -26.14 6.4 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.192 -0.458 . . . . 73.310000000000002 110.909 179.908 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 74' ' ' TYR . . . . . 0.656 ' CD1' ' C ' ' A' ' 74' ' ' TYR . 0.0 OUTLIER -48.05 150.65 1.98 Allowed Pre-proline 0 C--N 1.328 -0.346 0 CA-C-O 121.659 0.742 . . . . 75.239999999999995 110.91 -179.864 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 75' ' ' PRO . . . . . 0.568 ' HA ' ' CD2' ' A' ' 74' ' ' TYR . 54.3 Cg_endo -69.76 -11.12 11.79 Favored 'Cis proline' 0 C--N 1.34 0.129 0 C-N-CA 122.684 -1.798 . . . . 75.230000000000004 112.365 -0.09 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 76' ' ' TYR . . . . . 0.501 ' CB ' ' O ' ' A' ' 73' ' ' MET . 16.4 t80 -32.82 -53.9 0.35 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.199 -0.455 . . . . 72.25 110.949 -179.96 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 29.6 p -106.98 171.44 7.37 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.075 -0.511 . . . . 72.439999999999998 111.162 -179.947 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -85.09 130.19 53.09 Favored Pre-proline 0 C--N 1.329 -0.325 0 CA-C-O 121.566 0.698 . . . . 65.219999999999999 111.107 179.881 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 79' ' ' PRO . . . . . 0.465 ' HG3' ' CD1' ' A' ' 113' ' ' ILE . 53.4 Cg_endo -69.8 174.13 9.99 Favored 'Trans proline' 0 C--N 1.341 0.168 0 C-N-CA 122.675 2.25 . . . . 60.32 112.338 -179.965 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -120.45 137.69 54.2 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.223 -0.444 . . . . 62.240000000000002 110.857 -179.962 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 81' ' ' ILE . . . . . 0.478 ' CG1' ' HA ' ' A' ' 68' ' ' PHE . 13.7 mt -143.68 150.13 17.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.136 -0.484 . . . . 75.140000000000001 111.163 179.953 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . 0.479 ' HG3' ' CD ' ' A' ' 84' ' ' LYS . 9.5 pt-20 -149.0 147.48 28.61 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.21 -0.45 . . . . 75.430000000000007 110.915 179.959 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 83' ' ' PHE . . . . . 0.516 ' CE2' ' HD3' ' A' ' 98' ' ' LYS . 15.2 m-85 -90.51 140.96 29.24 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.154 -0.476 . . . . 74.019999999999996 110.851 -179.901 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 84' ' ' LYS . . . . . 0.512 ' O ' ' N ' ' A' ' 86' ' ' VAL . 8.9 mmmt -124.57 174.43 7.83 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.166 -0.47 . . . . 74.530000000000001 110.91 179.919 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 85' ' ' ASN . . . . . 0.421 ' C ' HG23 ' A' ' 86' ' ' VAL . 2.5 m-80 59.3 -75.75 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.215 -0.448 . . . . 73.140000000000001 110.915 179.998 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 86' ' ' VAL . . . . . 0.512 ' N ' ' O ' ' A' ' 84' ' ' LYS . 3.5 m 41.73 92.65 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.19 -0.459 . . . . 72.5 111.104 179.901 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -96.22 -77.82 0.47 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.189 -0.46 . . . . 74.319999999999993 110.861 -179.958 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 88' ' ' ASN . . . . . 0.415 ' CG ' HG21 ' A' ' 60' ' ' VAL . 0.7 OUTLIER -59.71 -56.82 17.09 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.202 -0.454 . . . . 73.219999999999999 110.881 -179.937 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 89' ' ' VAL . . . . . 0.466 ' CG2' ' HG ' ' A' ' 94' ' ' LEU . 2.1 p -51.07 136.68 9.95 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.19 -0.459 . . . . 74.310000000000002 111.158 179.887 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 90' ' ' MET . . . . . . . . . . . . . 6.8 mtm -88.97 -70.37 0.65 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.121 -0.491 . . . . 72.209999999999994 110.912 179.906 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 10.3 t0 -175.19 -31.62 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.217 -0.447 . . . . 73.310000000000002 110.867 179.957 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -53.98 -46.76 71.78 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.191 -0.459 . . . . 73.129999999999995 110.85 -179.722 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 93' ' ' GLN . . . . . 0.526 ' HG3' ' CE1' ' A' ' 128' ' ' PHE . 0.3 OUTLIER -70.24 -37.69 75.01 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.158 -0.474 . . . . 71.420000000000002 110.908 -179.978 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . 0.509 HD22 ' CG ' ' A' ' 83' ' ' PHE . 48.1 mt -59.2 -47.54 84.94 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.203 -0.453 . . . . 74.329999999999998 110.96 179.995 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 1.7 mt-30 -61.42 -35.74 78.39 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.181 -0.463 . . . . 62.340000000000003 110.857 179.932 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 96' ' ' MET . . . . . . . . . . . . . 31.7 ttp -61.44 -42.25 98.46 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.21 -0.45 . . . . 75.510000000000005 110.827 -179.964 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 97' ' ' LEU . . . . . 0.461 ' O ' ' CD1' ' A' ' 101' ' ' PHE . 79.8 mt -60.02 -43.82 95.02 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.243 -0.435 . . . . 74.319999999999993 110.965 -179.995 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 98' ' ' LYS . . . . . 0.516 ' HD3' ' CE2' ' A' ' 83' ' ' PHE . 6.0 mmtp -55.49 -39.06 69.96 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.18 -0.464 . . . . 73.319999999999993 110.867 179.809 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 57.1 m -64.11 -40.2 95.69 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.25 -0.432 . . . . 61.299999999999997 110.862 -179.888 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 100' ' ' GLU . . . . . 0.575 ' OE1' ' CZ ' ' A' ' 120' ' ' PHE . 19.5 mm-40 -71.44 -27.24 63.14 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.116 -0.493 . . . . 73.310000000000002 110.91 -179.983 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 101' ' ' PHE . . . . . 0.533 ' CD2' HD13 ' A' ' 117' ' ' ILE . 10.5 m-30 -60.19 -31.12 69.84 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.173 -0.467 . . . . 70.120000000000005 110.856 -179.867 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 14.1 ttmt -73.92 -41.54 61.92 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.165 -0.47 . . . . 75.120000000000005 110.898 179.958 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 17.4 ttpp -69.82 -41.25 75.24 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.167 -0.469 . . . . 74.120000000000005 110.905 179.856 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 3.9 mt -64.45 -47.59 88.72 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 116.257 -0.429 . . . . 63.409999999999997 111.131 179.86 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 105' ' ' HIS . . . . . . . . . . . . . 2.1 t60 -62.82 -43.62 98.33 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.197 -0.456 . . . . 74.409999999999997 110.86 179.861 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -56.53 -43.3 79.69 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.196 -0.456 . . . . 74.230000000000004 110.872 -179.913 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 9.9 t -77.87 -30.12 50.7 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.166 -0.47 . . . . 61.130000000000003 111.161 -179.991 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 27.0 m -107.05 33.08 4.15 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.221 -0.445 . . . . 71.530000000000001 110.846 -179.867 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 34.1 ttt180 -76.57 80.65 3.24 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.149 -0.478 . . . . 73.040000000000006 110.859 -179.93 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 151.21 -29.44 0.98 Allowed Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.694 -0.765 . . . . 51.109999999999999 112.484 -179.953 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 111' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -111.41 -164.43 0.92 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.784 0.326 . . . . 72.109999999999999 110.956 -179.909 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 12.2 mt-10 -67.23 133.87 50.56 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.234 -0.439 . . . . 63.219999999999999 110.839 -179.924 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 113' ' ' ILE . . . . . 0.465 ' CD1' ' HG3' ' A' ' 79' ' ' PRO . 2.8 pt -122.95 -16.94 5.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.096 -0.502 . . . . 65.219999999999999 111.121 179.986 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 114' ' ' ILE . . . . . 0.562 HG23 ' CE1' ' A' ' 68' ' ' PHE . 9.5 mm -57.18 -43.12 81.09 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 116.152 -0.476 . . . . 75.150000000000006 111.065 179.879 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 115' ' ' PHE . . . . . 0.555 ' CD1' HD13 ' A' ' 25' ' ' ILE . 20.0 t80 -70.58 -31.94 69.14 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.167 -0.47 . . . . 72.430000000000007 110.89 179.991 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 9.1 mm-40 -68.21 -47.79 66.9 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.144 -0.48 . . . . 72.010000000000005 110.862 -179.892 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 117' ' ' ILE . . . . . 0.533 HD13 ' CD2' ' A' ' 101' ' ' PHE . 0.7 OUTLIER -66.02 -42.34 91.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.134 -0.484 . . . . 71.030000000000001 111.117 -179.999 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 118' ' ' THR . . . . . 0.488 ' N ' ' CG2' ' A' ' 117' ' ' ILE . 70.8 p -68.01 -41.69 81.85 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.192 -0.458 . . . . 74.310000000000002 111.169 179.98 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 29.5 t -67.33 -39.71 85.84 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.199 -0.455 . . . . 71.409999999999997 110.858 -179.873 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 120' ' ' PHE . . . . . 0.575 ' CZ ' ' OE1' ' A' ' 100' ' ' GLU . 1.0 OUTLIER -67.13 -47.75 70.17 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.147 -0.479 . . . . 74.409999999999997 110.894 -179.923 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 34.8 p -65.44 -39.72 92.42 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.141 -0.481 . . . . 74.209999999999994 111.133 -179.955 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 37.6 tt0 -65.03 -47.04 78.85 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.223 -0.444 . . . . 75.400000000000006 110.907 -180.0 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 123' ' ' GLU . . . . . 0.438 ' CG ' ' N ' ' A' ' 124' ' ' LYS . 3.6 pt-20 -67.05 -44.42 80.19 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.231 -0.44 . . . . 65.340000000000003 110.88 -179.949 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 124' ' ' LYS . . . . . 0.59 ' O ' ' CE1' ' A' ' 128' ' ' PHE . 0.0 OUTLIER -70.78 -32.32 69.39 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.141 -0.481 . . . . 74.340000000000003 110.848 -180.0 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 125' ' ' LEU . . . . . 0.54 ' HA ' ' CD2' ' A' ' 128' ' ' PHE . 1.9 tp -63.25 -42.42 99.17 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.221 -0.445 . . . . 75.239999999999995 110.91 179.933 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 9.3 m-20 -59.65 -38.65 81.98 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.186 -0.461 . . . . 62.5 110.855 179.834 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 1.6 mt-10 -62.68 -36.12 81.88 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.142 -0.481 . . . . 74.420000000000002 110.862 -179.858 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 128' ' ' PHE . . . . . 0.59 ' CE1' ' O ' ' A' ' 124' ' ' LYS . 7.0 m-30 . . . . . 0 C--N 1.329 -0.308 0 CA-C-N 116.221 -0.445 . . . . 73.439999999999998 110.894 -179.93 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 60.5 mt . . . . . 0 C--O 1.231 0.091 0 CA-C-O 120.811 0.339 . . . . 74.209999999999994 110.924 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . 0.45 ' N ' ' OD1' ' A' ' 9' ' ' ASP . 0.8 OUTLIER -51.82 -35.23 43.63 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.18 -0.463 . . . . 55.340000000000003 110.844 179.886 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 71.5 mm-40 -65.23 -40.42 94.03 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.238 -0.437 . . . . 75.340000000000003 110.914 -179.952 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 13.6 m-85 -54.69 -23.15 16.21 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.199 -0.455 . . . . 75.140000000000001 110.909 -179.862 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER -57.48 -36.39 71.41 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.124 -0.489 . . . . 75.420000000000002 110.974 -179.938 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . 0.477 ' HG3' ' N ' ' A' ' 14' ' ' ILE . 4.8 pt-20 -62.24 -42.09 99.01 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.084 -0.507 . . . . 75.230000000000004 110.898 179.957 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' ILE . . . . . 0.477 ' N ' ' HG3' ' A' ' 13' ' ' GLU . 3.9 mp -68.52 -42.75 83.88 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-N 116.147 -0.478 . . . . 75.109999999999999 111.142 179.989 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . 0.585 ' OE1' ' CE1' ' A' ' 74' ' ' TYR . 10.8 mm-40 -66.06 -45.9 79.71 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.184 -0.462 . . . . 70.219999999999999 110.906 179.931 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 43.2 t -59.56 -41.53 90.33 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.185 -0.461 . . . . 72.319999999999993 110.882 -179.929 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -59.71 -33.65 71.89 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.208 -0.451 . . . . 73.129999999999995 110.918 -179.925 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 7.6 mt-10 -62.67 -38.09 89.0 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.162 -0.472 . . . . 74.319999999999993 110.906 -179.997 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . 0.443 ' CD2' HG13 ' A' ' 46' ' ' ILE . 9.9 mp -66.65 -51.64 53.86 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.122 -0.49 . . . . 72.519999999999996 110.887 -179.955 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 3.0 pt-20 -68.74 -32.7 72.67 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.18 -0.464 . . . . 73.209999999999994 110.881 179.94 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -66.66 -48.33 69.72 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.186 -0.461 . . . . 62.329999999999998 111.113 179.923 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . 0.473 ' N ' HD12 ' A' ' 22' ' ' ILE . 0.9 OUTLIER -75.85 -34.68 28.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.22 -0.446 . . . . 74.409999999999997 111.116 179.984 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -55.55 -34.44 64.74 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.169 -0.469 . . . . 74.430000000000007 110.833 -179.993 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -64.96 -35.73 82.12 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.254 -0.43 . . . . 64.349999999999994 110.861 -179.816 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . 0.569 HD13 ' CE1' ' A' ' 115' ' ' PHE . 3.1 mt -82.86 -41.23 17.16 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.125 -0.489 . . . . 63.109999999999999 111.139 179.967 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 23.0 m-85 -109.9 45.36 1.1 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.158 -0.474 . . . . 72.450000000000003 110.899 -179.97 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 1.8 mtm -43.55 -53.64 5.45 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.144 -0.48 . . . . 63.210000000000001 110.891 179.884 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -94.85 -20.86 19.08 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.18 -0.464 . . . . 73.420000000000002 110.836 -179.985 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -88.32 19.76 3.62 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.166 -0.47 . . . . 72.040000000000006 110.887 -179.984 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' PHE . . . . . 0.449 ' CD1' ' C ' ' A' ' 30' ' ' PHE . 1.9 t80 -105.97 145.96 30.66 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.23 -0.441 . . . . 74.530000000000001 110.887 -179.887 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 40.1 m -125.71 133.41 52.13 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.121 -0.491 . . . . 74.219999999999999 111.077 -179.849 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 1.1 t0 -97.94 115.5 28.27 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.188 -0.46 . . . . 73.540000000000006 110.891 179.882 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . 0.577 ' CD2' ' N ' ' A' ' 34' ' ' THR . 0.1 OUTLIER -118.91 -21.21 7.85 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.2 -0.454 . . . . 73.010000000000005 110.908 -179.92 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 34' ' ' THR . . . . . 0.577 ' N ' ' CD2' ' A' ' 33' ' ' LEU . 2.1 m . . . . . 0 C--N 1.33 -0.269 0 CA-C-N 116.183 -0.462 . . . . 74.25 111.158 179.922 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 45' ' ' GLN . . . . . 0.514 ' O ' ' CB ' ' A' ' 46' ' ' ILE . 0.1 OUTLIER . . . . . 0 C--O 1.232 0.144 0 CA-C-O 120.791 0.329 . . . . 74.209999999999994 110.959 . . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 46' ' ' ILE . . . . . 0.514 ' CB ' ' O ' ' A' ' 45' ' ' GLN . 0.1 OUTLIER 86.75 -12.55 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.199 -0.455 . . . . 75.450000000000003 111.136 179.964 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . 0.495 ' N ' ' CD1' ' A' ' 47' ' ' ILE . 0.1 OUTLIER -52.41 149.18 1.36 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.157 -0.474 . . . . 72.099999999999994 111.143 179.836 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 48' ' ' PHE . . . . . 0.446 ' HA ' ' CD2' ' A' ' 33' ' ' LEU . 30.2 p90 -161.88 162.8 29.41 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.197 -0.456 . . . . 75.519999999999996 110.909 179.945 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 5.8 mt-10 -111.91 159.74 18.09 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.146 -0.479 . . . . 74.319999999999993 110.908 -179.911 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 13.1 mm -135.25 142.7 39.1 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 116.191 -0.459 . . . . 74.129999999999995 111.143 179.961 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 83.9 m -84.88 129.58 34.79 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.185 -0.461 . . . . 63.43 111.116 179.984 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 12.0 mt -135.74 155.58 50.15 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.18 -0.464 . . . . 75.420000000000002 110.916 179.948 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -175.15 165.56 3.4 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.213 -0.449 . . . . 75.099999999999994 110.853 179.93 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -54.93 170.65 0.17 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.191 -0.459 . . . . 74.239999999999995 110.847 -179.785 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 18.7 m -84.43 -22.65 7.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.133 -0.485 . . . . 74.409999999999997 111.105 179.978 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -115.9 -176.99 3.05 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.151 -0.477 . . . . 75.239999999999995 110.846 179.995 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 6.1 mmmm -115.63 -7.28 12.17 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.192 -0.458 . . . . 73.209999999999994 110.927 179.955 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . 0.541 ' HA ' ' C ' ' A' ' 59' ' ' PRO . 44.6 mt-10 -129.01 148.17 67.89 Favored Pre-proline 0 C--N 1.33 -0.269 0 CA-C-O 121.652 0.739 . . . . 74.519999999999996 110.867 179.986 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 59' ' ' PRO . . . . . 0.541 ' C ' ' HA ' ' A' ' 58' ' ' GLU . 54.0 Cg_endo -69.73 -3.51 7.7 Favored 'Cis proline' 0 C--N 1.342 0.185 0 C-N-CA 122.686 -1.798 . . . . 63.439999999999998 112.369 -0.035 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 60' ' ' VAL . . . . . 0.417 HG22 ' CG ' ' A' ' 88' ' ' ASN . 18.6 m -148.44 179.06 0.74 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.235 -0.439 . . . . 72.219999999999999 111.132 179.94 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . 0.437 ' O ' ' C ' ' A' ' 62' ' ' SER . 8.7 tt0 -107.28 -17.17 14.21 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.137 -0.483 . . . . 73.239999999999995 110.886 -179.988 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 62' ' ' SER . . . . . 0.437 ' C ' ' O ' ' A' ' 61' ' ' GLU . 1.0 OUTLIER 34.15 91.0 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.137 -0.483 . . . . 73.430000000000007 110.829 -179.807 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 35.1 t -112.71 122.98 49.26 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.127 -0.488 . . . . 74.409999999999997 110.86 -179.856 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 64' ' ' ILE . . . . . . . . . . . . . 17.8 mt -136.53 138.63 46.36 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.121 -0.49 . . . . 73.120000000000005 111.141 179.959 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 90.5 m -104.38 113.89 27.75 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.2 -0.455 . . . . 75.150000000000006 111.112 179.974 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . 0.566 HD22 ' CD1' ' A' ' 83' ' ' PHE . 7.1 mt -93.06 113.26 25.48 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.197 -0.456 . . . . 71.140000000000001 110.883 179.972 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 67' ' ' HIS . . . . . 0.461 ' CE1' HD12 ' A' ' 33' ' ' LEU . 12.6 t60 -105.13 112.56 25.73 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.179 -0.464 . . . . 72.109999999999999 110.859 179.872 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 68' ' ' PHE . . . . . 0.566 ' CE1' HG22 ' A' ' 114' ' ' ILE . 0.0 OUTLIER -103.65 139.88 38.33 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.183 -0.462 . . . . 73.519999999999996 110.889 -179.927 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -114.47 115.67 27.62 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.14 -0.482 . . . . 65.129999999999995 111.081 179.949 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 70' ' ' MET . . . . . 0.456 ' HE1' ' CG1' ' A' ' 114' ' ' ILE . 5.9 mmt -79.11 102.25 8.34 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.229 -0.441 . . . . 74.239999999999995 110.84 179.99 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -60.84 153.95 61.49 Favored Pre-proline 0 C--N 1.33 -0.255 0 CA-C-O 121.632 0.729 . . . . 74.319999999999993 111.123 -179.956 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_endo -69.73 0.47 5.57 Favored 'Trans proline' 0 C--N 1.341 0.18 0 C-N-CA 122.643 2.229 . . . . 64.150000000000006 112.342 179.906 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 73' ' ' MET . . . . . 0.476 ' O ' ' CB ' ' A' ' 76' ' ' TYR . 0.0 OUTLIER -114.38 -26.92 7.77 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.236 -0.438 . . . . 73.239999999999995 110.932 179.858 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 74' ' ' TYR . . . . . 0.639 ' CD1' ' C ' ' A' ' 74' ' ' TYR . 0.0 OUTLIER -47.3 149.38 1.86 Allowed Pre-proline 0 C--N 1.328 -0.349 0 CA-C-O 121.673 0.749 . . . . 74.340000000000003 110.881 -179.853 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 75' ' ' PRO . . . . . 0.551 ' HA ' ' CD2' ' A' ' 74' ' ' TYR . 53.2 Cg_endo -69.78 -13.12 12.39 Favored 'Cis proline' 0 C--N 1.341 0.175 0 C-N-CA 122.709 -1.788 . . . . 75.099999999999994 112.342 -0.031 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 76' ' ' TYR . . . . . 0.476 ' CB ' ' O ' ' A' ' 73' ' ' MET . 3.3 t80 -33.44 -52.4 0.38 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.211 -0.449 . . . . 75.409999999999997 110.934 -179.91 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 43.1 p -106.37 -176.6 3.12 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.099 -0.5 . . . . 72.409999999999997 111.189 179.99 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -105.88 130.39 23.09 Favored Pre-proline 0 C--N 1.328 -0.338 0 CA-C-O 121.597 0.713 . . . . 61.530000000000001 111.113 179.865 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 79' ' ' PRO . . . . . 0.441 ' HG3' ' CD1' ' A' ' 113' ' ' ILE . 53.6 Cg_endo -69.79 -170.88 0.42 Allowed 'Trans proline' 0 C--N 1.342 0.228 0 C-N-CA 122.66 2.24 . . . . 73.519999999999996 112.344 -179.949 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . 0.459 ' HG3' ' N ' ' A' ' 81' ' ' ILE . 0.4 OUTLIER -123.88 142.12 51.41 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.246 -0.434 . . . . 75.120000000000005 110.922 -179.957 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 81' ' ' ILE . . . . . 0.472 ' CG2' HD23 ' A' ' 66' ' ' LEU . 2.3 mm -131.37 143.25 41.15 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.176 -0.465 . . . . 75.230000000000004 111.147 179.972 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . 0.465 ' HG3' ' CD ' ' A' ' 84' ' ' LYS . 4.3 pt-20 -148.58 142.07 25.35 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.182 -0.463 . . . . 75.230000000000004 110.856 179.973 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 83' ' ' PHE . . . . . 0.566 ' CD1' HD22 ' A' ' 66' ' ' LEU . 36.4 m-85 -95.19 141.37 28.88 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.13 -0.487 . . . . 74.109999999999999 110.902 -179.972 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 84' ' ' LYS . . . . . 0.484 ' O ' ' N ' ' A' ' 86' ' ' VAL . 7.7 mmmt -124.17 170.26 10.9 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.116 -0.493 . . . . 73.450000000000003 110.896 179.967 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 85' ' ' ASN . . . . . 0.547 ' N ' HD21 ' A' ' 85' ' ' ASN . 1.1 m-80 60.55 -75.68 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.209 -0.451 . . . . 73.329999999999998 110.904 179.954 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 86' ' ' VAL . . . . . 0.484 ' N ' ' O ' ' A' ' 84' ' ' LYS . 2.5 m 40.3 93.42 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-N 116.21 -0.45 . . . . 71.319999999999993 111.146 179.91 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -93.72 -93.61 0.17 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.1 -0.5 . . . . 75.319999999999993 110.923 -179.992 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 88' ' ' ASN . . . . . 0.417 ' CG ' HG22 ' A' ' 60' ' ' VAL . 1.3 t30 -44.44 -48.45 9.96 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.197 -0.456 . . . . 75.030000000000001 110.907 -179.931 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 2.0 p -60.1 141.11 17.16 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.171 -0.468 . . . . 74.549999999999997 111.119 179.908 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 90' ' ' MET . . . . . . . . . . . . . 5.5 mtm -92.55 -63.98 1.16 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.182 -0.463 . . . . 72.319999999999993 110.883 179.911 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 1.4 t0 173.88 -27.44 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.231 -0.441 . . . . 74.540000000000006 110.907 -179.997 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -54.38 -47.05 73.12 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.194 -0.457 . . . . 74.109999999999999 110.859 -179.745 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 93' ' ' GLN . . . . . 0.414 ' HB2' ' CD2' ' A' ' 128' ' ' PHE . 0.8 OUTLIER -71.08 -36.94 72.44 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.14 -0.482 . . . . 75.239999999999995 110.934 179.999 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 21.9 mt -57.95 -44.21 86.87 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.198 -0.456 . . . . 74.209999999999994 110.922 -179.983 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 2.9 mm-40 -63.76 -35.26 80.0 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.203 -0.453 . . . . 72.510000000000005 110.873 179.954 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 96' ' ' MET . . . . . . . . . . . . . 23.1 ttp -59.99 -44.35 94.58 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.226 -0.443 . . . . 75.129999999999995 110.918 179.935 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 97' ' ' LEU . . . . . 0.404 ' O ' ' CD1' ' A' ' 101' ' ' PHE . 34.5 mt -57.79 -41.95 83.13 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.246 -0.434 . . . . 73.0 110.903 179.987 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 98' ' ' LYS . . . . . 0.447 ' HD3' ' CE2' ' A' ' 83' ' ' PHE . 12.9 mmtm -54.64 -37.09 65.26 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.151 -0.477 . . . . 64.0 110.927 179.819 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -68.81 -41.97 77.92 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.249 -0.432 . . . . 74.329999999999998 110.877 -179.894 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 100' ' ' GLU . . . . . 0.407 ' OE2' ' NZ ' ' A' ' 103' ' ' LYS . 0.7 OUTLIER -69.17 -26.01 64.64 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.105 -0.498 . . . . 74.019999999999996 110.869 -179.98 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 101' ' ' PHE . . . . . 0.566 ' CD2' HD11 ' A' ' 117' ' ' ILE . 10.6 m-30 -59.7 -33.12 71.19 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.161 -0.472 . . . . 74.439999999999998 110.895 -179.92 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -63.99 -44.13 93.62 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.155 -0.475 . . . . 73.329999999999998 110.899 179.948 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 103' ' ' LYS . . . . . 0.407 ' NZ ' ' OE2' ' A' ' 100' ' ' GLU . 0.0 OUTLIER -68.86 -36.17 77.79 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.238 -0.437 . . . . 73.010000000000005 110.934 179.846 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 5.2 mt -63.22 -47.65 91.25 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.216 -0.447 . . . . 74.409999999999997 111.128 179.865 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 105' ' ' HIS . . . . . . . . . . . . . 5.9 t60 -62.96 -41.8 99.64 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.209 -0.45 . . . . 75.430000000000007 110.872 179.86 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -58.91 -43.6 91.1 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.231 -0.44 . . . . 72.310000000000002 110.896 -179.958 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 10.2 t -76.75 -27.9 55.54 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.144 -0.48 . . . . 74.329999999999998 111.152 -179.973 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 60.2 m -114.37 37.44 3.37 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.188 -0.46 . . . . 72.319999999999993 110.883 -179.83 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 18.7 ttt180 -81.6 77.44 8.45 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.088 -0.506 . . . . 73.310000000000002 110.88 -179.949 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 154.1 -15.12 0.58 Allowed Glycine 0 N--CA 1.451 -0.334 0 C-N-CA 120.757 -0.735 . . . . 53.229999999999997 112.493 -179.97 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 111' ' ' GLN . . . . . . . . . . . . . 14.3 pt20 -130.0 -166.21 1.64 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.754 0.311 . . . . 74.409999999999997 110.901 -179.886 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 66.1 mt-10 -61.4 131.87 51.65 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.158 -0.474 . . . . 65.400000000000006 110.918 -179.921 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 113' ' ' ILE . . . . . 0.441 ' CD1' ' HG3' ' A' ' 79' ' ' PRO . 20.6 pt -121.25 -8.11 9.91 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-N 116.163 -0.472 . . . . 73.150000000000006 111.128 179.966 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 114' ' ' ILE . . . . . 0.566 HG22 ' CE1' ' A' ' 68' ' ' PHE . 27.7 mm -66.52 -44.77 90.05 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-N 116.153 -0.476 . . . . 75.439999999999998 111.175 179.867 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 115' ' ' PHE . . . . . 0.569 ' CE1' HD13 ' A' ' 25' ' ' ILE . 28.8 t80 -68.04 -33.47 74.64 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.195 -0.457 . . . . 73.239999999999995 110.856 179.894 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 -67.79 -47.02 70.32 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.195 -0.457 . . . . 51.140000000000001 110.937 -179.928 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 117' ' ' ILE . . . . . 0.566 HD11 ' CD2' ' A' ' 101' ' ' PHE . 0.4 OUTLIER -64.18 -39.4 85.35 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.103 -0.499 . . . . 74.25 111.151 179.946 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 118' ' ' THR . . . . . 0.453 ' N ' ' CG2' ' A' ' 117' ' ' ILE . 74.2 p -68.19 -43.38 78.23 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.158 -0.474 . . . . 73.200000000000003 111.144 179.956 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -63.0 -44.09 96.99 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.258 -0.428 . . . . 75.109999999999999 110.906 -179.88 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -68.29 -46.62 69.83 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.103 -0.498 . . . . 72.129999999999995 110.883 -179.964 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 121' ' ' THR . . . . . 0.402 ' CG2' HD11 ' A' ' 66' ' ' LEU . 14.7 p -62.97 -39.18 93.91 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.089 -0.505 . . . . 75.409999999999997 111.148 -179.905 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 49.0 tp60 -65.71 -45.14 83.87 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.218 -0.446 . . . . 64.140000000000001 110.958 179.999 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 6.4 pt-20 -74.0 -29.89 62.19 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.148 -0.478 . . . . 73.519999999999996 110.881 -179.952 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 124' ' ' LYS . . . . . 0.494 ' CE ' ' HA ' ' A' ' 124' ' ' LYS . 0.0 OUTLIER -75.51 -45.48 37.95 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.165 -0.47 . . . . 74.530000000000001 110.894 179.971 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 125' ' ' LEU . . . . . 0.572 ' CD1' ' N ' ' A' ' 126' ' ' ASP . 0.0 OUTLIER -69.5 -42.84 74.22 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.205 -0.452 . . . . 73.439999999999998 110.957 179.917 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 126' ' ' ASP . . . . . 0.572 ' N ' ' CD1' ' A' ' 125' ' ' LEU . 14.3 t0 -60.25 -45.69 92.39 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.181 -0.463 . . . . 73.019999999999996 110.893 179.804 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 127' ' ' GLU . . . . . 0.494 ' HG3' ' N ' ' A' ' 128' ' ' PHE . 0.3 OUTLIER -60.94 -27.86 68.53 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.227 -0.442 . . . . 72.530000000000001 110.87 -179.922 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 128' ' ' PHE . . . . . 0.494 ' N ' ' HG3' ' A' ' 127' ' ' GLU . 0.1 OUTLIER . . . . . 0 C--N 1.328 -0.335 0 CA-C-N 116.194 -0.457 . . . . 63.310000000000002 110.922 -179.95 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 19.3 mt . . . . . 0 C--O 1.232 0.146 0 CA-C-O 120.815 0.34 . . . . 75.319999999999993 110.917 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . 0.42 ' OD1' ' N ' ' A' ' 9' ' ' ASP . 0.4 OUTLIER -55.63 -28.0 52.84 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.188 -0.46 . . . . 75.439999999999998 110.903 179.842 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 75.1 mm-40 -68.05 -36.79 80.45 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.227 -0.442 . . . . 71.430000000000007 110.895 -179.931 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 23.8 m-85 -63.94 -25.78 68.29 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.206 -0.452 . . . . 73.129999999999995 110.927 -179.879 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -59.4 -37.55 78.28 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.144 -0.48 . . . . 73.549999999999997 110.913 -179.916 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 2.2 mm-40 -60.23 -45.42 93.28 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.149 -0.478 . . . . 60.020000000000003 110.898 -179.985 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 3.7 mp -68.03 -41.06 84.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.098 -0.501 . . . . 70.219999999999999 111.166 179.954 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . 0.404 ' HG2' ' CB ' ' A' ' 70' ' ' MET . 0.8 OUTLIER -63.16 -47.87 80.84 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.207 -0.451 . . . . 72.409999999999997 110.961 179.895 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 3.8 t -58.83 -43.17 90.62 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.179 -0.464 . . . . 71.430000000000007 110.859 -179.938 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 1.1 t30 -57.79 -33.65 68.77 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.192 -0.458 . . . . 74.310000000000002 110.898 -179.854 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 4.9 mt-10 -66.1 -37.7 86.4 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.155 -0.475 . . . . 75.049999999999997 110.87 179.99 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . 0.447 ' N ' HD13 ' A' ' 19' ' ' LEU . 9.7 mp -64.99 -51.53 61.18 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.199 -0.455 . . . . 75.400000000000006 110.897 -179.939 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 1.5 pt-20 -68.58 -33.49 74.16 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.2 -0.455 . . . . 72.129999999999995 110.837 179.977 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -65.89 -49.63 67.37 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.214 -0.448 . . . . 74.120000000000005 111.116 179.967 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . 0.471 HD11 ' N ' ' A' ' 22' ' ' ILE . 0.6 OUTLIER -74.9 -34.41 32.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.2 -0.455 . . . . 75.319999999999993 111.172 179.928 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 4.1 mtp180 -52.32 -36.61 53.74 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.126 -0.488 . . . . 74.019999999999996 110.88 179.957 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -63.5 -34.14 77.12 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.188 -0.46 . . . . 64.439999999999998 110.837 -179.777 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . 0.558 HD12 ' CD1' ' A' ' 115' ' ' PHE . 3.3 mt -82.73 -43.52 18.8 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.145 -0.48 . . . . 72.329999999999998 111.155 179.922 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' TYR . . . . . 0.479 ' CD2' HG22 ' A' ' 50' ' ' ILE . 26.6 m-85 -108.82 46.62 0.96 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.156 -0.475 . . . . 75.040000000000006 110.929 -179.972 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 1.2 mtm -46.02 -58.35 3.66 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.099 -0.5 . . . . 73.129999999999995 110.846 179.948 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 20.2 m-20 -92.06 -5.65 52.47 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.259 -0.428 . . . . 75.150000000000006 110.881 179.952 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -102.96 30.28 4.9 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.213 -0.449 . . . . 72.329999999999998 110.865 179.991 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' PHE . . . . . 0.546 ' CE2' ' HB2' ' A' ' 48' ' ' PHE . 8.8 t80 -117.72 144.09 45.6 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.216 -0.447 . . . . 65.400000000000006 110.901 -179.93 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 21.9 m -123.52 133.07 54.05 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.152 -0.477 . . . . 75.319999999999993 111.115 -179.905 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -94.36 114.23 26.25 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.197 -0.456 . . . . 73.129999999999995 110.879 179.907 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . 0.497 ' CD2' ' HA ' ' A' ' 48' ' ' PHE . 1.7 pt? -113.52 -14.49 12.69 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.231 -0.44 . . . . 74.430000000000007 110.92 -179.947 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 34' ' ' THR . . . . . 0.407 ' O ' ' O ' ' A' ' 33' ' ' LEU . 0.2 OUTLIER . . . . . 0 C--N 1.329 -0.286 0 CA-C-N 116.148 -0.478 . . . . 43.130000000000003 111.147 179.966 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 45' ' ' GLN . . . . . 0.488 ' O ' ' CB ' ' A' ' 46' ' ' ILE . 32.6 tt0 . . . . . 0 C--O 1.232 0.14 0 CA-C-O 120.762 0.315 . . . . 75.450000000000003 110.918 . . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 46' ' ' ILE . . . . . 0.488 ' CB ' ' O ' ' A' ' 45' ' ' GLN . 0.0 OUTLIER 84.63 5.65 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.247 -0.433 . . . . 73.310000000000002 111.125 179.951 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . 0.43 ' O ' ' CD2' ' A' ' 33' ' ' LEU . 0.2 OUTLIER -63.54 141.57 17.97 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.159 -0.473 . . . . 65.25 111.15 179.82 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 48' ' ' PHE . . . . . 0.546 ' HB2' ' CE2' ' A' ' 30' ' ' PHE . 8.5 p90 -147.44 150.53 34.8 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.126 -0.488 . . . . 64.519999999999996 110.882 179.964 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 11.5 mt-10 -108.46 157.15 18.7 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.15 -0.477 . . . . 75.239999999999995 110.866 -179.903 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . 0.479 HG22 ' CD2' ' A' ' 26' ' ' TYR . 26.0 mm -136.15 141.87 40.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.159 -0.473 . . . . 74.430000000000007 111.126 179.969 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 52.8 m -89.39 126.36 35.51 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.197 -0.456 . . . . 71.019999999999996 111.125 179.949 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . 0.429 HD12 ' CD1' ' A' ' 66' ' ' LEU . 23.7 mt -130.34 162.05 29.93 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.212 -0.449 . . . . 75.200000000000003 110.921 179.95 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -179.26 173.88 1.08 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.207 -0.452 . . . . 74.019999999999996 110.859 179.919 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -64.69 166.66 8.42 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.207 -0.451 . . . . 73.319999999999993 110.857 -179.78 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 16.4 m -77.73 -28.56 15.74 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.11 -0.495 . . . . 74.120000000000005 111.099 179.988 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 3.1 t0 -118.78 -168.16 1.5 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.191 -0.459 . . . . 71.510000000000005 110.88 179.878 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 1.3 mmmp? -118.04 -16.81 9.79 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.208 -0.451 . . . . 74.420000000000002 110.877 -179.953 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . 0.552 ' HA ' ' C ' ' A' ' 59' ' ' PRO . 43.0 mt-10 -118.27 143.05 32.26 Favored Pre-proline 0 C--N 1.329 -0.31 0 CA-C-O 121.597 0.713 . . . . 71.129999999999995 110.921 179.969 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 59' ' ' PRO . . . . . 0.552 ' C ' ' HA ' ' A' ' 58' ' ' GLU . 53.6 Cg_endo -69.83 -10.89 11.87 Favored 'Cis proline' 0 C--O 1.232 0.191 0 C-N-CA 122.701 -1.791 . . . . 74.439999999999998 112.324 0.095 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 60' ' ' VAL . . . . . 0.435 ' HB ' ' CG ' ' A' ' 88' ' ' ASN . 9.4 m -149.41 172.11 1.68 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.236 -0.438 . . . . 74.310000000000002 111.128 179.91 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . 0.447 ' O ' ' C ' ' A' ' 62' ' ' SER . 1.0 OUTLIER -109.23 -16.64 14.02 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.155 -0.475 . . . . 62.439999999999998 110.879 -179.929 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 62' ' ' SER . . . . . 0.447 ' C ' ' O ' ' A' ' 61' ' ' GLU . 0.3 OUTLIER 34.2 88.54 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.137 -0.483 . . . . 64.400000000000006 110.888 -179.802 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 15.6 t -105.93 123.44 47.99 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.131 -0.486 . . . . 70.019999999999996 110.842 -179.799 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 64' ' ' ILE . . . . . . . . . . . . . 50.3 mt -141.01 137.88 34.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.124 -0.489 . . . . 73.510000000000005 111.172 179.937 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 62.5 m -97.68 114.75 26.78 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.173 -0.467 . . . . 71.430000000000007 111.206 179.918 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . 0.429 ' CD1' HD12 ' A' ' 52' ' ' LEU . 11.0 mt -91.46 111.85 23.52 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.221 -0.445 . . . . 62.399999999999999 110.96 179.951 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 1.1 t60 -107.72 112.29 24.9 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.209 -0.451 . . . . 73.319999999999993 110.839 179.899 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 68' ' ' PHE . . . . . 0.569 ' CZ ' HG22 ' A' ' 114' ' ' ILE . 0.0 OUTLIER -103.19 141.06 36.52 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.18 -0.464 . . . . 72.109999999999999 110.857 -179.91 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 69' ' ' ALA . . . . . 0.408 ' CB ' HG23 ' A' ' 47' ' ' ILE . . . -122.43 128.72 51.26 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.161 -0.472 . . . . 74.329999999999998 111.101 179.893 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 70' ' ' MET . . . . . 0.404 ' CB ' ' HG2' ' A' ' 15' ' ' GLN . 0.1 OUTLIER -94.6 110.08 21.93 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.222 -0.445 . . . . 75.120000000000005 110.905 179.959 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -62.38 157.98 51.37 Favored Pre-proline 0 C--N 1.33 -0.257 0 CA-C-O 121.61 0.719 . . . . 63.439999999999998 111.157 -179.931 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.78 2.52 3.47 Favored 'Trans proline' 0 C--N 1.342 0.2 0 C-N-CA 122.695 2.264 . . . . 71.030000000000001 112.318 179.989 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 73' ' ' MET . . . . . 0.507 ' O ' ' CB ' ' A' ' 76' ' ' TYR . 1.3 mtp -120.01 -25.39 5.8 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.23 -0.441 . . . . 52.229999999999997 110.854 179.952 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 74' ' ' TYR . . . . . 0.648 ' CD1' ' C ' ' A' ' 74' ' ' TYR . 0.1 OUTLIER -47.89 148.65 2.72 Favored Pre-proline 0 C--N 1.329 -0.325 0 CA-C-O 121.699 0.762 . . . . 73.040000000000006 110.885 -179.84 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 75' ' ' PRO . . . . . 0.542 ' C ' ' HA ' ' A' ' 74' ' ' TYR . 53.7 Cg_endo -69.8 -14.41 12.56 Favored 'Cis proline' 0 C--N 1.342 0.207 0 C-N-CA 122.631 -1.82 . . . . 75.319999999999993 112.348 -0.051 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 76' ' ' TYR . . . . . 0.507 ' CB ' ' O ' ' A' ' 73' ' ' MET . 10.3 t80 -33.36 -45.14 0.15 Allowed 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.215 -0.448 . . . . 75.409999999999997 110.928 -179.926 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 77' ' ' THR . . . . . 0.451 ' CG2' ' HB2' ' A' ' 73' ' ' MET . 59.7 p -110.82 178.12 4.46 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.077 -0.51 . . . . 73.019999999999996 111.147 -179.957 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -94.81 133.22 26.9 Favored Pre-proline 0 C--N 1.329 -0.301 0 CA-C-O 121.571 0.7 . . . . 61.149999999999999 111.091 179.856 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 79' ' ' PRO . . . . . 0.465 ' HG3' ' CD1' ' A' ' 113' ' ' ILE . 53.9 Cg_endo -69.74 -163.74 0.11 Allowed 'Trans proline' 0 C--N 1.341 0.138 0 C-N-CA 122.687 2.258 . . . . 71.239999999999995 112.32 -179.985 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 3.3 tt0 -148.52 136.61 21.0 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.192 -0.458 . . . . 53.530000000000001 110.884 -179.996 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 81' ' ' ILE . . . . . 0.48 ' CG1' ' HA ' ' A' ' 68' ' ' PHE . 12.4 mt -143.51 150.53 17.3 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.147 -0.479 . . . . 75.540000000000006 111.101 179.995 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . 0.479 ' HG3' ' CD ' ' A' ' 84' ' ' LYS . 10.1 pt-20 -147.69 148.25 30.83 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.156 -0.474 . . . . 72.530000000000001 110.871 179.956 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 83' ' ' PHE . . . . . 0.516 ' CZ ' ' HD3' ' A' ' 98' ' ' LYS . 8.0 m-85 -88.28 140.84 29.06 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.149 -0.478 . . . . 75.019999999999996 110.871 -179.92 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 84' ' ' LYS . . . . . 0.479 ' CD ' ' HG3' ' A' ' 82' ' ' GLU . 7.8 mmmt -125.68 174.57 8.2 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.179 -0.464 . . . . 74.010000000000005 110.91 179.927 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 85' ' ' ASN . . . . . 0.44 ' N ' HD21 ' A' ' 85' ' ' ASN . 1.7 m-80 61.99 -74.32 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.214 -0.448 . . . . 64.409999999999997 110.882 179.938 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 86' ' ' VAL . . . . . 0.47 ' N ' ' O ' ' A' ' 84' ' ' LYS . 3.5 m 41.42 90.53 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.227 -0.442 . . . . 63.030000000000001 111.132 179.924 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -102.89 -67.8 0.86 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.141 -0.481 . . . . 73.209999999999994 110.962 -179.992 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 88' ' ' ASN . . . . . 0.435 ' CG ' ' HB ' ' A' ' 60' ' ' VAL . 13.3 m120 -88.24 55.46 3.44 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.212 -0.449 . . . . 74.129999999999995 110.857 -179.958 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 1.6 p -156.21 138.48 6.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.171 -0.468 . . . . 73.340000000000003 111.102 179.891 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 90' ' ' MET . . . . . . . . . . . . . 11.2 mtm -83.95 -71.17 0.52 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.146 -0.479 . . . . 75.209999999999994 110.863 179.949 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 1.1 p30 176.9 -28.67 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.2 -0.454 . . . . 74.219999999999999 110.874 179.923 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -53.85 -44.11 70.07 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.228 -0.442 . . . . 74.140000000000001 110.824 -179.791 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 93' ' ' GLN . . . . . 0.517 ' HG3' ' CE2' ' A' ' 128' ' ' PHE . 0.1 OUTLIER -70.55 -38.55 74.17 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.129 -0.487 . . . . 73.549999999999997 110.892 -179.922 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . 0.421 ' CD2' HG12 ' A' ' 86' ' ' VAL . 0.1 OUTLIER -58.99 -49.2 78.78 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.192 -0.458 . . . . 73.400000000000006 110.891 -179.972 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 43.8 mt-30 -62.84 -34.69 77.86 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.203 -0.453 . . . . 65.25 110.938 179.911 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 96' ' ' MET . . . . . . . . . . . . . 24.2 ttp -61.12 -37.7 83.74 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.2 -0.454 . . . . 75.510000000000005 110.861 179.949 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 97' ' ' LEU . . . . . 0.591 ' O ' ' CD1' ' A' ' 101' ' ' PHE . 83.5 mt -65.33 -43.13 91.93 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.264 -0.425 . . . . 75.109999999999999 110.94 179.992 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 98' ' ' LYS . . . . . 0.516 ' HD3' ' CZ ' ' A' ' 83' ' ' PHE . 6.7 mmtp -58.67 -36.68 74.54 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.164 -0.471 . . . . 73.030000000000001 110.922 179.853 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -64.2 -44.93 90.46 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.187 -0.46 . . . . 75.230000000000004 110.817 -179.899 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 100' ' ' GLU . . . . . 0.525 ' HG2' ' CE1' ' A' ' 120' ' ' PHE . 2.5 mp0 -69.62 -25.39 63.92 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.137 -0.483 . . . . 71.540000000000006 110.868 -179.9 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 101' ' ' PHE . . . . . 0.591 ' CD1' ' O ' ' A' ' 97' ' ' LEU . 11.9 m-30 -60.06 -34.98 74.16 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.185 -0.461 . . . . 74.340000000000003 110.896 -179.927 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 4.2 tppp? -70.79 -38.78 73.39 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.187 -0.461 . . . . 73.510000000000005 110.877 179.954 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 25.2 mtmm -70.39 -42.9 71.11 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.187 -0.461 . . . . 73.140000000000001 110.881 179.92 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 3.9 mt -62.19 -47.38 93.39 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.224 -0.444 . . . . 72.120000000000005 111.133 179.883 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 105' ' ' HIS . . . . . . . . . . . . . 7.7 t60 -62.65 -42.63 99.71 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.17 -0.468 . . . . 74.209999999999994 110.815 179.887 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 1.2 m-20 -59.4 -43.52 92.97 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.195 -0.457 . . . . 75.549999999999997 110.888 -179.875 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 8.9 t -76.84 -27.64 55.18 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.192 -0.458 . . . . 62.219999999999999 111.12 -179.995 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -114.84 36.21 3.95 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.267 -0.424 . . . . 73.519999999999996 110.813 -179.83 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -78.38 75.38 4.9 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.185 -0.461 . . . . 74.430000000000007 110.877 -179.972 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 162.06 -27.34 0.26 Allowed Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.765 -0.731 . . . . 73.310000000000002 112.504 -179.986 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 111' ' ' GLN . . . . . . . . . . . . . 2.6 pt20 -120.06 -168.38 1.6 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.779 0.323 . . . . 75.549999999999997 110.94 -179.917 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 28.4 mt-10 -53.71 135.32 41.33 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.198 -0.456 . . . . 75.219999999999999 110.898 -179.961 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 113' ' ' ILE . . . . . 0.465 ' CD1' ' HG3' ' A' ' 79' ' ' PRO . 1.2 pt -126.5 -25.74 1.48 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 116.125 -0.488 . . . . 75.409999999999997 111.11 179.981 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 114' ' ' ILE . . . . . 0.569 HG22 ' CZ ' ' A' ' 68' ' ' PHE . 1.1 mp -57.07 -44.46 83.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.188 -0.46 . . . . 75.129999999999995 111.129 179.865 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 115' ' ' PHE . . . . . 0.558 ' CD1' HD12 ' A' ' 25' ' ' ILE . 39.8 t80 -64.35 -35.33 80.52 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.155 -0.475 . . . . 73.349999999999994 110.875 179.926 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 37.1 mm-40 -67.89 -44.87 76.0 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.13 -0.486 . . . . 75.519999999999996 110.903 -179.92 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 117' ' ' ILE . . . . . 0.521 HD13 ' CG ' ' A' ' 101' ' ' PHE . 0.3 OUTLIER -65.94 -40.83 88.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.153 -0.476 . . . . 71.319999999999993 111.114 179.987 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 118' ' ' THR . . . . . 0.464 ' N ' ' CG2' ' A' ' 117' ' ' ILE . 66.6 p -67.6 -43.86 79.46 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.177 -0.465 . . . . 73.530000000000001 111.175 179.911 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 45.2 t -68.32 -39.39 81.98 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.218 -0.446 . . . . 72.040000000000006 110.829 -179.814 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 120' ' ' PHE . . . . . 0.525 ' CE1' ' HG2' ' A' ' 100' ' ' GLU . 4.1 t80 -68.98 -48.13 63.9 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.115 -0.493 . . . . 63.229999999999997 110.904 -179.956 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 75.6 p -63.7 -39.98 95.66 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.129 -0.487 . . . . 74.129999999999995 111.108 -179.909 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 122' ' ' GLN . . . . . 0.456 ' NE2' ' O ' ' A' ' 122' ' ' GLN . 0.0 OUTLIER -64.63 -50.66 66.25 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.213 -0.449 . . . . 74.040000000000006 110.895 -179.981 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 123' ' ' GLU . . . . . 0.43 ' CG ' ' N ' ' A' ' 124' ' ' LYS . 5.7 pt-20 -65.87 -43.82 87.22 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.191 -0.459 . . . . 62.240000000000002 110.929 -179.97 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 124' ' ' LYS . . . . . 0.463 ' CE ' ' HA ' ' A' ' 124' ' ' LYS . 0.1 OUTLIER -68.77 -31.74 70.99 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.167 -0.47 . . . . 65.109999999999999 110.917 179.949 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 1.1 tp -71.47 -43.47 66.56 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.194 -0.457 . . . . 74.109999999999999 110.913 179.933 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 6.3 t0 -68.88 -46.6 68.0 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.168 -0.469 . . . . 75.439999999999998 110.881 179.843 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 127' ' ' GLU . . . . . 0.434 ' CG ' ' HA ' ' A' ' 124' ' ' LYS . 1.0 OUTLIER -60.26 -27.85 67.58 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.164 -0.471 . . . . 74.319999999999993 110.886 -179.901 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 128' ' ' PHE . . . . . 0.517 ' CE2' ' HG3' ' A' ' 93' ' ' GLN . 0.2 OUTLIER . . . . . 0 C--N 1.33 -0.265 0 CA-C-N 116.132 -0.485 . . . . 75.540000000000006 110.893 -179.909 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 18.3 mt . . . . . 0 C--O 1.23 0.071 0 CA-C-O 120.838 0.351 . . . . 73.219999999999999 110.905 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 9.8 t70 -53.59 -28.47 32.43 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.157 -0.474 . . . . 74.019999999999996 110.891 179.823 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . 0.427 ' O ' ' HG2' ' A' ' 13' ' ' GLU . 6.1 mm-40 -68.13 -38.65 82.43 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.208 -0.451 . . . . 71.510000000000005 110.93 -179.944 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 25.9 m-85 -70.37 -21.85 62.83 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.189 -0.46 . . . . 71.439999999999998 110.893 -179.867 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -57.23 -41.17 79.01 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.133 -0.485 . . . . 75.430000000000007 110.939 -179.952 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . 0.468 ' HG3' ' N ' ' A' ' 14' ' ' ILE . 4.1 pt-20 -66.32 -40.23 89.8 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.12 -0.491 . . . . 74.140000000000001 110.908 179.995 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' ILE . . . . . 0.468 ' N ' ' HG3' ' A' ' 13' ' ' GLU . 3.4 mp -67.76 -39.86 82.76 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-N 116.12 -0.491 . . . . 73.420000000000002 111.136 179.961 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 93.5 mt-30 -64.09 -48.37 76.41 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.206 -0.452 . . . . 73.409999999999997 110.915 179.933 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -63.9 -36.86 85.33 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.144 -0.48 . . . . 65.230000000000004 110.862 -179.918 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -58.05 -33.92 69.53 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.159 -0.473 . . . . 75.310000000000002 110.906 -179.872 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 1.2 mp0 -66.04 -38.17 87.73 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.182 -0.463 . . . . 74.129999999999995 110.891 179.996 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . 0.536 HD12 ' CE1' ' A' ' 48' ' ' PHE . 8.7 mp -65.6 -51.28 60.9 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.117 -0.492 . . . . 72.420000000000002 110.923 -179.954 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -68.64 -35.55 77.42 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.201 -0.454 . . . . 73.140000000000001 110.879 179.944 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -66.57 -50.53 62.79 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.182 -0.463 . . . . 62.310000000000002 111.127 179.884 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . 0.454 ' N ' HD13 ' A' ' 22' ' ' ILE . 0.7 OUTLIER -73.84 -34.19 39.46 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.239 -0.437 . . . . 72.239999999999995 111.117 179.971 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 34.4 mtp180 -52.25 -35.58 50.16 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.178 -0.464 . . . . 75.430000000000007 110.865 179.973 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -67.18 -35.05 78.83 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.173 -0.467 . . . . 73.349999999999994 110.863 -179.78 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 3.9 mt -78.11 -45.23 27.33 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.129 -0.487 . . . . 73.120000000000005 111.165 179.933 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 30.2 m-85 -109.9 43.32 1.36 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.148 -0.478 . . . . 73.230000000000004 110.924 -179.915 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 1.8 mtm -40.72 -55.63 2.35 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.094 -0.503 . . . . 75.439999999999998 110.877 179.926 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -86.85 -25.76 24.35 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.249 -0.432 . . . . 72.230000000000004 110.812 -179.979 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -92.77 31.21 1.42 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.183 -0.462 . . . . 73.510000000000005 110.882 179.989 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 10.1 t80 -115.59 130.55 56.91 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.155 -0.475 . . . . 74.519999999999996 110.882 -179.913 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 53.8 m -117.46 126.39 52.54 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.131 -0.486 . . . . 61.219999999999999 111.133 -179.916 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 4.6 t0 -101.04 114.81 29.09 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.201 -0.454 . . . . 64.239999999999995 110.868 179.913 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . 0.569 ' CD1' ' C ' ' A' ' 33' ' ' LEU . 0.2 OUTLIER -119.24 5.88 11.23 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.209 -0.451 . . . . 75.409999999999997 110.912 -179.943 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 34' ' ' THR . . . . . 0.423 ' N ' HD11 ' A' ' 33' ' ' LEU . 2.1 m . . . . . 0 C--N 1.33 -0.278 0 CA-C-N 116.18 -0.463 . . . . 71.0 111.14 179.934 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 45' ' ' GLN . . . . . 0.459 ' O ' ' CB ' ' A' ' 46' ' ' ILE . 12.8 tt0 . . . . . 0 C--O 1.232 0.133 0 CA-C-O 120.787 0.327 . . . . 74.549999999999997 110.911 . . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 46' ' ' ILE . . . . . 0.464 ' O ' ' C ' ' A' ' 47' ' ' ILE . 0.0 OUTLIER 81.89 -29.76 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.175 -0.466 . . . . 75.239999999999995 111.149 179.966 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . 0.464 ' C ' ' O ' ' A' ' 46' ' ' ILE . 0.2 OUTLIER -31.33 147.05 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 116.158 -0.474 . . . . 75.319999999999993 111.147 179.815 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 48' ' ' PHE . . . . . 0.536 ' CE1' HD12 ' A' ' 19' ' ' LEU . 2.0 p90 -158.9 166.35 32.05 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.207 -0.451 . . . . 74.340000000000003 110.843 179.968 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . 0.471 ' CG ' ' HB2' ' A' ' 67' ' ' HIS . 6.3 mt-10 -108.87 161.08 15.47 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.125 -0.489 . . . . 74.230000000000004 110.856 -179.926 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 8.6 mm -142.92 138.32 27.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-N 116.138 -0.483 . . . . 74.450000000000003 111.103 179.972 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 78.2 m -91.05 128.99 37.08 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.201 -0.454 . . . . 74.329999999999998 111.137 179.963 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 16.9 mt -130.32 166.02 21.27 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.254 -0.43 . . . . 74.349999999999994 110.934 179.946 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 53' ' ' ARG . . . . . 0.436 ' CB ' ' O ' ' A' ' 62' ' ' SER . 5.4 ptt180 -177.48 171.18 1.98 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.2 -0.454 . . . . 72.439999999999998 110.876 179.963 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 54' ' ' SER . . . . . 0.429 ' N ' ' OG ' ' A' ' 62' ' ' SER . 6.4 p -63.23 -175.8 0.12 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.196 -0.456 . . . . 73.0 110.829 -179.822 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 22.0 m -91.51 -22.96 5.96 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.118 -0.492 . . . . 71.209999999999994 111.13 179.936 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 3.2 t0 -118.55 -172.96 2.38 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.164 -0.471 . . . . 72.430000000000007 110.873 179.904 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -118.83 -4.05 10.72 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.166 -0.47 . . . . 73.540000000000006 110.886 -179.999 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . 0.528 ' HA ' ' C ' ' A' ' 59' ' ' PRO . 5.1 mm-40 -136.33 150.29 70.31 Favored Pre-proline 0 C--N 1.329 -0.287 0 CA-C-O 121.649 0.738 . . . . 73.219999999999999 110.911 179.937 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 59' ' ' PRO . . . . . 0.528 ' C ' ' HA ' ' A' ' 58' ' ' GLU . 54.1 Cg_endo -69.73 -1.85 6.81 Favored 'Cis proline' 0 C--N 1.341 0.162 0 C-N-CA 122.707 -1.789 . . . . 74.200000000000003 112.361 -0.038 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 60' ' ' VAL . . . . . 0.428 ' N ' ' HA ' ' A' ' 58' ' ' GLU . 34.5 m -144.86 168.6 9.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.231 -0.44 . . . . 72.209999999999994 111.162 179.883 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . 0.41 ' O ' ' O ' ' A' ' 62' ' ' SER . 22.3 tt0 -100.03 -29.14 12.7 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.168 -0.469 . . . . 65.420000000000002 110.909 -179.966 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 62' ' ' SER . . . . . 0.436 ' O ' ' CB ' ' A' ' 53' ' ' ARG . 20.1 p 50.69 102.86 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.155 -0.475 . . . . 74.340000000000003 110.852 -179.81 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 63' ' ' SER . . . . . 0.43 ' N ' HE21 ' A' ' 87' ' ' GLN . 49.7 p -129.55 122.93 30.18 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.133 -0.485 . . . . 72.230000000000004 110.831 -179.8 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 64' ' ' ILE . . . . . 0.467 HD13 ' CG2' ' A' ' 89' ' ' VAL . 52.8 mt -143.93 132.03 18.34 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.163 -0.472 . . . . 74.150000000000006 111.179 179.9 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 91.7 m -92.93 119.33 32.11 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.228 -0.442 . . . . 74.540000000000006 111.168 179.954 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . 0.499 ' HB3' ' CE2' ' A' ' 68' ' ' PHE . 1.5 mp -97.39 109.82 22.5 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.188 -0.46 . . . . 65.120000000000005 110.917 179.989 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 67' ' ' HIS . . . . . 0.567 ' CE1' HD22 ' A' ' 33' ' ' LEU . 39.9 t60 -102.05 109.69 21.47 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.152 -0.476 . . . . 73.409999999999997 110.841 179.873 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 68' ' ' PHE . . . . . 0.499 ' CE2' ' HB3' ' A' ' 66' ' ' LEU . 0.0 OUTLIER -104.08 139.91 38.51 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.184 -0.462 . . . . 73.239999999999995 110.873 -179.919 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 69' ' ' ALA . . . . . 0.443 ' O ' ' CB ' ' A' ' 79' ' ' PRO . . . -121.23 120.6 35.65 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.168 -0.469 . . . . 65.230000000000004 111.116 179.912 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 70' ' ' MET . . . . . 0.47 ' HE3' ' CG1' ' A' ' 114' ' ' ILE . 1.7 mmt -85.34 89.95 7.8 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.241 -0.436 . . . . 64.129999999999995 110.875 179.998 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -41.26 160.33 0.15 Allowed Pre-proline 0 C--N 1.33 -0.277 0 CA-C-O 121.595 0.712 . . . . 73.349999999999994 111.13 -179.913 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.78 2.97 3.06 Favored 'Trans proline' 0 C--N 1.341 0.162 0 C-N-CA 122.704 2.269 . . . . 71.510000000000005 112.34 179.953 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 73' ' ' MET . . . . . 0.501 ' O ' ' CB ' ' A' ' 76' ' ' TYR . 0.1 OUTLIER -121.44 -25.24 5.21 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.216 -0.447 . . . . 74.109999999999999 110.911 179.869 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 74' ' ' TYR . . . . . 0.632 ' CD1' ' C ' ' A' ' 74' ' ' TYR . 0.0 OUTLIER -46.95 149.86 1.47 Allowed Pre-proline 0 C--N 1.329 -0.315 0 CA-C-O 121.684 0.754 . . . . 70.049999999999997 110.945 -179.904 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 75' ' ' PRO . . . . . 0.56 ' HA ' ' CD2' ' A' ' 74' ' ' TYR . 53.7 Cg_endo -69.75 -10.79 11.65 Favored 'Cis proline' 0 C--O 1.232 0.186 0 C-N-CA 122.673 -1.803 . . . . 74.099999999999994 112.338 -0.103 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 76' ' ' TYR . . . . . 0.501 ' CB ' ' O ' ' A' ' 73' ' ' MET . 20.9 t80 -33.81 -45.46 0.19 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.262 -0.427 . . . . 74.219999999999999 110.937 -179.924 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 16.8 p -114.86 -175.03 2.6 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.118 -0.492 . . . . 74.209999999999994 111.152 179.998 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -99.94 132.96 22.01 Favored Pre-proline 0 C--N 1.329 -0.291 0 CA-C-O 121.566 0.698 . . . . 72.310000000000002 111.123 179.863 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 79' ' ' PRO . . . . . 0.443 ' CB ' ' O ' ' A' ' 69' ' ' ALA . 54.0 Cg_endo -69.75 -164.21 0.12 Allowed 'Trans proline' 0 C--N 1.341 0.175 0 C-N-CA 122.71 2.273 . . . . 73.099999999999994 112.336 180.0 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 9.4 tt0 -131.73 129.2 40.33 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.171 -0.468 . . . . 63.350000000000001 110.857 -179.944 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 5.1 mm -120.64 145.58 26.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.157 -0.474 . . . . 74.319999999999993 111.085 179.994 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . 0.494 ' HG3' ' CD ' ' A' ' 84' ' ' LYS . 4.2 pt-20 -149.01 136.44 20.24 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.162 -0.472 . . . . 64.319999999999993 110.898 179.944 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 83' ' ' PHE . . . . . 0.497 ' CG ' HD23 ' A' ' 94' ' ' LEU . 38.5 m-85 -93.08 138.63 31.36 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.156 -0.474 . . . . 75.319999999999993 110.836 -179.888 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 84' ' ' LYS . . . . . 0.494 ' CD ' ' HG3' ' A' ' 82' ' ' GLU . 9.7 mmmt -124.93 171.88 9.84 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.113 -0.494 . . . . 72.109999999999999 110.915 179.942 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 85' ' ' ASN . . . . . 0.434 ' C ' HG23 ' A' ' 86' ' ' VAL . 7.8 m-80 61.24 -74.47 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.2 -0.455 . . . . 70.409999999999997 110.923 179.978 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 86' ' ' VAL . . . . . 0.487 ' N ' ' O ' ' A' ' 84' ' ' LYS . 2.8 m 41.61 84.59 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.179 -0.464 . . . . 74.430000000000007 111.092 179.864 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 87' ' ' GLN . . . . . 0.43 HE21 ' N ' ' A' ' 63' ' ' SER . 0.4 OUTLIER -93.06 -79.66 0.4 Allowed 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.18 -0.464 . . . . 72.049999999999997 110.923 -179.984 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -54.41 -44.16 72.12 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.194 -0.457 . . . . 73.400000000000006 110.887 -179.988 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 89' ' ' VAL . . . . . 0.467 ' CG2' HD13 ' A' ' 64' ' ' ILE . 1.7 t -62.21 151.74 7.36 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.163 -0.472 . . . . 63.329999999999998 111.136 179.932 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 90' ' ' MET . . . . . . . . . . . . . 14.8 mtm -102.25 -70.35 0.75 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.192 -0.458 . . . . 73.310000000000002 110.864 179.897 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 3.0 p-10 -172.26 -36.95 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.255 -0.429 . . . . 74.019999999999996 110.898 179.989 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -54.28 -41.51 68.95 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.179 -0.464 . . . . 74.109999999999999 110.843 -179.802 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 93' ' ' GLN . . . . . 0.478 ' CD ' ' CD2' ' A' ' 128' ' ' PHE . 0.8 OUTLIER -69.03 -42.03 76.91 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.16 -0.473 . . . . 75.019999999999996 110.95 -179.965 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . 0.497 HD23 ' CG ' ' A' ' 83' ' ' PHE . 50.8 mt -59.36 -49.03 79.38 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.137 -0.483 . . . . 72.25 110.931 -179.993 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 1.8 mm100 -65.98 -36.13 82.48 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.148 -0.478 . . . . 75.140000000000001 110.905 179.921 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 96' ' ' MET . . . . . 0.453 ' SD ' ' CE1' ' A' ' 128' ' ' PHE . 49.8 ttp -60.89 -38.58 86.15 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.168 -0.469 . . . . 72.049999999999997 110.851 179.99 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 97' ' ' LEU . . . . . 0.61 ' O ' ' CD1' ' A' ' 101' ' ' PHE . 98.4 mt -60.62 -46.8 88.92 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.238 -0.437 . . . . 71.420000000000002 110.959 -179.984 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 12.8 mmtm -55.8 -34.66 65.53 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.148 -0.478 . . . . 73.319999999999993 110.878 179.822 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 67.1 m -68.7 -45.74 70.82 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.25 -0.432 . . . . 63.130000000000003 110.861 -179.87 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 8.6 pt-20 -75.16 -23.47 57.77 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.106 -0.497 . . . . 72.150000000000006 110.885 -179.958 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 101' ' ' PHE . . . . . 0.61 ' CD1' ' O ' ' A' ' 97' ' ' LEU . 8.0 m-30 -59.09 -34.37 71.92 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.175 -0.466 . . . . 73.409999999999997 110.877 -179.933 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.34 -42.83 98.97 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.114 -0.494 . . . . 71.219999999999999 110.929 179.989 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 21.0 mtmm -64.91 -37.81 88.89 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.2 -0.455 . . . . 72.120000000000005 110.916 179.818 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 104' ' ' ILE . . . . . 0.517 HD12 ' CD2' ' A' ' 120' ' ' PHE . 3.0 mt -65.01 -47.55 87.58 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 116.236 -0.438 . . . . 72.409999999999997 111.132 179.853 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 105' ' ' HIS . . . . . . . . . . . . . 4.3 t60 -62.97 -41.49 99.55 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.172 -0.467 . . . . 74.329999999999998 110.868 179.901 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -60.63 -43.3 97.67 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.188 -0.46 . . . . 72.409999999999997 110.887 -179.952 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 9.2 t -78.95 -28.74 43.73 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.194 -0.457 . . . . 75.430000000000007 111.172 179.986 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 12.5 m -114.77 40.4 2.61 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.239 -0.437 . . . . 63.450000000000003 110.845 -179.839 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 34.5 ttt180 -84.8 90.32 7.73 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.14 -0.482 . . . . 74.420000000000002 110.837 -179.927 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 110' ' ' GLY . . . . . 0.44 ' HA2' ' CB ' ' A' ' 75' ' ' PRO . . . 110.59 45.33 0.91 Allowed Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.725 -0.75 . . . . 74.5 112.49 -179.973 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 111' ' ' GLN . . . . . 0.422 ' O ' ' CB ' ' A' ' 112' ' ' GLU . 5.1 pt20 -174.33 28.52 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.745 0.307 . . . . 72.420000000000002 110.897 -179.918 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 112' ' ' GLU . . . . . 0.422 ' CB ' ' O ' ' A' ' 111' ' ' GLN . 0.2 OUTLIER 78.07 135.73 0.06 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.207 -0.451 . . . . 62.520000000000003 110.87 -179.989 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 113' ' ' ILE . . . . . . . . . . . . . 31.9 pt -133.46 -0.31 1.43 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.183 -0.462 . . . . 73.109999999999999 111.136 179.968 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 114' ' ' ILE . . . . . 0.47 ' CG1' ' HE3' ' A' ' 70' ' ' MET . 25.6 mm -63.34 -45.43 98.15 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.2 -0.454 . . . . 74.430000000000007 111.132 179.876 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 115' ' ' PHE . . . . . . . . . . . . . 26.6 t80 -72.65 -34.63 67.4 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.188 -0.46 . . . . 75.409999999999997 110.874 179.93 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 4.3 mm-40 -67.8 -47.63 68.57 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.144 -0.48 . . . . 62.229999999999997 110.893 -179.928 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 117' ' ' ILE . . . . . 0.563 HD12 ' CD2' ' A' ' 101' ' ' PHE . 0.9 OUTLIER -63.47 -40.61 89.69 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.14 -0.482 . . . . 74.219999999999999 111.103 179.976 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 118' ' ' THR . . . . . 0.459 ' N ' ' CG2' ' A' ' 117' ' ' ILE . 64.5 p -68.07 -42.77 79.91 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.169 -0.469 . . . . 53.409999999999997 111.108 -179.955 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 67.6 m -67.89 -44.25 77.43 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.225 -0.443 . . . . 71.329999999999998 110.853 -179.843 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 120' ' ' PHE . . . . . 0.517 ' CD2' HD12 ' A' ' 104' ' ' ILE . 0.2 OUTLIER -60.74 -50.27 74.15 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.139 -0.482 . . . . 74.329999999999998 110.888 -179.959 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 121' ' ' THR . . . . . 0.403 ' CG2' ' CE1' ' A' ' 101' ' ' PHE . 81.4 p -65.54 -40.71 93.22 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.171 -0.468 . . . . 70.329999999999998 111.146 -179.95 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 8.4 tm0? -64.23 -38.85 92.52 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.191 -0.459 . . . . 71.329999999999998 110.911 -179.985 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 4.4 pt-20 -77.5 -40.48 42.69 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.216 -0.447 . . . . 72.150000000000006 110.916 -179.976 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 124' ' ' LYS . . . . . 0.466 ' CE ' ' HA ' ' A' ' 124' ' ' LYS . 0.0 OUTLIER -68.57 -41.06 80.27 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.128 -0.487 . . . . 75.310000000000002 110.815 -179.982 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 125' ' ' LEU . . . . . 0.431 ' CD2' ' O ' ' A' ' 125' ' ' LEU . 0.5 OUTLIER -68.39 -38.26 81.15 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.253 -0.43 . . . . 74.209999999999994 110.926 179.945 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 126' ' ' ASP . . . . . 0.433 ' C ' ' OD1' ' A' ' 126' ' ' ASP . 1.2 t0 -61.78 -45.59 93.22 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.202 -0.454 . . . . 54.329999999999998 110.886 179.817 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 127' ' ' GLU . . . . . 0.434 ' HG3' ' N ' ' A' ' 128' ' ' PHE . 7.4 pt-20 -69.68 -31.17 69.06 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.202 -0.454 . . . . 72.450000000000003 110.899 -179.892 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 128' ' ' PHE . . . . . 0.478 ' CD2' ' CD ' ' A' ' 93' ' ' GLN . 0.3 OUTLIER . . . . . 0 C--N 1.329 -0.302 0 CA-C-N 116.138 -0.483 . . . . 74.420000000000002 110.836 -179.886 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 76.0 mt . . . . . 0 C--O 1.231 0.119 0 CA-C-O 120.813 0.339 . . . . 75.200000000000003 110.955 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -51.62 -34.64 38.43 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.169 -0.469 . . . . 70.310000000000002 110.828 179.883 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 16.1 mm-40 -67.95 -35.11 77.83 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.212 -0.449 . . . . 74.349999999999994 110.883 -179.863 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 11' ' ' TYR . . . . . 0.421 ' CD1' ' HD2' ' A' ' 75' ' ' PRO . 15.1 m-85 -65.77 -25.06 67.09 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.2 -0.455 . . . . 64.150000000000006 110.916 -179.852 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -64.59 -37.85 88.99 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.105 -0.498 . . . . 72.329999999999998 110.911 -179.884 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 2.5 mm-40 -61.56 -44.15 97.56 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.144 -0.48 . . . . 73.120000000000005 110.885 179.985 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 5.2 mp -68.03 -40.12 82.63 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.125 -0.489 . . . . 71.129999999999995 111.135 179.971 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 59.1 mt-30 -65.22 -46.33 81.09 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.159 -0.473 . . . . 63.140000000000001 110.881 179.946 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 7.0 t -63.19 -36.56 84.05 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.254 -0.43 . . . . 73.439999999999998 110.881 -179.946 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' ASN . . . . . 0.432 ' OD1' ' N ' ' A' ' 18' ' ' GLU . 0.2 OUTLIER -58.36 -33.72 69.89 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.154 -0.476 . . . . 73.239999999999995 110.889 -179.907 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . 0.432 ' N ' ' OD1' ' A' ' 17' ' ' ASN . 1.3 mp0 -66.33 -37.78 86.15 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.18 -0.464 . . . . 75.430000000000007 110.886 -179.985 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . 0.502 ' N ' HD13 ' A' ' 19' ' ' LEU . 8.8 mp -64.44 -51.51 62.75 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.18 -0.464 . . . . 75.049999999999997 110.908 -179.976 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 1.4 pt-20 -68.5 -35.86 78.1 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.202 -0.454 . . . . 73.430000000000007 110.933 179.918 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -66.66 -47.1 73.59 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.124 -0.489 . . . . 74.540000000000006 111.068 179.944 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . 0.468 ' N ' HD13 ' A' ' 22' ' ' ILE . 0.7 OUTLIER -76.21 -34.27 25.66 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-N 116.261 -0.427 . . . . 61.549999999999997 111.167 179.955 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -52.32 -34.18 45.84 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.144 -0.48 . . . . 73.430000000000007 110.87 179.973 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -66.37 -32.15 73.36 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.219 -0.446 . . . . 70.430000000000007 110.879 -179.823 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . 0.486 ' CD1' ' CE1' ' A' ' 115' ' ' PHE . 3.3 mt -84.77 -43.84 17.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.118 -0.492 . . . . 70.420000000000002 111.121 179.95 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' TYR . . . . . 0.439 ' CD2' HG22 ' A' ' 50' ' ' ILE . 19.5 m-85 -107.5 45.36 1.0 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.176 -0.465 . . . . 73.450000000000003 110.903 -179.95 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 4.1 mtm -46.26 -47.82 18.07 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.132 -0.485 . . . . 75.040000000000006 110.869 179.887 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 7.1 m-20 -98.74 -27.2 14.07 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.219 -0.446 . . . . 64.450000000000003 110.859 179.952 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 84.6 m-20 -86.11 34.4 0.62 Allowed 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.214 -0.448 . . . . 73.420000000000002 110.862 -179.995 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' PHE . . . . . 0.612 ' C ' ' CD1' ' A' ' 30' ' ' PHE . 0.1 OUTLIER -117.46 144.12 45.35 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.176 -0.465 . . . . 72.219999999999999 110.923 -179.935 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 24.4 m -127.08 135.07 50.25 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.141 -0.481 . . . . 72.219999999999999 111.18 -179.926 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -97.82 114.81 26.94 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.227 -0.442 . . . . 70.140000000000001 110.83 179.948 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . 0.559 ' C ' ' CD2' ' A' ' 33' ' ' LEU . 0.1 OUTLIER -121.81 -9.65 8.8 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.216 -0.447 . . . . 74.430000000000007 110.95 -179.979 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 34' ' ' THR . . . . . 0.45 ' C ' ' O ' ' A' ' 33' ' ' LEU . 0.2 OUTLIER . . . . . 0 C--N 1.33 -0.262 0 CA-C-N 116.174 -0.466 . . . . 75.200000000000003 111.163 179.933 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 45' ' ' GLN . . . . . 0.532 ' O ' ' CB ' ' A' ' 46' ' ' ILE . 15.1 pt20 . . . . . 0 C--O 1.231 0.11 0 CA-C-O 120.79 0.328 . . . . 74.049999999999997 110.929 . . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 46' ' ' ILE . . . . . 0.532 ' CB ' ' O ' ' A' ' 45' ' ' GLN . 0.2 OUTLIER 87.16 -21.88 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.174 -0.466 . . . . 65.519999999999996 111.142 -180.0 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . 0.495 ' N ' HD13 ' A' ' 47' ' ' ILE . 0.2 OUTLIER -36.5 144.54 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.205 -0.452 . . . . 74.420000000000002 111.171 179.849 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 48' ' ' PHE . . . . . 0.439 ' CE1' HD11 ' A' ' 19' ' ' LEU . 0.9 OUTLIER -161.59 158.37 26.15 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.183 -0.462 . . . . 74.239999999999995 110.896 -179.994 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . 0.477 ' CG ' ' CD1' ' A' ' 33' ' ' LEU . 20.4 mt-10 -108.76 160.99 15.52 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.137 -0.483 . . . . 72.530000000000001 110.866 -179.922 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . 0.439 HG22 ' CD2' ' A' ' 26' ' ' TYR . 15.4 mm -141.66 135.55 30.44 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.151 -0.477 . . . . 72.530000000000001 111.131 179.975 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 90.2 m -83.73 137.08 33.92 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.136 -0.484 . . . . 72.519999999999996 111.195 179.946 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 14.2 mt -136.69 160.23 39.46 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.216 -0.447 . . . . 74.230000000000004 110.92 179.943 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 7.4 ptt85 -176.14 161.6 2.38 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.18 -0.464 . . . . 73.549999999999997 110.829 179.965 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -53.63 -176.68 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.154 -0.475 . . . . 75.019999999999996 110.886 -179.823 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 15.9 m -94.41 -25.69 4.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.169 -0.469 . . . . 73.319999999999993 111.084 179.984 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -124.47 -165.99 1.45 Allowed 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.179 -0.464 . . . . 74.310000000000002 110.881 179.92 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -114.76 -14.58 11.97 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.191 -0.458 . . . . 75.420000000000002 110.854 -179.954 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . 0.543 ' HA ' ' C ' ' A' ' 59' ' ' PRO . 7.5 pt-20 -119.49 143.22 34.15 Favored Pre-proline 0 C--N 1.329 -0.294 0 CA-C-O 121.644 0.735 . . . . 63.229999999999997 110.859 -179.995 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 59' ' ' PRO . . . . . 0.543 ' C ' ' HA ' ' A' ' 58' ' ' GLU . 54.3 Cg_endo -69.81 -9.2 10.99 Favored 'Cis proline' 0 C--O 1.232 0.188 0 C-N-CA 122.632 -1.82 . . . . 71.439999999999998 112.364 0.025 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 60' ' ' VAL . . . . . 0.449 ' HB ' ' CG ' ' A' ' 88' ' ' ASN . 12.0 m -153.89 176.54 0.48 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.242 -0.436 . . . . 71.140000000000001 111.164 179.903 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . 0.461 ' O ' ' C ' ' A' ' 62' ' ' SER . 6.0 tt0 -107.93 -18.0 13.91 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.203 -0.453 . . . . 74.150000000000006 110.917 179.963 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 62' ' ' SER . . . . . 0.461 ' C ' ' O ' ' A' ' 61' ' ' GLU . 0.1 OUTLIER 33.7 90.05 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.191 -0.459 . . . . 73.519999999999996 110.845 -179.846 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -103.66 122.85 45.87 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.151 -0.477 . . . . 74.209999999999994 110.866 -179.801 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 64' ' ' ILE . . . . . 0.458 HG21 ' N ' ' A' ' 65' ' ' THR . 12.5 mt -141.37 150.42 19.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.156 -0.475 . . . . 75.420000000000002 111.113 179.972 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 65' ' ' THR . . . . . 0.458 ' N ' HG21 ' A' ' 64' ' ' ILE . 84.0 m -118.96 117.34 28.55 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.153 -0.476 . . . . 72.129999999999995 111.135 179.972 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . 0.572 HD23 ' CE1' ' A' ' 83' ' ' PHE . 11.4 mt -95.04 111.9 23.66 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.217 -0.447 . . . . 74.420000000000002 110.912 179.979 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 67' ' ' HIS . . . . . 0.415 ' CG ' ' HG2' ' A' ' 49' ' ' GLU . 0.9 OUTLIER -102.11 111.88 24.33 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.152 -0.476 . . . . 74.510000000000005 110.843 179.855 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 68' ' ' PHE . . . . . 0.467 ' CE1' HG22 ' A' ' 114' ' ' ILE . 0.0 OUTLIER -103.83 139.95 38.33 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.195 -0.457 . . . . 72.040000000000006 110.889 -179.959 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 69' ' ' ALA . . . . . 0.464 ' CB ' HG21 ' A' ' 47' ' ' ILE . . . -119.67 118.4 30.83 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.123 -0.49 . . . . 65.140000000000001 111.096 179.897 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 70' ' ' MET . . . . . 0.418 ' HE2' ' CG1' ' A' ' 114' ' ' ILE . 2.3 mmt -84.08 99.13 10.27 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.238 -0.437 . . . . 70.209999999999994 110.883 179.942 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -53.25 159.86 1.94 Allowed Pre-proline 0 C--N 1.33 -0.275 0 CA-C-O 121.553 0.692 . . . . 71.040000000000006 111.14 -179.912 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.73 -2.22 9.79 Favored 'Trans proline' 0 C--N 1.341 0.167 0 C-N-CA 122.69 2.26 . . . . 71.219999999999999 112.376 179.887 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 73' ' ' MET . . . . . 0.496 ' O ' ' CB ' ' A' ' 76' ' ' TYR . 0.1 OUTLIER -115.83 -23.33 8.67 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.234 -0.439 . . . . 75.450000000000003 110.914 179.902 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 74' ' ' TYR . . . . . 0.665 ' CD1' ' C ' ' A' ' 74' ' ' TYR . 0.0 OUTLIER -48.49 151.53 1.93 Allowed Pre-proline 0 C--N 1.328 -0.353 0 CA-C-O 121.69 0.757 . . . . 73.129999999999995 110.924 -179.907 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 75' ' ' PRO . . . . . 0.571 ' HA ' ' CD2' ' A' ' 74' ' ' TYR . 53.7 Cg_endo -69.73 -9.99 11.23 Favored 'Cis proline' 0 C--N 1.341 0.184 0 C-N-CA 122.633 -1.819 . . . . 75.510000000000005 112.386 -0.109 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 76' ' ' TYR . . . . . 0.496 ' CB ' ' O ' ' A' ' 73' ' ' MET . 16.3 t80 -34.41 -52.3 0.48 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.172 -0.467 . . . . 74.420000000000002 110.916 -179.911 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 62.1 p -101.41 -171.56 2.01 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.094 -0.503 . . . . 72.150000000000006 111.158 -179.956 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -108.65 131.31 21.85 Favored Pre-proline 0 C--N 1.328 -0.335 0 CA-C-O 121.57 0.7 . . . . 70.439999999999998 111.142 179.842 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 79' ' ' PRO . . . . . 0.464 ' HG3' ' CD1' ' A' ' 113' ' ' ILE . 53.5 Cg_endo -69.82 -170.14 0.38 Allowed 'Trans proline' 0 C--N 1.342 0.192 0 C-N-CA 122.688 2.259 . . . . 72.200000000000003 112.344 -179.964 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -127.37 127.36 44.08 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.242 -0.436 . . . . 74.030000000000001 110.854 -179.963 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 10.2 mm -120.4 139.13 48.65 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.156 -0.475 . . . . 73.329999999999998 111.102 179.956 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . 0.475 ' HG3' ' CD ' ' A' ' 84' ' ' LYS . 7.2 pt-20 -148.34 144.04 27.28 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.144 -0.48 . . . . 63.43 110.866 179.948 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 83' ' ' PHE . . . . . 0.572 ' CE1' HD23 ' A' ' 66' ' ' LEU . 22.5 m-85 -93.76 141.14 28.84 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.132 -0.486 . . . . 74.349999999999994 110.895 -179.963 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 84' ' ' LYS . . . . . 0.475 ' CD ' ' HG3' ' A' ' 82' ' ' GLU . 9.6 mmmt -124.89 171.05 10.49 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.124 -0.489 . . . . 73.200000000000003 110.903 179.968 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 85' ' ' ASN . . . . . 0.425 ' C ' HG21 ' A' ' 86' ' ' VAL . 1.9 m-80 62.81 -74.22 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.216 -0.447 . . . . 72.0 110.918 179.977 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 86' ' ' VAL . . . . . 0.465 ' N ' ' O ' ' A' ' 84' ' ' LYS . 3.2 m 41.5 92.08 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.144 -0.48 . . . . 73.239999999999995 111.144 179.901 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -102.54 -69.59 0.78 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.21 -0.45 . . . . 73.0 110.868 -179.945 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 88' ' ' ASN . . . . . 0.449 ' CG ' ' HB ' ' A' ' 60' ' ' VAL . 14.6 m-80 -83.31 53.11 2.38 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.191 -0.459 . . . . 73.329999999999998 110.851 -179.909 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 89' ' ' VAL . . . . . 0.525 ' CG2' ' CD2' ' A' ' 94' ' ' LEU . 2.1 p -165.27 133.85 0.63 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.173 -0.467 . . . . 75.129999999999995 111.1 179.904 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 90' ' ' MET . . . . . . . . . . . . . 1.4 mtm -78.36 -70.43 0.49 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.123 -0.49 . . . . 62.210000000000001 110.885 179.888 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 5.1 p-10 -176.34 -30.95 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.195 -0.457 . . . . 55.409999999999997 110.857 179.981 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -53.65 -37.65 63.32 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.185 -0.461 . . . . 74.310000000000002 110.906 -179.792 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 93' ' ' GLN . . . . . 0.512 ' HG2' ' CZ ' ' A' ' 128' ' ' PHE . 1.4 mp0 -71.03 -38.37 72.58 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.108 -0.496 . . . . 73.200000000000003 110.917 -179.945 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . 0.525 ' CD2' ' CG2' ' A' ' 89' ' ' VAL . 1.1 mm? -64.78 -47.21 78.95 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.166 -0.47 . . . . 72.319999999999993 110.907 -179.964 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 44.6 mt-30 -65.17 -34.0 77.35 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.16 -0.473 . . . . 72.340000000000003 110.905 179.952 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 96' ' ' MET . . . . . . . . . . . . . 32.0 ttp -59.85 -37.88 80.52 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.184 -0.462 . . . . 73.209999999999994 110.913 179.951 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 97' ' ' LEU . . . . . 0.477 ' O ' ' CD1' ' A' ' 101' ' ' PHE . 17.1 mt -71.97 -38.9 69.66 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.188 -0.46 . . . . 70.239999999999995 110.902 179.961 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 98' ' ' LYS . . . . . 0.456 ' HD3' ' CZ ' ' A' ' 83' ' ' PHE . 7.0 mmtt -54.64 -37.11 65.28 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.206 -0.452 . . . . 72.510000000000005 110.903 179.847 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -64.45 -38.69 91.9 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.217 -0.447 . . . . 74.239999999999995 110.864 -179.861 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 1.4 mp0 -72.94 -24.1 60.77 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.145 -0.48 . . . . 70.549999999999997 110.905 179.995 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 101' ' ' PHE . . . . . 0.511 ' CG ' HD11 ' A' ' 117' ' ' ILE . 8.9 m-30 -59.75 -35.19 74.1 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.117 -0.492 . . . . 74.099999999999994 110.935 -179.951 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.51 -38.29 84.07 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.143 -0.48 . . . . 75.530000000000001 110.881 179.959 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 21.8 mtmt -70.04 -43.19 71.76 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.264 -0.426 . . . . 73.109999999999999 110.927 179.846 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 3.0 mt -62.16 -47.45 93.06 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.185 -0.461 . . . . 73.400000000000006 111.102 179.901 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 105' ' ' HIS . . . . . 0.465 ' O ' ' N ' ' A' ' 109' ' ' ARG . 1.8 t60 -62.87 -41.09 99.26 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.163 -0.471 . . . . 75.140000000000001 110.832 179.932 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 1.3 m-80 -58.14 -39.25 78.3 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.246 -0.434 . . . . 71.430000000000007 110.834 -179.901 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 9.4 t -90.12 -13.18 36.28 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.195 -0.457 . . . . 75.099999999999994 111.091 -179.921 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 58.8 m -116.78 17.5 15.12 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.241 -0.436 . . . . 72.019999999999996 110.863 -179.845 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 109' ' ' ARG . . . . . 0.465 ' N ' ' O ' ' A' ' 105' ' ' HIS . 21.4 ttp180 -67.17 76.16 0.14 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.098 -0.501 . . . . 71.239999999999995 110.884 -179.98 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 149.05 -21.63 1.25 Allowed Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.77 -0.728 . . . . 73.109999999999999 112.505 -179.954 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 111' ' ' GLN . . . . . . . . . . . . . 10.6 pt20 -116.84 -165.48 1.07 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.765 0.317 . . . . 73.329999999999998 110.894 -179.891 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 23.4 mt-10 -67.05 134.29 51.6 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.189 -0.46 . . . . 63.020000000000003 110.871 -179.943 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 113' ' ' ILE . . . . . 0.464 ' CD1' ' HG3' ' A' ' 79' ' ' PRO . 22.4 pt -124.5 -14.66 5.07 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 116.131 -0.486 . . . . 75.109999999999999 111.117 179.984 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 114' ' ' ILE . . . . . 0.467 HG22 ' CE1' ' A' ' 68' ' ' PHE . 14.5 mm -63.03 -43.83 99.26 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.157 -0.474 . . . . 75.450000000000003 111.15 179.81 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 115' ' ' PHE . . . . . 0.486 ' CE1' ' CD1' ' A' ' 25' ' ' ILE . 16.2 t80 -72.52 -35.97 68.21 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.145 -0.48 . . . . 72.349999999999994 110.91 179.944 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 5.2 mm-40 -66.02 -46.77 76.69 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.189 -0.459 . . . . 62.539999999999999 110.922 -179.954 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 117' ' ' ILE . . . . . 0.511 HD11 ' CG ' ' A' ' 101' ' ' PHE . 0.7 OUTLIER -64.37 -43.06 97.03 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.159 -0.473 . . . . 74.510000000000005 111.137 179.93 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 118' ' ' THR . . . . . 0.49 ' N ' ' CG2' ' A' ' 117' ' ' ILE . 72.7 p -67.83 -43.03 80.49 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.192 -0.458 . . . . 61.030000000000001 111.127 179.972 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 4.0 m -63.86 -44.48 92.99 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.245 -0.434 . . . . 75.129999999999995 110.843 -179.835 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -65.41 -48.74 71.77 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.176 -0.465 . . . . 74.430000000000007 110.906 -179.984 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 25.3 p -63.7 -38.62 91.8 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.154 -0.475 . . . . 74.420000000000002 111.137 -179.912 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 27.7 tt0 -63.23 -41.44 99.11 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.202 -0.453 . . . . 64.439999999999998 110.903 -179.963 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 123' ' ' GLU . . . . . 0.497 ' O ' ' CG ' ' A' ' 127' ' ' GLU . 4.2 pt-20 -75.95 -35.61 59.64 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.245 -0.434 . . . . 74.349999999999994 110.861 -179.946 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 124' ' ' LYS . . . . . 0.48 ' HA ' ' CG ' ' A' ' 127' ' ' GLU . 0.0 OUTLIER -68.61 -35.22 77.03 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.14 -0.482 . . . . 74.420000000000002 110.901 179.966 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 125' ' ' LEU . . . . . 0.537 ' C ' ' CD2' ' A' ' 125' ' ' LEU . 4.0 tt -72.93 -43.67 62.1 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.274 -0.421 . . . . 73.430000000000007 110.925 179.912 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 4.5 t70 -65.7 -46.93 77.14 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.219 -0.446 . . . . 75.109999999999999 110.836 179.843 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 127' ' ' GLU . . . . . 0.497 ' CG ' ' O ' ' A' ' 123' ' ' GLU . 0.0 OUTLIER -59.52 -50.35 74.23 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.248 -0.433 . . . . 73.450000000000003 110.868 -179.908 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 128' ' ' PHE . . . . . 0.667 ' C ' ' CD1' ' A' ' 128' ' ' PHE . 0.0 OUTLIER . . . . . 0 C--N 1.329 -0.284 0 CA-C-N 116.161 -0.472 . . . . 74.450000000000003 110.865 -179.906 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 17.4 mt . . . . . 0 C--O 1.231 0.112 0 CA-C-O 120.838 0.351 . . . . 73.120000000000005 110.948 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . 0.411 ' OD1' ' N ' ' A' ' 9' ' ' ASP . 1.2 m-20 -53.38 -32.58 50.03 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.179 -0.464 . . . . 64.319999999999993 110.852 179.863 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 33.0 mm-40 -66.99 -38.93 86.93 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.205 -0.452 . . . . 73.329999999999998 110.922 -179.969 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 11' ' ' TYR . . . . . 0.504 ' CD1' ' HD2' ' A' ' 75' ' ' PRO . 18.9 m-85 -61.65 -25.08 67.15 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.187 -0.46 . . . . 74.209999999999994 110.92 -179.89 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -59.05 -41.69 88.47 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.164 -0.471 . . . . 74.319999999999993 110.962 -179.917 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 1.5 mm-40 -62.43 -45.23 94.04 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.085 -0.507 . . . . 74.430000000000007 110.897 179.952 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 4.4 mp -67.21 -39.89 83.95 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.146 -0.479 . . . . 73.409999999999997 111.148 -179.999 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . 0.466 ' NE2' ' HB3' ' A' ' 70' ' ' MET . 55.9 mt-30 -62.62 -49.43 75.24 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.171 -0.468 . . . . 73.239999999999995 110.889 179.913 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -63.45 -40.67 97.75 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.206 -0.452 . . . . 74.120000000000005 110.878 -179.924 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -57.71 -33.28 68.23 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.197 -0.456 . . . . 73.400000000000006 110.916 -179.91 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . 0.482 ' OE1' ' CE ' ' A' ' 70' ' ' MET . 1.4 tt0 -68.42 -37.82 80.65 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.143 -0.481 . . . . 72.409999999999997 110.895 -179.992 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . 0.468 HD11 ' N ' ' A' ' 19' ' ' LEU . 10.9 mp -56.65 -52.26 65.56 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.189 -0.459 . . . . 72.430000000000007 110.926 -179.98 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 3.6 pt-20 -68.92 -31.97 71.25 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.204 -0.453 . . . . 73.209999999999994 110.901 179.952 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -63.59 -48.66 76.45 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.15 -0.477 . . . . 71.409999999999997 111.086 179.898 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . 0.473 ' N ' HD13 ' A' ' 22' ' ' ILE . 0.5 OUTLIER -77.22 -34.29 21.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.161 -0.472 . . . . 73.25 111.122 -179.995 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 42.5 mtt180 -52.52 -35.44 53.22 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.208 -0.451 . . . . 74.010000000000005 110.874 179.971 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 24.8 p -62.66 -31.19 72.02 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.199 -0.455 . . . . 73.430000000000007 110.9 -179.8 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . 0.506 HD13 ' CD1' ' A' ' 115' ' ' PHE . 3.9 mt -84.76 -45.44 17.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.08 -0.509 . . . . 75.340000000000003 111.154 179.952 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 24.2 m-85 -105.82 44.63 1.03 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.142 -0.481 . . . . 74.409999999999997 110.948 179.991 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 2.2 mtm -43.53 -52.38 6.21 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.104 -0.498 . . . . 74.400000000000006 110.853 179.918 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 -93.68 -27.32 16.62 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.224 -0.443 . . . . 74.310000000000002 110.889 179.93 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 10.5 m-20 -87.62 27.66 1.09 Allowed 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.177 -0.465 . . . . 64.439999999999998 110.884 -179.982 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 5.4 t80 -106.21 138.7 41.93 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.161 -0.472 . . . . 75.150000000000006 110.888 -179.904 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 55.3 m -122.91 133.07 54.42 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.128 -0.487 . . . . 75.099999999999994 111.132 -179.909 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 2.8 t70 -105.04 114.9 29.37 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.21 -0.45 . . . . 75.319999999999993 110.875 179.911 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . 0.518 HD22 ' CE1' ' A' ' 67' ' ' HIS . 0.2 OUTLIER -115.51 -7.15 12.25 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.147 -0.479 . . . . 63.299999999999997 110.935 -179.953 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 34' ' ' THR . . . . . 0.451 ' N ' HD13 ' A' ' 33' ' ' LEU . 0.2 OUTLIER . . . . . 0 C--N 1.329 -0.303 0 CA-C-N 116.231 -0.44 . . . . 74.540000000000006 111.164 179.933 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 45' ' ' GLN . . . . . 0.576 ' NE2' ' CG2' ' A' ' 47' ' ' ILE . 0.0 OUTLIER . . . . . 0 C--O 1.232 0.15 0 CA-C-O 120.716 0.294 . . . . 74.200000000000003 110.881 . . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 46' ' ' ILE . . . . . 0.516 ' CB ' ' O ' ' A' ' 45' ' ' GLN . 0.1 OUTLIER 86.87 -21.09 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.217 -0.447 . . . . 75.540000000000006 111.121 179.988 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . 0.576 ' CG2' ' NE2' ' A' ' 45' ' ' GLN . 0.1 OUTLIER -34.99 152.5 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 116.22 -0.445 . . . . 64.420000000000002 111.137 179.841 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 48' ' ' PHE . . . . . 0.469 ' HA ' ' CD1' ' A' ' 33' ' ' LEU . 1.7 p90 -161.68 168.21 23.76 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.174 -0.466 . . . . 73.510000000000005 110.876 179.965 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . 0.47 ' CG ' ' HB2' ' A' ' 67' ' ' HIS . 7.6 mt-10 -121.19 160.98 22.68 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.114 -0.494 . . . . 63.210000000000001 110.809 -179.892 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 11.5 mm -139.2 134.83 41.3 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.144 -0.48 . . . . 65.239999999999995 111.14 179.951 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 93.6 m -88.53 118.33 28.11 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.146 -0.479 . . . . 72.310000000000002 111.14 179.997 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . 0.445 HD13 ' CD1' ' A' ' 66' ' ' LEU . 21.2 mt -119.63 165.3 14.64 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.202 -0.453 . . . . 70.25 110.916 179.958 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -175.96 166.53 3.02 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.182 -0.463 . . . . 75.049999999999997 110.828 179.985 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -59.3 177.25 0.19 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.177 -0.465 . . . . 72.329999999999998 110.859 -179.801 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 16.2 m -90.89 -26.37 5.18 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.147 -0.479 . . . . 74.049999999999997 111.096 179.959 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -115.31 -169.79 1.64 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.205 -0.452 . . . . 71.439999999999998 110.894 179.924 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -116.27 -23.58 8.33 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.2 -0.455 . . . . 72.310000000000002 110.903 -179.996 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . 0.539 ' HA ' ' C ' ' A' ' 59' ' ' PRO . 7.9 pt-20 -114.51 146.32 35.67 Favored Pre-proline 0 C--N 1.329 -0.289 0 CA-C-O 121.574 0.702 . . . . 71.400000000000006 110.939 179.933 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 59' ' ' PRO . . . . . 0.539 ' C ' ' HA ' ' A' ' 58' ' ' GLU . 54.0 Cg_endo -69.75 -12.54 12.21 Favored 'Cis proline' 0 C--O 1.232 0.194 0 C-N-CA 122.69 -1.796 . . . . 73.140000000000001 112.334 -0.025 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 60' ' ' VAL . . . . . 0.417 ' HB ' ' CG ' ' A' ' 88' ' ' ASN . 12.2 m -147.44 167.61 5.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.25 -0.432 . . . . 75.409999999999997 111.138 179.902 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 5.9 tt0 -94.26 -22.64 18.26 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.138 -0.483 . . . . 73.040000000000006 110.873 -179.967 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 1.7 m 42.68 94.66 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.166 -0.47 . . . . 70.329999999999998 110.834 -179.819 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 25.5 t -118.97 123.1 43.75 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.141 -0.481 . . . . 75.530000000000001 110.878 -179.85 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 64' ' ' ILE . . . . . 0.42 HD13 ' CD2' ' A' ' 94' ' ' LEU . 52.9 mt -138.08 147.14 26.05 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.092 -0.503 . . . . 74.25 111.126 179.956 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 29.0 m -111.62 113.79 26.42 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.189 -0.46 . . . . 74.430000000000007 111.124 179.987 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . 0.634 ' CD2' ' CE1' ' A' ' 83' ' ' PHE . 15.9 mt -91.97 109.95 21.3 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.247 -0.433 . . . . 71.109999999999999 110.927 179.928 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 67' ' ' HIS . . . . . 0.518 ' CE1' HD22 ' A' ' 33' ' ' LEU . 1.2 t60 -95.64 109.89 22.08 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.19 -0.459 . . . . 75.219999999999999 110.839 179.884 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 68' ' ' PHE . . . . . 0.449 ' HB3' ' CD1' ' A' ' 81' ' ' ILE . 0.0 OUTLIER -104.02 139.93 38.45 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.219 -0.446 . . . . 75.239999999999995 110.874 -179.917 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 69' ' ' ALA . . . . . 0.47 ' CB ' HG22 ' A' ' 47' ' ' ILE . . . -124.44 120.07 30.99 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.165 -0.47 . . . . 73.030000000000001 111.087 179.93 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 70' ' ' MET . . . . . 0.482 ' CE ' ' OE1' ' A' ' 18' ' ' GLU . 9.2 mmt -79.63 95.51 5.93 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.199 -0.455 . . . . 75.319999999999993 110.864 179.98 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -49.78 160.16 0.65 Allowed Pre-proline 0 C--N 1.33 -0.263 0 CA-C-O 121.639 0.733 . . . . 74.349999999999994 111.135 -179.923 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.78 3.1 2.98 Favored 'Trans proline' 0 C--N 1.342 0.189 0 C-N-CA 122.691 2.261 . . . . 73.140000000000001 112.349 179.963 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 73' ' ' MET . . . . . 0.502 ' O ' ' CB ' ' A' ' 76' ' ' TYR . 0.0 OUTLIER -120.36 -25.55 5.61 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.194 -0.457 . . . . 74.230000000000004 110.881 179.908 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 74' ' ' TYR . . . . . 0.653 ' CD1' ' C ' ' A' ' 74' ' ' TYR . 0.0 OUTLIER -50.52 150.75 4.51 Favored Pre-proline 0 C--N 1.328 -0.337 0 CA-C-O 121.648 0.737 . . . . 74.549999999999997 110.916 -179.854 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 75' ' ' PRO . . . . . 0.563 ' HA ' ' CD2' ' A' ' 74' ' ' TYR . 53.7 Cg_endo -69.76 -14.12 12.45 Favored 'Cis proline' 0 C--N 1.341 0.183 0 C-N-CA 122.65 -1.813 . . . . 75.430000000000007 112.325 -0.089 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 76' ' ' TYR . . . . . 0.502 ' CB ' ' O ' ' A' ' 73' ' ' MET . 6.2 t80 -33.93 -52.64 0.44 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.236 -0.438 . . . . 74.120000000000005 110.883 -179.912 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 39.0 p -105.86 -178.88 3.78 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.141 -0.481 . . . . 74.329999999999998 111.179 -179.989 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -98.62 129.36 30.32 Favored Pre-proline 0 C--N 1.329 -0.287 0 CA-C-O 121.595 0.712 . . . . 55.25 111.135 179.859 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 79' ' ' PRO . . . . . 0.445 ' CB ' ' O ' ' A' ' 69' ' ' ALA . 53.9 Cg_endo -69.74 -170.89 0.42 Allowed 'Trans proline' 0 C--O 1.231 0.152 0 C-N-CA 122.717 2.278 . . . . 73.439999999999998 112.366 -179.992 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 2.1 tt0 -119.77 125.17 47.94 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.224 -0.443 . . . . 74.239999999999995 110.878 -179.982 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 81' ' ' ILE . . . . . 0.449 ' CD1' ' HB3' ' A' ' 68' ' ' PHE . 13.0 mm -121.37 142.38 37.83 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.107 -0.497 . . . . 71.329999999999998 111.109 -179.985 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . 0.476 ' HG3' ' CD ' ' A' ' 84' ' ' LYS . 11.8 pt-20 -148.61 147.2 28.7 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.162 -0.472 . . . . 64.140000000000001 110.886 179.903 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 83' ' ' PHE . . . . . 0.634 ' CE1' ' CD2' ' A' ' 66' ' ' LEU . 91.2 m-85 -95.79 139.97 31.25 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.12 -0.491 . . . . 73.109999999999999 110.893 -179.934 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 84' ' ' LYS . . . . . 0.476 ' CD ' ' HG3' ' A' ' 82' ' ' GLU . 6.0 mmmt -126.25 170.8 11.49 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.159 -0.473 . . . . 74.319999999999993 110.918 -179.998 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 85' ' ' ASN . . . . . 0.621 ' N ' HD21 ' A' ' 85' ' ' ASN . 0.8 OUTLIER 63.53 -73.35 0.05 OUTLIER 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.258 -0.428 . . . . 72.530000000000001 110.892 179.946 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 86' ' ' VAL . . . . . 0.446 ' N ' ' O ' ' A' ' 84' ' ' LYS . 4.2 m 36.12 91.0 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 116.162 -0.472 . . . . 63.520000000000003 111.182 179.952 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -94.93 -72.49 0.62 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.18 -0.464 . . . . 75.439999999999998 110.881 -179.94 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 88' ' ' ASN . . . . . 0.417 ' CG ' ' HB ' ' A' ' 60' ' ' VAL . 24.5 m120 -81.28 47.1 0.99 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.184 -0.462 . . . . 75.200000000000003 110.897 -179.954 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 48.1 t -141.71 145.27 24.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.138 -0.483 . . . . 74.230000000000004 111.118 179.897 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 90' ' ' MET . . . . . . . . . . . . . 21.3 mtm -92.04 -71.11 0.66 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.15 -0.477 . . . . 74.219999999999999 110.871 179.941 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER 178.28 -37.21 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.249 -0.432 . . . . 73.519999999999996 110.901 179.951 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -55.97 -45.78 78.82 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.196 -0.456 . . . . 54.109999999999999 110.891 -179.805 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 93' ' ' GLN . . . . . 0.554 ' HG2' ' CD2' ' A' ' 128' ' ' PHE . 2.4 mp0 -61.19 -44.38 97.38 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.152 -0.476 . . . . 75.040000000000006 110.874 -179.969 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . 0.439 HD23 ' CG1' ' A' ' 86' ' ' VAL . 78.6 mt -59.08 -48.85 80.1 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.188 -0.46 . . . . 75.010000000000005 110.92 -179.974 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 2.2 mm-40 -65.1 -33.7 76.64 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.166 -0.47 . . . . 62.420000000000002 110.877 179.959 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 96' ' ' MET . . . . . . . . . . . . . 30.5 ttp -59.9 -38.64 82.86 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.212 -0.449 . . . . 75.450000000000003 110.852 179.997 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 97' ' ' LEU . . . . . 0.563 HD12 ' CZ ' ' A' ' 83' ' ' PHE . 24.9 mt -65.64 -41.09 93.02 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.199 -0.455 . . . . 75.409999999999997 110.922 -179.997 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 98' ' ' LYS . . . . . 0.506 ' HA ' ' CD2' ' A' ' 101' ' ' PHE . 13.2 mmtm -55.47 -43.62 75.67 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.17 -0.468 . . . . 74.140000000000001 110.867 179.871 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 4.2 t -57.28 -38.2 73.56 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.246 -0.433 . . . . 75.549999999999997 110.87 -179.936 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 6.8 mt-10 -74.69 -29.97 61.4 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.12 -0.491 . . . . 74.030000000000001 110.887 -179.965 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 101' ' ' PHE . . . . . 0.579 ' CZ ' HD13 ' A' ' 117' ' ' ILE . 14.0 m-30 -61.74 -27.77 68.95 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.164 -0.471 . . . . 74.519999999999996 110.896 -179.93 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -65.37 -44.92 86.1 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.106 -0.497 . . . . 75.430000000000007 110.927 179.953 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.53 -37.51 74.11 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.199 -0.455 . . . . 74.120000000000005 110.912 179.846 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 104' ' ' ILE . . . . . 0.54 HD11 ' CD2' ' A' ' 120' ' ' PHE . 5.0 mt -61.93 -47.54 92.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.257 -0.429 . . . . 71.319999999999993 111.104 179.886 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 105' ' ' HIS . . . . . . . . . . . . . 1.6 t60 -62.86 -42.15 99.64 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.19 -0.459 . . . . 75.049999999999997 110.844 179.886 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -56.94 -43.37 81.44 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.242 -0.435 . . . . 74.200000000000003 110.924 -179.945 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 6.9 t -77.84 -30.71 51.14 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.127 -0.488 . . . . 75.109999999999999 111.136 -179.986 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 21.0 m -102.96 24.23 11.04 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.229 -0.441 . . . . 74.549999999999997 110.835 -179.866 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 17.9 ttt180 -67.16 77.69 0.14 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.142 -0.481 . . . . 73.239999999999995 110.901 -179.993 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 110' ' ' GLY . . . . . 0.472 ' HA2' ' CG ' ' A' ' 75' ' ' PRO . . . 145.64 -18.46 1.83 Allowed Glycine 0 N--CA 1.452 -0.266 0 C-N-CA 120.71 -0.757 . . . . 73.439999999999998 112.477 -179.949 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 111' ' ' GLN . . . . . . . . . . . . . 10.0 pt20 -117.49 -165.1 1.05 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.735 0.302 . . . . 73.209999999999994 110.928 -179.88 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 53.3 mt-10 -69.08 135.6 51.02 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.215 -0.448 . . . . 74.549999999999997 110.88 -179.944 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 113' ' ' ILE . . . . . 0.424 ' CD1' ' HG3' ' A' ' 79' ' ' PRO . 28.0 pt -123.8 -16.32 4.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.122 -0.49 . . . . 71.420000000000002 111.125 179.993 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 114' ' ' ILE . . . . . 0.508 ' O ' ' CG2' ' A' ' 118' ' ' THR . 29.7 mm -61.19 -38.7 80.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.155 -0.475 . . . . 70.150000000000006 111.115 179.878 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 115' ' ' PHE . . . . . 0.506 ' CD1' HD13 ' A' ' 25' ' ' ILE . 43.0 t80 -72.82 -36.16 67.46 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.183 -0.462 . . . . 75.430000000000007 110.883 179.969 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 8.3 mm-40 -68.3 -46.66 69.72 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.14 -0.482 . . . . 73.409999999999997 110.897 -179.958 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 117' ' ' ILE . . . . . 0.579 HD13 ' CZ ' ' A' ' 101' ' ' PHE . 0.0 OUTLIER -65.79 -41.94 91.29 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 116.161 -0.472 . . . . 75.340000000000003 111.111 179.984 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 118' ' ' THR . . . . . 0.508 ' CG2' ' O ' ' A' ' 114' ' ' ILE . 57.4 p -68.8 -42.95 76.63 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.179 -0.464 . . . . 63.25 111.15 179.943 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 36.6 t -65.13 -44.34 89.0 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.198 -0.455 . . . . 74.420000000000002 110.87 -179.867 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 120' ' ' PHE . . . . . 0.54 ' CD2' HD11 ' A' ' 104' ' ' ILE . 0.7 OUTLIER -60.87 -48.08 83.45 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.161 -0.472 . . . . 73.129999999999995 110.878 -179.963 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 18.9 p -58.77 -38.98 79.68 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.13 -0.486 . . . . 72.120000000000005 111.182 -179.94 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 9.1 tt0 -61.46 -40.89 96.14 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.197 -0.456 . . . . 75.450000000000003 110.929 179.972 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 123' ' ' GLU . . . . . 0.442 ' CG ' ' N ' ' A' ' 124' ' ' LYS . 1.0 OUTLIER -75.46 -45.0 41.21 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.231 -0.441 . . . . 74.430000000000007 110.901 -179.965 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 124' ' ' LYS . . . . . 0.443 ' HE3' ' CD ' ' A' ' 127' ' ' GLU . 8.4 mmmt -64.43 -37.83 88.91 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.167 -0.469 . . . . 71.530000000000001 110.907 179.957 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 125' ' ' LEU . . . . . 0.553 ' C ' ' CD2' ' A' ' 125' ' ' LEU . 3.6 tt -69.65 -44.59 70.23 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.18 -0.464 . . . . 74.129999999999995 110.919 179.909 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 126' ' ' ASP . . . . . 0.424 ' OD1' ' C ' ' A' ' 126' ' ' ASP . 0.0 OUTLIER -68.61 -39.89 80.65 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.183 -0.462 . . . . 73.519999999999996 110.833 179.858 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 127' ' ' GLU . . . . . 0.474 ' HG3' ' N ' ' A' ' 128' ' ' PHE . 3.2 pt-20 -65.62 -42.77 91.17 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.225 -0.443 . . . . 63.399999999999999 110.882 -179.889 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 128' ' ' PHE . . . . . 0.659 ' C ' ' CD1' ' A' ' 128' ' ' PHE . 0.0 OUTLIER . . . . . 0 C--N 1.329 -0.301 0 CA-C-N 116.165 -0.47 . . . . 74.299999999999997 110.911 -179.926 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 20.1 mt . . . . . 0 C--O 1.231 0.107 0 CA-C-O 120.816 0.341 . . . . 72.109999999999999 110.926 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -51.52 -31.67 24.87 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.211 -0.45 . . . . 74.129999999999995 110.85 179.856 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 3.9 mm-40 -67.85 -35.49 78.66 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.178 -0.464 . . . . 73.450000000000003 110.88 -179.87 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 13.6 m-85 -67.61 -24.98 65.53 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.208 -0.451 . . . . 74.109999999999999 110.933 -179.893 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -59.26 -38.08 79.18 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.146 -0.479 . . . . 74.140000000000001 110.925 -179.917 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 2.7 mm-40 -58.86 -46.0 88.8 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.126 -0.488 . . . . 73.120000000000005 110.903 179.979 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 4.2 mp -68.05 -46.64 81.27 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.179 -0.464 . . . . 74.230000000000004 111.115 179.961 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 84.5 mt-30 -57.21 -48.22 79.33 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.202 -0.453 . . . . 74.319999999999993 110.89 179.966 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -62.22 -42.27 99.15 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.263 -0.426 . . . . 74.049999999999997 110.886 -179.945 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 2.5 m-20 -58.1 -33.64 69.33 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.168 -0.469 . . . . 74.409999999999997 110.876 -179.879 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 2.4 mp0 -65.44 -38.85 91.1 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.163 -0.471 . . . . 74.230000000000004 110.93 179.986 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . 0.489 HD12 ' N ' ' A' ' 19' ' ' LEU . 8.5 mp -63.7 -51.7 63.84 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.103 -0.499 . . . . 75.340000000000003 110.909 -179.972 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 1.9 pt-20 -68.9 -32.72 72.55 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.163 -0.472 . . . . 73.319999999999993 110.888 179.925 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -62.06 -50.56 71.51 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.175 -0.466 . . . . 75.540000000000006 111.07 179.95 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . 0.468 HD11 ' N ' ' A' ' 22' ' ' ILE . 0.6 OUTLIER -77.23 -34.36 21.2 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 116.249 -0.432 . . . . 74.140000000000001 111.112 179.985 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 44.4 mtp180 -52.54 -35.02 52.6 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.187 -0.46 . . . . 73.129999999999995 110.89 179.973 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -66.98 -31.43 72.0 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.191 -0.459 . . . . 63.25 110.828 -179.812 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 3.9 mt -82.89 -44.41 18.96 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.159 -0.473 . . . . 74.5 111.137 179.967 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 26.6 m-85 -106.6 41.16 1.49 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.193 -0.458 . . . . 74.450000000000003 110.964 -179.994 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER -40.4 -49.38 2.82 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.099 -0.501 . . . . 71.420000000000002 110.895 179.91 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -98.39 -9.02 25.88 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.196 -0.456 . . . . 43.420000000000002 110.872 179.981 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -104.67 32.65 3.98 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.218 -0.446 . . . . 72.239999999999995 110.819 -179.999 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 30' ' ' PHE . . . . . 0.513 ' C ' ' CD1' ' A' ' 30' ' ' PHE . 1.7 t80 -116.55 138.39 51.45 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.234 -0.439 . . . . 74.230000000000004 110.89 -179.95 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 52.3 m -111.71 129.79 55.99 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.147 -0.479 . . . . 74.329999999999998 111.089 -179.857 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . 0.452 ' O ' ' CG ' ' A' ' 32' ' ' ASP . 0.0 OUTLIER -99.36 115.62 29.64 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.215 -0.448 . . . . 53.100000000000001 110.864 179.861 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . 0.458 ' CD2' ' HA ' ' A' ' 48' ' ' PHE . 0.4 OUTLIER -123.48 -17.04 6.62 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.138 -0.483 . . . . 74.109999999999999 110.943 -179.976 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 1.2 m . . . . . 0 C--N 1.329 -0.295 0 CA-C-N 116.187 -0.46 . . . . 75.329999999999998 111.098 180.0 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 45' ' ' GLN . . . . . 0.45 ' O ' ' CB ' ' A' ' 46' ' ' ILE . 16.2 tt0 . . . . . 0 C--O 1.231 0.101 0 CA-C-O 120.778 0.323 . . . . 73.439999999999998 110.931 . . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 46' ' ' ILE . . . . . 0.45 ' CB ' ' O ' ' A' ' 45' ' ' GLN . 0.0 OUTLIER 82.02 -3.99 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.179 -0.464 . . . . 74.540000000000006 111.146 179.979 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . 0.472 HG23 ' CB ' ' A' ' 69' ' ' ALA . 0.2 OUTLIER -59.83 143.37 14.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.162 -0.472 . . . . 75.310000000000002 111.117 179.844 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 48' ' ' PHE . . . . . 0.458 ' HA ' ' CD2' ' A' ' 33' ' ' LEU . 4.2 p90 -155.54 154.73 32.19 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.218 -0.447 . . . . 73.510000000000005 110.884 179.955 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 6.0 mt-10 -108.93 159.17 17.02 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.178 -0.465 . . . . 64.099999999999994 110.928 -179.971 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 7.3 mm -133.95 140.6 46.0 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 116.174 -0.466 . . . . 74.109999999999999 111.179 179.962 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 88.9 m -85.21 118.58 24.84 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.208 -0.451 . . . . 73.109999999999999 111.153 179.99 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 17.0 mt -123.3 163.23 21.13 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.286 -0.415 . . . . 74.230000000000004 110.925 179.962 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -178.43 175.54 1.14 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.211 -0.45 . . . . 73.219999999999999 110.905 179.979 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -70.12 -156.08 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.16 -0.473 . . . . 73.200000000000003 110.873 -179.811 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 18.0 m -117.72 -20.08 5.62 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.138 -0.483 . . . . 73.409999999999997 111.156 179.926 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -112.44 174.73 5.75 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.171 -0.468 . . . . 70.299999999999997 110.89 179.916 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -111.8 -22.38 11.16 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.173 -0.467 . . . . 73.120000000000005 110.895 179.989 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . 0.531 ' HA ' ' C ' ' A' ' 59' ' ' PRO . 3.4 pt-20 -126.32 148.91 65.6 Favored Pre-proline 0 C--N 1.33 -0.26 0 CA-C-O 121.692 0.758 . . . . 74.299999999999997 110.84 179.956 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 59' ' ' PRO . . . . . 0.531 ' C ' ' HA ' ' A' ' 58' ' ' GLU . 54.0 Cg_endo -69.72 -8.58 10.5 Favored 'Cis proline' 0 C--N 1.342 0.186 0 C-N-CA 122.737 -1.776 . . . . 74.340000000000003 112.33 0.012 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 29.2 m -139.5 172.27 13.08 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.193 -0.458 . . . . 73.530000000000001 111.131 179.923 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 5.1 tt0 -108.35 -17.15 14.07 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.143 -0.48 . . . . 74.319999999999993 110.882 179.99 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 41.4 93.43 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.193 -0.458 . . . . 55.329999999999998 110.86 -179.773 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 16.1 t -124.5 124.02 41.38 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.112 -0.495 . . . . 75.430000000000007 110.835 -179.831 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 64' ' ' ILE . . . . . 0.427 HG21 ' N ' ' A' ' 65' ' ' THR . 14.5 mt -138.34 146.06 27.37 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 116.124 -0.489 . . . . 73.0 111.155 179.889 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 65' ' ' THR . . . . . 0.427 ' N ' HG21 ' A' ' 64' ' ' ILE . 62.1 m -110.32 113.69 26.55 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.162 -0.472 . . . . 73.439999999999998 111.159 179.996 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -91.75 112.24 24.08 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.267 -0.424 . . . . 72.109999999999999 110.92 179.955 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 5.1 t60 -105.27 109.87 22.02 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.203 -0.453 . . . . 74.530000000000001 110.872 179.841 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 68' ' ' PHE . . . . . 0.464 ' CE1' HG22 ' A' ' 114' ' ' ILE . 0.0 OUTLIER -103.75 140.12 38.05 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.208 -0.451 . . . . 74.409999999999997 110.871 -179.916 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 69' ' ' ALA . . . . . 0.472 ' CB ' HG23 ' A' ' 47' ' ' ILE . . . -119.3 129.36 54.84 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.159 -0.473 . . . . 71.319999999999993 111.093 179.921 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 70' ' ' MET . . . . . 0.501 ' HE3' ' CD1' ' A' ' 114' ' ' ILE . 17.8 mmt -91.35 95.7 10.14 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.22 -0.445 . . . . 64.430000000000007 110.845 -179.993 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -51.61 159.96 1.14 Allowed Pre-proline 0 C--N 1.329 -0.295 0 CA-C-O 121.578 0.704 . . . . 74.239999999999995 111.129 -179.91 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.8 3.29 2.88 Favored 'Trans proline' 0 C--N 1.341 0.163 0 C-N-CA 122.705 2.27 . . . . 75.319999999999993 112.362 179.944 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 73' ' ' MET . . . . . 0.489 ' O ' ' CB ' ' A' ' 76' ' ' TYR . 0.1 OUTLIER -119.73 -25.78 5.83 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.182 -0.463 . . . . 72.439999999999998 110.921 179.911 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 74' ' ' TYR . . . . . 0.651 ' CD1' ' C ' ' A' ' 74' ' ' TYR . 0.0 OUTLIER -48.37 149.59 2.69 Favored Pre-proline 0 C--N 1.329 -0.305 0 CA-C-O 121.692 0.758 . . . . 65.439999999999998 110.987 -179.909 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 75' ' ' PRO . . . . . 0.545 ' HA ' ' CD2' ' A' ' 74' ' ' TYR . 53.6 Cg_endo -69.84 -13.0 12.51 Favored 'Cis proline' 0 C--O 1.232 0.184 0 C-N-CA 122.688 -1.797 . . . . 64.310000000000002 112.341 0.059 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 76' ' ' TYR . . . . . 0.489 ' CB ' ' O ' ' A' ' 73' ' ' MET . 1.5 t80 -34.89 -48.48 0.4 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.232 -0.44 . . . . 73.430000000000007 110.91 -179.917 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 69.6 p -108.2 169.92 8.33 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.119 -0.491 . . . . 75.120000000000005 111.168 -179.985 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -89.59 129.81 45.64 Favored Pre-proline 0 C--N 1.33 -0.282 0 CA-C-O 121.57 0.7 . . . . 61.409999999999997 111.121 179.858 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 79' ' ' PRO . . . . . 0.454 ' HG3' ' CD1' ' A' ' 113' ' ' ILE . 53.6 Cg_endo -69.77 179.38 3.74 Favored 'Trans proline' 0 C--N 1.341 0.163 0 C-N-CA 122.643 2.229 . . . . 71.129999999999995 112.355 -179.989 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -117.1 137.13 52.49 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.219 -0.446 . . . . 73.040000000000006 110.846 -179.921 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 81' ' ' ILE . . . . . 0.414 ' CD1' ' HB3' ' A' ' 68' ' ' PHE . 5.2 mm -125.45 144.21 36.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.164 -0.471 . . . . 74.310000000000002 111.139 179.964 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . 0.456 ' HG3' ' CD ' ' A' ' 84' ' ' LYS . 3.0 pt-20 -145.48 141.25 28.16 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.175 -0.466 . . . . 75.230000000000004 110.901 179.985 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 83' ' ' PHE . . . . . 0.532 ' CZ ' ' HD3' ' A' ' 98' ' ' LYS . 7.5 m-85 -96.97 141.02 30.64 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.196 -0.456 . . . . 70.0 110.886 -179.916 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 84' ' ' LYS . . . . . 0.468 ' O ' ' N ' ' A' ' 86' ' ' VAL . 5.1 mmmt -125.45 172.22 9.84 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.124 -0.489 . . . . 72.109999999999999 110.9 179.952 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 85' ' ' ASN . . . . . 0.413 ' C ' HG22 ' A' ' 86' ' ' VAL . 2.4 m-80 61.48 -75.24 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.222 -0.445 . . . . 65.319999999999993 110.865 179.939 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 86' ' ' VAL . . . . . 0.468 ' N ' ' O ' ' A' ' 84' ' ' LYS . 2.4 m 39.96 92.63 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.233 -0.44 . . . . 74.409999999999997 111.125 179.916 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -97.06 -87.43 0.31 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.147 -0.478 . . . . 63.039999999999999 110.938 -179.992 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -47.93 -51.25 24.15 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.199 -0.455 . . . . 74.430000000000007 110.897 -179.985 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 89' ' ' VAL . . . . . 0.41 ' CG2' ' HG ' ' A' ' 94' ' ' LEU . 1.2 p -59.53 135.2 24.34 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.187 -0.461 . . . . 75.239999999999995 111.123 179.903 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 90' ' ' MET . . . . . . . . . . . . . 4.7 mtm -86.87 -60.82 1.88 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.168 -0.469 . . . . 74.319999999999993 110.882 179.925 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 3.5 p-10 179.41 -32.1 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.198 -0.455 . . . . 74.140000000000001 110.858 179.961 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 99.8 p -54.6 -45.35 73.63 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.2 -0.455 . . . . 75.329999999999998 110.832 -179.773 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 93' ' ' GLN . . . . . 0.645 ' CD ' ' CD1' ' A' ' 128' ' ' PHE . 1.2 mt-30 -70.2 -38.09 75.25 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.14 -0.482 . . . . 75.219999999999999 110.894 -179.947 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . 0.443 ' CD1' HG11 ' A' ' 86' ' ' VAL . 29.2 mt -58.84 -47.77 83.68 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.217 -0.447 . . . . 74.439999999999998 110.91 -179.986 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 28.4 mt-30 -62.78 -34.1 76.56 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.168 -0.469 . . . . 74.310000000000002 110.952 179.919 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 96' ' ' MET . . . . . 0.464 ' HE3' ' CG ' ' A' ' 124' ' ' LYS . 43.5 ttp -60.47 -37.27 80.48 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.199 -0.455 . . . . 72.150000000000006 110.86 179.941 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 97' ' ' LEU . . . . . 0.611 ' O ' ' CD1' ' A' ' 101' ' ' PHE . 80.4 mt -61.41 -46.57 89.57 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.223 -0.444 . . . . 75.349999999999994 110.891 -179.97 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 98' ' ' LYS . . . . . 0.532 ' HD3' ' CZ ' ' A' ' 83' ' ' PHE . 3.9 mmtp -58.12 -34.16 69.92 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.204 -0.453 . . . . 74.109999999999999 110.87 179.896 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 1.4 t -69.68 -46.29 66.4 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.207 -0.452 . . . . 71.0 110.822 -179.887 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 7.7 pt-20 -72.38 -23.88 61.18 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.145 -0.48 . . . . 71.319999999999993 110.926 -179.973 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 101' ' ' PHE . . . . . 0.611 ' CD1' ' O ' ' A' ' 97' ' ' LEU . 10.1 m-30 -59.42 -22.9 62.14 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.121 -0.49 . . . . 74.129999999999995 110.886 -179.93 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.46 -45.38 59.78 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.155 -0.475 . . . . 74.030000000000001 110.858 -179.999 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 24.6 mtmm -63.24 -38.8 92.57 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.189 -0.46 . . . . 72.540000000000006 110.869 179.922 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 1.6 mp -63.08 -47.63 91.66 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.218 -0.446 . . . . 74.010000000000005 111.108 179.876 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 105' ' ' HIS . . . . . . . . . . . . . 9.3 t-80 -63.12 -41.88 99.43 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.201 -0.454 . . . . 73.439999999999998 110.866 179.867 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -56.73 -43.39 80.6 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.21 -0.45 . . . . 72.209999999999994 110.9 -179.929 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 7.6 t -77.73 -22.39 50.44 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.185 -0.461 . . . . 71.120000000000005 111.162 -179.983 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 1.7 m -118.3 35.46 4.75 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.197 -0.456 . . . . 74.230000000000004 110.862 -179.851 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 14.4 ttt180 -75.87 88.41 2.88 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.163 -0.471 . . . . 70.099999999999994 110.85 -179.919 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 123.33 32.85 0.87 Allowed Glycine 0 N--CA 1.45 -0.369 0 C-N-CA 120.754 -0.736 . . . . 51.409999999999997 112.49 179.987 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 111' ' ' GLN . . . . . . . . . . . . . 3.4 pt20 -169.28 -162.98 0.38 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.794 0.331 . . . . 74.319999999999993 110.878 -179.888 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 35.3 mt-10 -65.9 127.1 30.7 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.162 -0.472 . . . . 74.129999999999995 110.833 -179.896 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 113' ' ' ILE . . . . . 0.454 ' CD1' ' HG3' ' A' ' 79' ' ' PRO . 7.4 pt -126.35 -8.35 5.1 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 116.122 -0.49 . . . . 61.240000000000002 111.13 179.947 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 114' ' ' ILE . . . . . 0.501 ' CD1' ' HE3' ' A' ' 70' ' ' MET . 3.6 mp -67.73 -46.77 81.92 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.174 -0.466 . . . . 73.230000000000004 111.114 179.873 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 115' ' ' PHE . . . . . . . . . . . . . 28.1 t80 -68.28 -36.42 79.37 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.157 -0.474 . . . . 72.420000000000002 110.852 -179.979 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 53.4 mm-40 -67.54 -45.79 74.68 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.139 -0.482 . . . . 73.030000000000001 110.911 -179.945 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 117' ' ' ILE . . . . . 0.461 ' CG2' ' N ' ' A' ' 118' ' ' THR . 0.4 OUTLIER -67.15 -40.41 85.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.111 -0.495 . . . . 75.549999999999997 111.141 179.983 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 118' ' ' THR . . . . . 0.461 ' N ' ' CG2' ' A' ' 117' ' ' ILE . 62.1 p -68.35 -43.43 77.49 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.156 -0.475 . . . . 75.439999999999998 111.114 179.956 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -64.9 -43.89 91.39 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.26 -0.427 . . . . 73.140000000000001 110.829 -179.824 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -60.86 -48.58 81.15 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.13 -0.486 . . . . 74.349999999999994 110.904 -179.961 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 29.5 p -64.52 -40.31 95.39 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.128 -0.487 . . . . 73.140000000000001 111.145 -179.949 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 16.1 tt0 -60.17 -38.14 82.28 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.211 -0.449 . . . . 74.450000000000003 110.955 179.985 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 123' ' ' GLU . . . . . 0.515 ' C ' ' CD ' ' A' ' 123' ' ' GLU . 0.1 OUTLIER -77.87 -46.38 21.55 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.156 -0.475 . . . . 74.319999999999993 110.947 179.986 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 124' ' ' LYS . . . . . 0.464 ' CG ' ' HE3' ' A' ' 96' ' ' MET . 0.0 OUTLIER -64.4 -34.1 77.39 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.127 -0.488 . . . . 74.319999999999993 110.889 179.96 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 1.8 tp -68.96 -43.37 75.14 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.236 -0.438 . . . . 70.019999999999996 110.925 179.926 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -68.12 -36.95 80.55 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.139 -0.482 . . . . 74.530000000000001 110.885 179.863 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 127' ' ' GLU . . . . . 0.434 ' HG3' ' N ' ' A' ' 128' ' ' PHE . 0.0 OUTLIER -62.39 -28.76 70.0 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.155 -0.475 . . . . 73.239999999999995 110.906 -179.947 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 128' ' ' PHE . . . . . 0.645 ' CD1' ' CD ' ' A' ' 93' ' ' GLN . 0.2 OUTLIER . . . . . 0 C--N 1.329 -0.324 0 CA-C-N 116.143 -0.48 . . . . 74.530000000000001 110.907 -179.918 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 16.6 mt . . . . . 0 C--O 1.231 0.08 0 CA-C-O 120.874 0.369 . . . . 74.530000000000001 110.926 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -51.4 -32.02 24.8 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.181 -0.463 . . . . 73.540000000000006 110.885 179.802 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 11.4 mm-40 -68.4 -40.32 81.35 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.185 -0.462 . . . . 73.530000000000001 110.896 -179.906 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 10.4 m-85 -49.37 -23.32 1.42 Allowed 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.229 -0.441 . . . . 74.25 110.896 -179.85 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 9.1 m-85 -57.72 -36.34 71.88 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.158 -0.474 . . . . 73.120000000000005 110.958 -179.919 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . 0.477 ' HG3' ' N ' ' A' ' 14' ' ' ILE . 11.9 pt-20 -60.97 -43.55 98.6 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.068 -0.514 . . . . 74.230000000000004 110.868 -179.965 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 14' ' ' ILE . . . . . 0.477 ' N ' ' HG3' ' A' ' 13' ' ' GLU . 2.8 mp -68.15 -43.32 85.11 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.179 -0.464 . . . . 74.219999999999999 111.19 179.932 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . 0.459 ' HG2' ' CB ' ' A' ' 70' ' ' MET . 20.4 mt-30 -63.16 -45.74 90.44 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.118 -0.492 . . . . 73.049999999999997 110.931 179.928 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 16.1 t -58.86 -41.59 87.38 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.224 -0.444 . . . . 65.129999999999995 110.869 -179.934 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 4.8 m-20 -63.15 -34.02 76.71 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.191 -0.459 . . . . 73.040000000000006 110.87 -179.917 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . 0.415 ' N ' ' OE1' ' A' ' 18' ' ' GLU . 0.0 OUTLIER -66.22 -38.99 89.25 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.193 -0.458 . . . . 61.100000000000001 110.89 -179.994 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 6.0 mt -60.79 -51.64 68.48 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.18 -0.463 . . . . 72.519999999999996 110.883 -179.968 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 4.8 pt-20 -68.74 -38.15 79.93 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.227 -0.442 . . . . 71.450000000000003 110.863 179.943 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -58.63 -50.54 73.47 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.154 -0.475 . . . . 62.130000000000003 111.084 179.977 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . 0.475 HD11 ' N ' ' A' ' 22' ' ' ILE . 0.7 OUTLIER -75.49 -35.83 33.45 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.218 -0.446 . . . . 74.209999999999994 111.115 179.984 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 7.2 mtp180 -52.55 -34.25 49.28 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.178 -0.464 . . . . 72.450000000000003 110.873 179.981 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -66.39 -34.55 78.21 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.183 -0.462 . . . . 74.049999999999997 110.831 -179.816 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . 0.565 HD12 ' CD1' ' A' ' 115' ' ' PHE . 3.7 mt -79.92 -45.34 22.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.178 -0.465 . . . . 61.109999999999999 111.117 179.977 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 26' ' ' TYR . . . . . 0.433 ' CD2' HG23 ' A' ' 50' ' ' ILE . 34.9 m-85 -109.78 45.38 1.1 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.177 -0.465 . . . . 74.420000000000002 110.974 -179.989 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -39.68 -55.6 1.86 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.103 -0.499 . . . . 72.319999999999993 110.882 179.921 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -95.28 -14.69 23.76 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.252 -0.431 . . . . 75.349999999999994 110.88 179.945 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 4.4 m-20 -92.75 31.01 1.44 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.185 -0.461 . . . . 72.409999999999997 110.897 179.997 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 30' ' ' PHE . . . . . 0.519 ' C ' ' CD1' ' A' ' 30' ' ' PHE . 2.0 t80 -120.39 142.26 49.35 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.163 -0.471 . . . . 74.510000000000005 110.846 -179.881 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 31' ' ' THR . . . . . 0.45 ' N ' ' CD1' ' A' ' 30' ' ' PHE . 18.2 m -119.01 129.38 55.1 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.16 -0.473 . . . . 74.439999999999998 111.148 -179.925 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 10.2 t0 -89.27 113.6 24.87 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.206 -0.452 . . . . 72.430000000000007 110.883 179.902 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . 0.49 ' CD2' ' N ' ' A' ' 34' ' ' THR . 0.4 OUTLIER -120.19 -28.92 4.98 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.159 -0.473 . . . . 72.450000000000003 110.891 -179.962 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 34' ' ' THR . . . . . 0.49 ' N ' ' CD2' ' A' ' 33' ' ' LEU . 5.2 m . . . . . 0 C--N 1.329 -0.306 0 CA-C-N 116.231 -0.441 . . . . 72.530000000000001 111.166 179.957 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 45' ' ' GLN . . . . . 0.519 ' O ' ' CG ' ' A' ' 45' ' ' GLN . 7.3 tt0 . . . . . 0 C--O 1.232 0.163 0 CA-C-O 120.775 0.321 . . . . 71.200000000000003 110.921 . . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 46' ' ' ILE . . . . . 0.454 ' CB ' ' O ' ' A' ' 45' ' ' GLN . 0.0 OUTLIER 82.81 -28.1 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.215 -0.448 . . . . 73.310000000000002 111.118 179.952 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . 0.495 ' N ' HD12 ' A' ' 47' ' ' ILE . 0.2 OUTLIER -37.97 150.42 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.147 -0.479 . . . . 73.219999999999999 111.129 179.877 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 48' ' ' PHE . . . . . 0.475 ' HA ' ' CD2' ' A' ' 33' ' ' LEU . 1.6 p90 -152.35 157.93 41.99 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.187 -0.46 . . . . 72.239999999999995 110.902 179.967 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 7.1 mt-10 -108.76 147.43 32.03 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.164 -0.471 . . . . 71.329999999999998 110.886 -179.939 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . 0.433 HG23 ' CD2' ' A' ' 26' ' ' TYR . 10.8 mm -129.32 135.23 62.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.172 -0.467 . . . . 73.450000000000003 111.132 179.955 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 98.4 m -84.27 132.16 34.66 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.174 -0.466 . . . . 62.210000000000001 111.134 179.945 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 19.8 mt -132.83 157.04 46.01 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.18 -0.464 . . . . 72.219999999999999 110.88 179.983 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -178.64 166.02 1.71 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.219 -0.446 . . . . 74.510000000000005 110.921 179.952 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -62.63 -176.53 0.11 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.223 -0.444 . . . . 53.439999999999998 110.859 -179.765 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 18.5 m -99.08 -24.08 4.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.147 -0.479 . . . . 74.519999999999996 111.096 -179.991 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -112.92 -171.03 1.79 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.196 -0.456 . . . . 54.509999999999998 110.925 179.902 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 6.0 mmmm -119.33 -18.92 8.46 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.234 -0.439 . . . . 74.519999999999996 110.874 179.989 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . 0.548 ' HA ' ' C ' ' A' ' 59' ' ' PRO . 11.2 pt-20 -115.97 143.27 30.53 Favored Pre-proline 0 C--N 1.329 -0.315 0 CA-C-O 121.599 0.714 . . . . 73.409999999999997 110.898 179.939 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 59' ' ' PRO . . . . . 0.548 ' C ' ' HA ' ' A' ' 58' ' ' GLU . 54.0 Cg_endo -69.67 -9.23 10.74 Favored 'Cis proline' 0 C--O 1.232 0.205 0 C-N-CA 122.746 -1.772 . . . . 74.150000000000006 112.355 -0.051 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 60' ' ' VAL . . . . . 0.469 ' HB ' ' ND2' ' A' ' 88' ' ' ASN . 11.9 m -152.13 -176.29 0.25 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.215 -0.448 . . . . 72.510000000000005 111.129 179.945 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . 0.457 ' O ' ' C ' ' A' ' 62' ' ' SER . 11.7 tt0 -113.24 -11.95 13.16 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.166 -0.47 . . . . 74.439999999999998 110.898 -179.977 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 62' ' ' SER . . . . . 0.457 ' C ' ' O ' ' A' ' 61' ' ' GLU . 0.1 OUTLIER 33.16 90.56 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.122 -0.49 . . . . 73.409999999999997 110.846 -179.794 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 32.3 t -109.53 124.73 51.58 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.11 -0.495 . . . . 63.25 110.876 -179.849 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 64' ' ' ILE . . . . . . . . . . . . . 14.5 mt -139.71 150.72 22.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.144 -0.48 . . . . 73.510000000000005 111.115 179.998 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 90.7 m -120.9 114.47 21.62 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.182 -0.463 . . . . 73.420000000000002 111.123 179.957 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . 0.577 HD21 ' CD1' ' A' ' 83' ' ' PHE . 17.5 mt -93.81 116.49 28.96 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.224 -0.444 . . . . 74.219999999999999 110.923 179.914 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 7.2 t60 -103.98 115.44 30.45 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.223 -0.444 . . . . 73.540000000000006 110.817 179.883 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 68' ' ' PHE . . . . . 0.555 ' CZ ' HG23 ' A' ' 114' ' ' ILE . 0.0 OUTLIER -103.86 139.75 38.62 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.183 -0.462 . . . . 74.439999999999998 110.889 -179.923 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 69' ' ' ALA . . . . . 0.425 ' HA ' ' CG2' ' A' ' 47' ' ' ILE . . . -120.44 114.93 22.53 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.125 -0.489 . . . . 74.319999999999993 111.108 179.906 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 70' ' ' MET . . . . . 0.459 ' CB ' ' HG2' ' A' ' 15' ' ' GLN . 1.0 OUTLIER -81.59 95.38 7.14 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.203 -0.453 . . . . 73.140000000000001 110.929 179.929 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -51.36 161.49 0.78 Allowed Pre-proline 0 C--N 1.329 -0.295 0 CA-C-O 121.602 0.715 . . . . 61.509999999999998 111.134 -179.89 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_endo -69.75 -15.09 36.97 Favored 'Trans proline' 0 C--N 1.341 0.158 0 C-N-CA 122.694 2.263 . . . . 72.420000000000002 112.316 179.991 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 73' ' ' MET . . . . . 0.501 ' O ' ' CB ' ' A' ' 76' ' ' TYR . 0.0 OUTLIER -101.38 -20.68 15.07 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.211 -0.45 . . . . 71.219999999999999 110.889 179.876 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 74' ' ' TYR . . . . . 0.668 ' CD1' ' C ' ' A' ' 74' ' ' TYR . 0.0 OUTLIER -50.72 152.42 3.5 Favored Pre-proline 0 C--N 1.328 -0.356 0 CA-C-O 121.654 0.74 . . . . 72.230000000000004 110.913 -179.899 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 75' ' ' PRO . . . . . 0.586 ' HA ' ' CD2' ' A' ' 74' ' ' TYR . 54.1 Cg_endo -69.75 -11.37 11.87 Favored 'Cis proline' 0 C--O 1.231 0.169 0 C-N-CA 122.684 -1.798 . . . . 71.530000000000001 112.334 -0.033 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 76' ' ' TYR . . . . . 0.501 ' CB ' ' O ' ' A' ' 73' ' ' MET . 2.3 t80 -34.06 -56.77 0.48 Allowed 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.175 -0.466 . . . . 63.399999999999999 110.927 -179.895 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 37.6 p -99.46 167.48 10.59 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.117 -0.492 . . . . 75.5 111.14 -179.969 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -89.03 129.93 46.36 Favored Pre-proline 0 C--N 1.329 -0.288 0 CA-C-O 121.576 0.703 . . . . 71.400000000000006 111.096 179.864 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 79' ' ' PRO . . . . . 0.423 ' CG ' HD11 ' A' ' 113' ' ' ILE . 53.4 Cg_endo -69.75 -176.59 1.53 Allowed 'Trans proline' 0 C--N 1.341 0.172 0 C-N-CA 122.695 2.263 . . . . 75.450000000000003 112.365 179.984 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . 0.4 ' HG3' ' N ' ' A' ' 81' ' ' ILE . 2.8 tt0 -114.55 141.16 48.1 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.223 -0.444 . . . . 64.129999999999995 110.912 -179.974 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 81' ' ' ILE . . . . . 0.468 ' CG2' HD22 ' A' ' 66' ' ' LEU . 17.4 mm -133.44 140.88 45.86 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.17 -0.468 . . . . 73.5 111.111 -179.979 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . 0.464 ' HG3' ' CD ' ' A' ' 84' ' ' LYS . 5.9 pt-20 -149.08 145.76 27.39 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.185 -0.461 . . . . 75.530000000000001 110.883 179.95 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 83' ' ' PHE . . . . . 0.577 ' CD1' HD21 ' A' ' 66' ' ' LEU . 26.5 m-85 -97.65 142.14 29.82 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.196 -0.457 . . . . 72.219999999999999 110.896 -179.946 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 84' ' ' LYS . . . . . 0.464 ' CD ' ' HG3' ' A' ' 82' ' ' GLU . 5.1 mmmt -126.92 173.65 9.44 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.167 -0.469 . . . . 75.510000000000005 110.872 179.975 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 85' ' ' ASN . . . . . 0.482 ' C ' HG21 ' A' ' 86' ' ' VAL . 1.7 m-80 63.29 -72.67 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.175 -0.466 . . . . 72.239999999999995 110.857 179.942 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 86' ' ' VAL . . . . . 0.482 HG21 ' C ' ' A' ' 85' ' ' ASN . 16.6 m 32.13 90.99 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.192 -0.458 . . . . 75.200000000000003 111.125 179.924 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -95.51 -74.14 0.56 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.167 -0.469 . . . . 72.430000000000007 110.91 -179.988 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 88' ' ' ASN . . . . . 0.469 ' ND2' ' HB ' ' A' ' 60' ' ' VAL . 62.4 m-80 -78.61 45.48 0.59 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.204 -0.453 . . . . 70.510000000000005 110.881 -179.974 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 89' ' ' VAL . . . . . 0.401 ' CG1' ' HG ' ' A' ' 94' ' ' LEU . 42.2 t -135.28 140.12 45.55 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.17 -0.468 . . . . 74.140000000000001 111.134 179.914 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 90' ' ' MET . . . . . 0.457 ' O ' ' CB ' ' A' ' 91' ' ' ASP . 22.0 mtm -92.1 -62.0 1.5 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.167 -0.469 . . . . 72.340000000000003 110.839 179.968 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 91' ' ' ASP . . . . . 0.457 ' CB ' ' O ' ' A' ' 90' ' ' MET . 0.4 OUTLIER 163.0 -22.15 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.226 -0.443 . . . . 75.140000000000001 110.857 179.968 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -62.9 -47.18 84.42 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.199 -0.455 . . . . 74.400000000000006 110.887 -179.789 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 93' ' ' GLN . . . . . 0.472 ' HB3' ' CE1' ' A' ' 128' ' ' PHE . 3.8 pm0 -71.26 -36.41 71.75 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.132 -0.485 . . . . 65.129999999999995 110.896 -179.945 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . 0.422 HD22 ' CG1' ' A' ' 86' ' ' VAL . 31.7 mt -58.0 -48.96 78.47 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.191 -0.458 . . . . 74.219999999999999 110.887 -179.97 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 2.4 mm-40 -65.79 -33.57 76.16 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.204 -0.453 . . . . 74.329999999999998 110.871 179.972 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 96' ' ' MET . . . . . . . . . . . . . 6.1 ttp -59.61 -36.65 76.74 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.222 -0.444 . . . . 74.329999999999998 110.898 179.954 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 97' ' ' LEU . . . . . 0.593 ' O ' ' CD1' ' A' ' 101' ' ' PHE . 61.2 mt -66.5 -43.63 84.82 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.201 -0.454 . . . . 73.109999999999999 110.899 -179.99 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 98' ' ' LYS . . . . . 0.421 ' HA ' ' CD2' ' A' ' 101' ' ' PHE . 8.5 mmtp -55.44 -37.1 67.26 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.239 -0.437 . . . . 73.540000000000006 110.897 179.823 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 8.9 m -62.4 -43.61 98.41 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.198 -0.455 . . . . 75.109999999999999 110.872 -179.873 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -71.01 -24.95 62.47 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.11 -0.496 . . . . 73.329999999999998 110.863 -179.96 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 101' ' ' PHE . . . . . 0.593 ' CD1' ' O ' ' A' ' 97' ' ' LEU . 9.0 m-30 -59.62 -40.84 88.92 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.167 -0.469 . . . . 74.439999999999998 110.912 -179.909 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -63.11 -40.26 97.1 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.122 -0.49 . . . . 75.420000000000002 110.882 179.992 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 14.7 ttpt -67.94 -36.5 80.22 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.25 -0.432 . . . . 74.430000000000007 110.901 179.847 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 3.8 mt -67.35 -47.6 80.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.208 -0.451 . . . . 74.340000000000003 111.115 179.895 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 105' ' ' HIS . . . . . . . . . . . . . 14.8 t60 -62.92 -42.19 99.71 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.161 -0.472 . . . . 74.129999999999995 110.881 179.868 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -57.96 -38.28 75.71 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.206 -0.452 . . . . 72.129999999999995 110.94 -179.966 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 8.9 t -88.15 -23.25 23.69 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.161 -0.472 . . . . 75.420000000000002 111.166 -179.992 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 13.4 m -114.59 41.01 2.43 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.174 -0.466 . . . . 55.240000000000002 110.898 -179.897 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 13.7 ttt180 -88.8 90.73 8.54 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.124 -0.489 . . . . 72.319999999999993 110.856 -179.914 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 140.09 -6.16 2.8 Favored Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.754 -0.736 . . . . 74.230000000000004 112.495 -179.966 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 111' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -136.11 -152.59 0.46 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.757 0.313 . . . . 74.129999999999995 110.919 -179.944 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 11.9 mt-10 -79.8 132.3 36.1 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.197 -0.456 . . . . 65.129999999999995 110.921 -179.956 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 113' ' ' ILE . . . . . 0.423 HD11 ' CG ' ' A' ' 79' ' ' PRO . 9.8 pt -126.27 -12.33 4.54 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 116.157 -0.474 . . . . 74.439999999999998 111.127 179.99 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 114' ' ' ILE . . . . . 0.555 HG23 ' CZ ' ' A' ' 68' ' ' PHE . 1.3 mp -63.05 -39.66 86.06 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.195 -0.457 . . . . 74.140000000000001 111.14 179.85 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 115' ' ' PHE . . . . . 0.565 ' CD1' HD12 ' A' ' 25' ' ' ILE . 40.9 t80 -70.96 -38.72 72.81 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.179 -0.464 . . . . 75.310000000000002 110.848 179.976 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 54.9 mm-40 -65.41 -44.04 88.65 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.128 -0.487 . . . . 64.019999999999996 110.849 -179.867 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 117' ' ' ILE . . . . . 0.506 HD12 ' CG ' ' A' ' 101' ' ' PHE . 0.4 OUTLIER -65.14 -40.15 87.89 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.172 -0.467 . . . . 72.530000000000001 111.142 179.965 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 118' ' ' THR . . . . . 0.45 ' N ' ' CG2' ' A' ' 117' ' ' ILE . 58.7 p -67.62 -42.9 81.62 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.176 -0.465 . . . . 74.540000000000006 111.157 179.974 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 119' ' ' SER . . . . . 0.407 ' HA ' ' CG ' ' A' ' 122' ' ' GLN . 0.7 OUTLIER -67.44 -31.41 71.57 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.238 -0.437 . . . . 72.329999999999998 110.864 -179.891 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 120' ' ' PHE . . . . . 0.422 ' O ' ' HG2' ' A' ' 123' ' ' GLU . 0.3 OUTLIER -77.65 -38.74 47.12 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.128 -0.487 . . . . 75.510000000000005 110.888 -179.941 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 121' ' ' THR . . . . . 0.444 ' CG2' HD12 ' A' ' 66' ' ' LEU . 9.7 p -71.64 -42.21 67.86 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.154 -0.476 . . . . 74.120000000000005 111.173 -179.948 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 122' ' ' GLN . . . . . 0.407 ' CG ' ' HA ' ' A' ' 119' ' ' SER . 1.1 pp0? -66.21 -41.08 90.62 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.229 -0.441 . . . . 72.540000000000006 110.93 179.953 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 123' ' ' GLU . . . . . 0.422 ' HG2' ' O ' ' A' ' 120' ' ' PHE . 11.9 pt-20 -68.37 -35.33 77.55 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.214 -0.448 . . . . 74.120000000000005 110.895 -179.915 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 124' ' ' LYS . . . . . 0.436 ' CE ' ' HA ' ' A' ' 124' ' ' LYS . 0.0 OUTLIER -72.16 -44.35 63.2 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.141 -0.481 . . . . 73.340000000000003 110.908 179.958 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 125' ' ' LEU . . . . . 0.551 ' CD1' ' C ' ' A' ' 125' ' ' LEU . 0.2 OUTLIER -65.18 -40.41 94.24 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.248 -0.433 . . . . 73.239999999999995 110.886 179.918 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -63.63 -45.43 90.28 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.223 -0.444 . . . . 74.109999999999999 110.893 179.835 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 127' ' ' GLU . . . . . 0.45 ' HG3' ' N ' ' A' ' 128' ' ' PHE . 0.0 OUTLIER -66.17 -29.3 69.56 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.158 -0.474 . . . . 72.219999999999999 110.896 -179.905 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 128' ' ' PHE . . . . . 0.472 ' CE1' ' HB3' ' A' ' 93' ' ' GLN . 1.8 t80 . . . . . 0 C--N 1.329 -0.319 0 CA-C-N 116.131 -0.486 . . . . 75.25 110.889 -179.901 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 20.2 mt . . . . . 0 C--O 1.231 0.121 0 CA-C-O 120.781 0.324 . . . . 74.150000000000006 110.888 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -51.25 -25.58 5.88 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.215 -0.448 . . . . 74.299999999999997 110.881 179.847 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . 0.414 ' O ' ' HG2' ' A' ' 13' ' ' GLU . 10.3 mm-40 -67.77 -38.99 84.16 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.221 -0.445 . . . . 75.409999999999997 110.913 -179.941 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 23.9 m-85 -64.51 -22.2 66.9 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.205 -0.452 . . . . 74.040000000000006 110.889 -179.834 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -57.43 -36.25 71.13 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.143 -0.48 . . . . 72.530000000000001 110.871 -179.842 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . 0.467 ' HG3' ' N ' ' A' ' 14' ' ' ILE . 5.6 pt-20 -59.82 -39.91 86.67 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.112 -0.494 . . . . 70.209999999999994 110.888 -179.981 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 14' ' ' ILE . . . . . 0.467 ' N ' ' HG3' ' A' ' 13' ' ' GLU . 3.7 mp -67.62 -47.47 80.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.178 -0.465 . . . . 73.450000000000003 111.109 179.967 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 46.4 mt-30 -64.56 -44.53 90.44 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.211 -0.45 . . . . 73.530000000000001 110.888 179.988 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 6.3 t -63.61 -41.47 98.3 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.218 -0.446 . . . . 73.310000000000002 110.865 -179.93 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 1.2 m-20 -57.98 -34.7 70.24 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.214 -0.448 . . . . 74.450000000000003 110.918 -179.936 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -67.23 -38.6 85.51 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.188 -0.46 . . . . 65.540000000000006 110.898 179.973 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . 0.459 ' CD1' HG13 ' A' ' 46' ' ' ILE . 6.1 mt -60.91 -51.52 68.93 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.148 -0.478 . . . . 65.310000000000002 110.936 -179.994 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 4.7 pt-20 -68.62 -37.9 80.11 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.198 -0.455 . . . . 73.209999999999994 110.905 179.917 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -63.83 -50.64 68.09 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.126 -0.488 . . . . 72.439999999999998 111.089 179.924 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . 0.451 ' N ' HD12 ' A' ' 22' ' ' ILE . 0.8 OUTLIER -71.4 -36.58 61.61 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 116.226 -0.443 . . . . 74.109999999999999 111.137 179.983 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -52.48 -34.45 49.32 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.177 -0.465 . . . . 74.439999999999998 110.889 179.963 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -67.23 -36.25 81.27 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.174 -0.466 . . . . 71.150000000000006 110.85 -179.77 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . 0.567 HD12 ' CE1' ' A' ' 115' ' ' PHE . 3.3 mt -79.33 -45.23 23.88 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.153 -0.476 . . . . 75.310000000000002 111.138 179.915 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 29.0 m-85 -109.04 46.35 0.98 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.155 -0.475 . . . . 74.219999999999999 110.936 -179.977 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 1.2 mtm -42.67 -57.4 2.74 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.081 -0.509 . . . . 74.430000000000007 110.9 179.903 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 6.2 p-10 -106.08 32.98 4.04 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.229 -0.441 . . . . 74.510000000000005 110.874 179.937 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -135.01 13.15 3.61 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.187 -0.46 . . . . 70.140000000000001 110.891 179.976 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 30' ' ' PHE . . . . . 0.611 ' C ' ' CD1' ' A' ' 30' ' ' PHE . 0.2 OUTLIER -111.89 139.92 46.98 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.195 -0.457 . . . . 73.319999999999993 110.854 -179.899 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 20.2 m -110.85 128.11 55.66 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.097 -0.501 . . . . 72.409999999999997 111.143 -179.928 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -87.61 113.71 23.55 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.218 -0.446 . . . . 70.030000000000001 110.891 179.918 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . 0.531 ' C ' ' CD2' ' A' ' 33' ' ' LEU . 0.1 OUTLIER -121.73 -16.68 7.63 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.193 -0.458 . . . . 71.040000000000006 110.899 -179.946 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 34' ' ' THR . . . . . 0.528 ' N ' ' CD2' ' A' ' 33' ' ' LEU . 15.8 m . . . . . 0 C--N 1.329 -0.293 0 CA-C-N 116.204 -0.453 . . . . 73.340000000000003 111.146 179.933 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 45' ' ' GLN . . . . . 0.469 ' O ' ' CG ' ' A' ' 45' ' ' GLN . 15.2 tt0 . . . . . 0 C--O 1.232 0.15 0 CA-C-O 120.775 0.322 . . . . 75.299999999999997 110.912 . . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 46' ' ' ILE . . . . . 0.459 HG13 ' CD1' ' A' ' 19' ' ' LEU . 0.0 OUTLIER 81.86 -34.74 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.229 -0.441 . . . . 73.439999999999998 111.112 -179.995 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . 0.473 ' N ' HD12 ' A' ' 47' ' ' ILE . 0.1 OUTLIER -32.97 141.02 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.209 -0.45 . . . . 73.120000000000005 111.12 179.878 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 48' ' ' PHE . . . . . 0.44 ' HA ' ' CD2' ' A' ' 33' ' ' LEU . 1.4 p90 -153.06 164.59 37.73 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.172 -0.467 . . . . 74.25 110.927 179.961 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . 0.437 ' CG ' HD11 ' A' ' 33' ' ' LEU . 12.5 mt-10 -108.86 152.31 25.08 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.183 -0.462 . . . . 71.519999999999996 110.893 -179.953 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 3.8 mm -133.89 141.54 43.73 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.142 -0.481 . . . . 73.010000000000005 111.144 179.951 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 85.8 m -86.28 126.7 34.49 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.168 -0.469 . . . . 73.430000000000007 111.144 179.957 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 16.2 mt -132.59 159.55 39.19 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.194 -0.457 . . . . 72.409999999999997 110.908 179.953 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -178.31 174.56 1.28 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.178 -0.465 . . . . 75.030000000000001 110.918 179.979 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 54' ' ' SER . . . . . 0.475 ' N ' HD11 ' A' ' 125' ' ' LEU . 7.3 p -63.16 -177.61 0.19 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.241 -0.436 . . . . 75.450000000000003 110.844 -179.792 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 30.2 m -91.18 -22.36 6.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.095 -0.502 . . . . 74.120000000000005 111.12 179.943 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -122.74 -170.13 2.04 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.208 -0.451 . . . . 61.030000000000001 110.862 179.95 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 1.7 mmmp? -118.11 -16.56 9.76 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.185 -0.462 . . . . 72.230000000000004 110.888 -179.97 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . 0.551 ' HA ' ' C ' ' A' ' 59' ' ' PRO . 56.8 mt-10 -120.22 146.69 43.14 Favored Pre-proline 0 C--N 1.329 -0.298 0 CA-C-O 121.675 0.75 . . . . 74.310000000000002 110.894 179.97 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 59' ' ' PRO . . . . . 0.551 ' C ' ' HA ' ' A' ' 58' ' ' GLU . 54.0 Cg_endo -69.75 -9.56 11.05 Favored 'Cis proline' 0 C--N 1.342 0.188 0 C-N-CA 122.695 -1.794 . . . . 52.299999999999997 112.334 0.034 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 60' ' ' VAL . . . . . 0.423 HG11 ' ND2' ' A' ' 88' ' ' ASN . 22.1 m -141.98 176.16 4.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.247 -0.433 . . . . 75.109999999999999 111.122 179.96 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . 0.447 ' O ' ' C ' ' A' ' 62' ' ' SER . 13.4 tt0 -106.97 -16.73 14.37 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.199 -0.455 . . . . 74.430000000000007 110.879 -180.0 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 62' ' ' SER . . . . . 0.447 ' C ' ' O ' ' A' ' 61' ' ' GLU . 26.7 m 34.12 87.19 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.161 -0.472 . . . . 72.0 110.87 -179.776 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 7.9 t -112.29 127.56 56.02 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.136 -0.483 . . . . 74.329999999999998 110.842 -179.777 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 64' ' ' ILE . . . . . . . . . . . . . 22.5 mt -140.61 140.34 33.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.144 -0.48 . . . . 64.340000000000003 111.127 179.948 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 29.8 m -103.28 117.3 34.19 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.15 -0.477 . . . . 72.299999999999997 111.159 179.968 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 8.9 mt -98.05 115.17 27.68 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.216 -0.447 . . . . 64.540000000000006 110.95 179.942 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 10.5 t60 -111.67 110.08 20.29 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.193 -0.458 . . . . 75.109999999999999 110.885 179.893 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 68' ' ' PHE . . . . . 0.577 ' CE1' HG21 ' A' ' 114' ' ' ILE . 0.0 OUTLIER -102.81 140.21 37.38 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.239 -0.437 . . . . 73.030000000000001 110.897 -179.893 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -120.73 116.41 25.21 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.144 -0.48 . . . . 73.340000000000003 111.073 179.961 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 70' ' ' MET . . . . . 0.479 ' HE3' ' CG1' ' A' ' 114' ' ' ILE . 1.1 mtt -87.06 108.96 19.1 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.241 -0.436 . . . . 74.319999999999993 110.908 179.934 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -61.68 160.38 27.26 Favored Pre-proline 0 C--N 1.33 -0.277 0 CA-C-O 121.516 0.674 . . . . 74.129999999999995 111.174 -179.924 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.83 -4.17 13.53 Favored 'Trans proline' 0 C--N 1.341 0.173 0 C-N-CA 122.636 2.224 . . . . 63.530000000000001 112.373 179.937 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 73' ' ' MET . . . . . 0.505 ' O ' ' CB ' ' A' ' 76' ' ' TYR . 0.0 OUTLIER -111.92 -24.58 9.88 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.183 -0.462 . . . . 74.420000000000002 110.868 179.909 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 74' ' ' TYR . . . . . 0.655 ' CD1' ' C ' ' A' ' 74' ' ' TYR . 0.0 OUTLIER -48.94 152.7 1.73 Allowed Pre-proline 0 C--N 1.329 -0.309 0 CA-C-O 121.666 0.746 . . . . 73.310000000000002 110.941 -179.861 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 75' ' ' PRO . . . . . 0.575 ' HA ' ' CD2' ' A' ' 74' ' ' TYR . 53.4 Cg_endo -69.75 -8.55 10.53 Favored 'Cis proline' 0 C--O 1.232 0.196 0 C-N-CA 122.714 -1.786 . . . . 65.540000000000006 112.319 -0.056 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 76' ' ' TYR . . . . . 0.505 ' CB ' ' O ' ' A' ' 73' ' ' MET . 31.1 t80 -33.0 -46.79 0.16 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.255 -0.43 . . . . 74.329999999999998 110.912 -179.902 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 13.8 p -106.83 -171.44 1.89 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.135 -0.484 . . . . 72.450000000000003 111.125 -179.961 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -104.8 130.41 23.22 Favored Pre-proline 0 C--N 1.329 -0.3 0 CA-C-O 121.577 0.703 . . . . 72.209999999999994 111.123 179.843 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 79' ' ' PRO . . . . . 0.464 ' HG3' ' CD1' ' A' ' 113' ' ' ILE . 53.3 Cg_endo -69.8 167.54 24.19 Favored 'Trans proline' 0 C--O 1.231 0.153 0 C-N-CA 122.648 2.232 . . . . 75.319999999999993 112.336 -179.975 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 1.7 tt0 -118.85 134.82 54.9 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.213 -0.449 . . . . 75.310000000000002 110.876 -179.962 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 81' ' ' ILE . . . . . 0.474 ' CG1' ' HA ' ' A' ' 68' ' ' PHE . 12.1 mt -142.8 150.83 17.8 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.152 -0.476 . . . . 75.340000000000003 111.129 179.973 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . 0.487 ' HG3' ' CD ' ' A' ' 84' ' ' LYS . 9.2 pt-20 -149.43 147.64 28.5 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.167 -0.47 . . . . 71.549999999999997 110.906 179.923 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 83' ' ' PHE . . . . . 0.519 ' CZ ' ' HD3' ' A' ' 98' ' ' LYS . 6.3 m-85 -89.03 140.58 29.29 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.161 -0.472 . . . . 72.329999999999998 110.861 -179.891 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 84' ' ' LYS . . . . . 0.51 ' O ' ' N ' ' A' ' 86' ' ' VAL . 8.7 mmmt -124.26 174.69 7.54 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.133 -0.485 . . . . 65.420000000000002 110.913 179.971 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 85' ' ' ASN . . . . . 0.411 ' C ' HG23 ' A' ' 86' ' ' VAL . 2.0 m-80 59.66 -76.06 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.265 -0.425 . . . . 63.310000000000002 110.852 179.937 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 86' ' ' VAL . . . . . 0.51 ' N ' ' O ' ' A' ' 84' ' ' LYS . 3.6 m 41.28 87.52 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.162 -0.472 . . . . 72.319999999999993 111.146 179.914 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -94.61 -78.39 0.44 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.187 -0.46 . . . . 75.310000000000002 110.934 -179.989 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 88' ' ' ASN . . . . . 0.423 ' ND2' HG11 ' A' ' 60' ' ' VAL . 33.6 m120 -83.96 55.02 3.11 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.173 -0.467 . . . . 71.219999999999999 110.871 -179.954 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 1.3 p -152.75 145.79 15.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.192 -0.458 . . . . 73.439999999999998 111.145 179.921 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 90' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -95.18 -155.65 0.48 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.176 -0.465 . . . . 65.329999999999998 110.88 179.904 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 91' ' ' ASP . . . . . 0.477 ' O ' ' CG ' ' A' ' 95' ' ' GLN . 0.1 OUTLIER -98.61 -17.76 18.46 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.227 -0.442 . . . . 75.209999999999994 110.883 179.955 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 78.8 p -66.64 -47.11 73.61 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.192 -0.458 . . . . 60.420000000000002 110.911 -179.783 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 93' ' ' GLN . . . . . 0.549 ' CG ' ' CD2' ' A' ' 128' ' ' PHE . 5.0 mt-30 -68.69 -42.97 77.07 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.114 -0.494 . . . . 74.120000000000005 110.918 -179.987 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . 0.419 ' CD2' HG12 ' A' ' 86' ' ' VAL . 0.1 OUTLIER -59.04 -49.11 79.14 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.156 -0.475 . . . . 64.530000000000001 110.91 -179.998 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 95' ' ' GLN . . . . . 0.477 ' CG ' ' O ' ' A' ' 91' ' ' ASP . 7.3 mm-40 -66.06 -35.25 80.03 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.149 -0.478 . . . . 74.140000000000001 110.941 179.911 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 96' ' ' MET . . . . . 0.512 ' SD ' ' CE1' ' A' ' 128' ' ' PHE . 29.5 ttp -60.3 -44.85 95.04 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.187 -0.461 . . . . 73.319999999999993 110.873 179.961 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 97' ' ' LEU . . . . . 0.521 ' O ' ' CD1' ' A' ' 101' ' ' PHE . 33.7 mt -58.13 -39.8 79.67 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.227 -0.442 . . . . 74.299999999999997 110.906 -179.968 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 98' ' ' LYS . . . . . 0.519 ' HD3' ' CZ ' ' A' ' 83' ' ' PHE . 5.6 mmtp -57.39 -43.78 83.94 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.186 -0.461 . . . . 74.219999999999999 110.881 179.82 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -61.3 -39.0 88.83 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.229 -0.442 . . . . 62.5 110.853 -179.879 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 100' ' ' GLU . . . . . 0.501 ' HG2' ' CE1' ' A' ' 120' ' ' PHE . 0.3 OUTLIER -69.86 -28.6 65.79 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.168 -0.469 . . . . 65.129999999999995 110.916 -179.97 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 101' ' ' PHE . . . . . 0.521 ' CD1' ' O ' ' A' ' 97' ' ' LEU . 9.2 m-30 -59.42 -39.17 82.62 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.143 -0.481 . . . . 72.450000000000003 110.843 -179.906 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.81 -39.5 94.38 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.143 -0.48 . . . . 73.310000000000002 110.904 -179.999 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 37.7 mtmt -68.77 -40.98 79.45 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.209 -0.451 . . . . 74.109999999999999 110.891 179.865 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 4.3 mt -65.09 -47.57 87.26 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 116.278 -0.419 . . . . 72.409999999999997 111.166 179.842 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 105' ' ' HIS . . . . . 0.495 ' O ' ' N ' ' A' ' 109' ' ' ARG . 4.6 t60 -62.76 -41.35 99.18 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.191 -0.459 . . . . 63.539999999999999 110.853 179.873 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -59.17 -42.35 90.56 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.224 -0.444 . . . . 74.25 110.89 -179.944 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 10.7 t -82.67 -28.12 30.85 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.191 -0.459 . . . . 74.019999999999996 111.126 -179.955 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 108' ' ' SER . . . . . 0.448 ' O ' ' N ' ' A' ' 110' ' ' GLY . 23.5 m -101.74 13.38 35.05 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.195 -0.457 . . . . 73.109999999999999 110.904 -179.874 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 109' ' ' ARG . . . . . 0.495 ' N ' ' O ' ' A' ' 105' ' ' HIS . 2.6 ttt-85 -61.57 77.88 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.114 -0.494 . . . . 72.230000000000004 110.882 -179.949 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 110' ' ' GLY . . . . . 0.448 ' N ' ' O ' ' A' ' 108' ' ' SER . . . 137.12 31.76 0.25 Allowed Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.739 -0.744 . . . . 61.43 112.52 -179.98 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 111' ' ' GLN . . . . . . . . . . . . . 4.4 pt20 -173.2 -165.69 0.3 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.743 0.306 . . . . 60.350000000000001 110.958 -179.841 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 38.8 mt-10 -65.74 127.64 32.77 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.216 -0.447 . . . . 73.5 110.88 179.994 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 113' ' ' ILE . . . . . 0.464 ' CD1' ' HG3' ' A' ' 79' ' ' PRO . 19.3 pt -126.5 -10.9 4.66 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.133 -0.485 . . . . 74.239999999999995 111.112 179.974 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 114' ' ' ILE . . . . . 0.577 HG21 ' CE1' ' A' ' 68' ' ' PHE . 13.6 mm -67.06 -44.9 87.92 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.221 -0.445 . . . . 75.200000000000003 111.079 179.887 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 115' ' ' PHE . . . . . 0.567 ' CE1' HD12 ' A' ' 25' ' ' ILE . 19.7 t80 -68.98 -34.5 75.41 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.19 -0.459 . . . . 61.329999999999998 110.894 179.962 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 4.9 mm-40 -67.47 -47.53 69.79 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.154 -0.475 . . . . 73.200000000000003 110.89 -179.909 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 117' ' ' ILE . . . . . 0.468 ' CG2' ' N ' ' A' ' 118' ' ' THR . 0.5 OUTLIER -64.31 -40.53 89.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.108 -0.496 . . . . 71.319999999999993 111.165 179.949 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 118' ' ' THR . . . . . 0.468 ' N ' ' CG2' ' A' ' 117' ' ' ILE . 58.3 p -67.03 -43.38 82.94 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.166 -0.47 . . . . 75.209999999999994 111.13 179.93 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -68.07 -39.24 83.01 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.24 -0.437 . . . . 73.420000000000002 110.876 -179.861 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 120' ' ' PHE . . . . . 0.501 ' CE1' ' HG2' ' A' ' 100' ' ' GLU . 0.4 OUTLIER -69.69 -45.21 68.81 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.12 -0.491 . . . . 73.0 110.92 -179.995 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 19.0 p -66.63 -42.17 87.18 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.142 -0.481 . . . . 71.349999999999994 111.144 -179.935 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 122' ' ' GLN . . . . . 0.442 ' NE2' ' O ' ' A' ' 122' ' ' GLN . 0.7 OUTLIER -65.06 -51.28 62.36 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.266 -0.425 . . . . 74.239999999999995 110.943 179.98 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 123' ' ' GLU . . . . . 0.474 ' CG ' ' N ' ' A' ' 124' ' ' LYS . 7.3 pt-20 -62.13 -46.2 90.08 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.188 -0.46 . . . . 74.540000000000006 110.869 -179.953 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 124' ' ' LYS . . . . . 0.474 ' N ' ' CG ' ' A' ' 123' ' ' GLU . 1.1 mmpt? -63.91 -40.07 95.64 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.189 -0.46 . . . . 73.340000000000003 110.874 179.986 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 125' ' ' LEU . . . . . 0.558 ' CD1' ' C ' ' A' ' 125' ' ' LEU . 0.1 OUTLIER -70.09 -38.97 75.83 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.231 -0.44 . . . . 73.510000000000005 110.9 179.92 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 126' ' ' ASP . . . . . 0.451 ' N ' HD13 ' A' ' 125' ' ' LEU . 1.6 t0 -66.72 -46.49 75.35 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.158 -0.474 . . . . 74.120000000000005 110.856 179.872 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -67.88 -28.63 67.69 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.215 -0.448 . . . . 75.129999999999995 110.914 -179.93 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 128' ' ' PHE . . . . . 0.549 ' CD2' ' CG ' ' A' ' 93' ' ' GLN . 0.5 OUTLIER . . . . . 0 C--N 1.329 -0.291 0 CA-C-N 116.17 -0.468 . . . . 64.340000000000003 110.906 -179.934 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 44.1 mt . . . . . 0 C--O 1.231 0.092 0 CA-C-O 120.813 0.339 . . . . 75.040000000000006 110.904 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 17.2 t0 -54.19 -31.67 53.55 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.198 -0.455 . . . . 72.209999999999994 110.866 179.828 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . 0.409 ' O ' ' HG2' ' A' ' 13' ' ' GLU . 97.0 mm-40 -66.72 -40.53 88.44 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.218 -0.447 . . . . 60.130000000000003 110.918 -179.901 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 20.1 m-85 -56.09 -22.94 30.9 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.194 -0.457 . . . . 73.439999999999998 110.925 -179.859 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 12' ' ' TYR . . . . . 0.456 ' CE1' ' CG1' ' A' ' 46' ' ' ILE . 0.3 OUTLIER -57.69 -36.34 71.82 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.145 -0.48 . . . . 75.010000000000005 110.869 -179.885 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . 0.469 ' HG3' ' N ' ' A' ' 14' ' ' ILE . 5.0 pt-20 -61.63 -41.11 97.04 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.173 -0.467 . . . . 64.030000000000001 110.874 -179.997 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 14' ' ' ILE . . . . . 0.469 ' N ' ' HG3' ' A' ' 13' ' ' GLU . 3.8 mp -68.28 -44.33 83.94 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-N 116.153 -0.476 . . . . 73.5 111.125 -179.99 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 10.2 mt-30 -65.99 -47.22 75.27 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.15 -0.477 . . . . 74.209999999999994 110.91 179.944 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 2.5 t -61.4 -40.69 95.29 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.177 -0.465 . . . . 72.200000000000003 110.871 -179.946 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -58.21 -33.72 69.6 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.208 -0.451 . . . . 75.540000000000006 110.887 -179.866 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . 0.401 ' OE1' ' SD ' ' A' ' 70' ' ' MET . 32.6 mt-10 -65.81 -39.08 90.54 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.197 -0.456 . . . . 74.5 110.876 -179.997 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 6.8 mp -63.18 -51.8 64.93 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.144 -0.48 . . . . 73.150000000000006 110.903 -179.943 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 1.7 pt-20 -68.8 -37.22 79.12 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.203 -0.453 . . . . 73.120000000000005 110.895 179.941 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -64.27 -50.51 67.63 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.148 -0.478 . . . . 65.510000000000005 111.066 179.97 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . 0.484 ' N ' HD12 ' A' ' 22' ' ' ILE . 0.9 OUTLIER -71.85 -35.31 54.35 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.272 -0.422 . . . . 73.340000000000003 111.117 179.971 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . 0.435 ' HG3' ' CD2' ' A' ' 30' ' ' PHE . 7.6 mtp180 -54.36 -37.99 65.59 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.174 -0.466 . . . . 71.040000000000006 110.887 179.936 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -65.38 -31.41 72.5 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.18 -0.464 . . . . 42.530000000000001 110.859 -179.786 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 5.1 mt -80.35 -45.43 22.1 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.135 -0.484 . . . . 74.530000000000001 111.099 179.972 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 26' ' ' TYR . . . . . 0.422 ' O ' ' N ' ' A' ' 30' ' ' PHE . 25.1 m-85 -107.97 41.28 1.57 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.175 -0.466 . . . . 70.109999999999999 110.909 -179.94 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 27' ' ' MET . . . . . 0.406 ' C ' ' O ' ' A' ' 26' ' ' TYR . 1.9 mtm -38.08 -52.94 1.42 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.137 -0.483 . . . . 74.420000000000002 110.869 179.907 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -88.83 -33.2 17.47 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.206 -0.452 . . . . 74.310000000000002 110.848 179.979 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -84.5 21.67 1.43 Allowed 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.237 -0.438 . . . . 62.5 110.875 179.997 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 30' ' ' PHE . . . . . 0.435 ' CD2' ' HG3' ' A' ' 23' ' ' ARG . 0.4 OUTLIER -111.0 128.67 55.92 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.189 -0.46 . . . . 71.530000000000001 110.89 -179.889 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 83.2 m -114.2 133.88 55.3 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.157 -0.474 . . . . 65.010000000000005 111.143 -179.923 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 41.8 t0 -98.11 120.5 38.62 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.213 -0.449 . . . . 71.510000000000005 110.891 179.918 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . 0.546 ' C ' ' CD2' ' A' ' 33' ' ' LEU . 0.2 OUTLIER -121.58 0.73 9.97 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.204 -0.453 . . . . 65.310000000000002 110.89 -179.904 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 34' ' ' THR . . . . . 0.423 ' O ' ' O ' ' A' ' 33' ' ' LEU . 0.2 OUTLIER . . . . . 0 C--N 1.33 -0.274 0 CA-C-N 116.186 -0.461 . . . . 75.019999999999996 111.184 179.999 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 45' ' ' GLN . . . . . 0.457 ' HG2' ' CD1' ' A' ' 47' ' ' ILE . 7.4 pt20 . . . . . 0 C--O 1.231 0.127 0 CA-C-O 120.787 0.327 . . . . 75.010000000000005 110.913 . . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 46' ' ' ILE . . . . . 0.456 ' CG1' ' CE1' ' A' ' 12' ' ' TYR . 15.4 mm 69.9 75.48 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.177 -0.465 . . . . 63.32 111.153 179.961 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . 0.527 ' N ' ' CD1' ' A' ' 47' ' ' ILE . 0.2 OUTLIER -142.52 148.33 20.13 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.171 -0.468 . . . . 73.409999999999997 111.135 179.875 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 22.3 p90 -162.14 155.4 20.58 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.146 -0.479 . . . . 72.129999999999995 110.903 179.919 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 13.4 mt-10 -108.44 151.88 25.44 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.199 -0.455 . . . . 74.319999999999993 110.87 -179.901 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . 0.401 ' CD1' ' HA ' ' A' ' 30' ' ' PHE . 29.9 mm -130.38 135.71 60.06 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.132 -0.486 . . . . 73.010000000000005 111.155 179.958 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 84.8 m -87.19 116.97 25.63 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.208 -0.451 . . . . 74.140000000000001 111.163 179.954 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 18.3 mt -117.0 164.91 13.99 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.241 -0.436 . . . . 71.420000000000002 110.94 179.959 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -175.76 175.84 1.96 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.203 -0.453 . . . . 75.010000000000005 110.865 179.943 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 76.6 p -66.69 -154.3 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.156 -0.474 . . . . 73.340000000000003 110.843 -179.789 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 17.3 m -119.21 -19.64 5.42 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.135 -0.484 . . . . 63.210000000000001 111.123 179.976 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -114.23 178.66 4.2 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.186 -0.461 . . . . 75.400000000000006 110.866 179.911 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . 0.457 ' C ' ' O ' ' A' ' 60' ' ' VAL . 0.0 OUTLIER -118.24 -5.63 10.88 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.168 -0.469 . . . . 73.310000000000002 110.917 179.974 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . 0.541 ' HA ' ' C ' ' A' ' 59' ' ' PRO . 2.9 pt-20 -135.57 145.65 54.24 Favored Pre-proline 0 C--N 1.329 -0.287 0 CA-C-O 121.654 0.74 . . . . 75.439999999999998 110.91 179.939 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 59' ' ' PRO . . . . . 0.541 ' C ' ' HA ' ' A' ' 58' ' ' GLU . 53.6 Cg_endo -69.78 -6.92 9.73 Favored 'Cis proline' 0 C--N 1.342 0.185 0 C-N-CA 122.654 -1.811 . . . . 71.049999999999997 112.332 0.011 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 60' ' ' VAL . . . . . 0.457 ' O ' ' C ' ' A' ' 57' ' ' LYS . 32.3 m -140.89 -174.25 0.75 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.205 -0.452 . . . . 75.540000000000006 111.115 179.954 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . 0.46 ' O ' ' C ' ' A' ' 62' ' ' SER . 7.2 tt0 -119.28 -12.2 9.45 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.182 -0.463 . . . . 73.219999999999999 110.879 -179.965 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 62' ' ' SER . . . . . 0.46 ' C ' ' O ' ' A' ' 61' ' ' GLU . 0.2 OUTLIER 33.8 89.21 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.158 -0.474 . . . . 71.540000000000006 110.888 -179.79 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 5.0 p -119.06 123.63 44.94 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.158 -0.474 . . . . 74.0 110.839 -179.802 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 64' ' ' ILE . . . . . . . . . . . . . 33.6 mt -135.69 134.96 51.46 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.126 -0.488 . . . . 75.219999999999999 111.131 179.921 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 36.6 m -98.81 113.98 26.34 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.157 -0.474 . . . . 62.539999999999999 111.133 179.969 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . 0.442 ' CD1' ' CD1' ' A' ' 83' ' ' PHE . 0.4 OUTLIER -94.74 111.37 23.15 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.236 -0.438 . . . . 74.329999999999998 110.899 179.984 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 5.1 t60 -103.38 112.02 24.72 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.217 -0.447 . . . . 75.340000000000003 110.873 179.843 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 68' ' ' PHE . . . . . 0.566 ' CE1' HG22 ' A' ' 114' ' ' ILE . 0.0 OUTLIER -103.76 139.91 38.35 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.227 -0.442 . . . . 74.209999999999994 110.861 -179.897 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 69' ' ' ALA . . . . . 0.504 ' CB ' HG21 ' A' ' 47' ' ' ILE . . . -123.66 116.22 22.73 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.171 -0.468 . . . . 75.540000000000006 111.058 179.94 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 70' ' ' MET . . . . . 0.453 ' HE1' ' CG1' ' A' ' 114' ' ' ILE . 0.0 OUTLIER -79.39 160.58 26.62 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.222 -0.445 . . . . 72.340000000000003 110.852 179.974 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -116.92 161.13 34.01 Favored Pre-proline 0 C--N 1.329 -0.295 0 CA-C-O 121.551 0.691 . . . . 63.340000000000003 111.145 -179.904 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.77 3.07 2.99 Favored 'Trans proline' 0 C--N 1.341 0.152 0 C-N-CA 122.702 2.268 . . . . 74.230000000000004 112.335 179.942 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 73' ' ' MET . . . . . 0.495 ' O ' ' CB ' ' A' ' 76' ' ' TYR . 0.5 OUTLIER -122.19 -24.98 4.97 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.201 -0.454 . . . . 73.099999999999994 110.901 179.889 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 74' ' ' TYR . . . . . 0.647 ' CD1' ' C ' ' A' ' 74' ' ' TYR . 0.0 OUTLIER -46.74 149.92 1.38 Allowed Pre-proline 0 C--N 1.329 -0.323 0 CA-C-O 121.698 0.761 . . . . 73.140000000000001 110.929 -179.875 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 75' ' ' PRO . . . . . 0.567 ' HA ' ' CD2' ' A' ' 74' ' ' TYR . 53.5 Cg_endo -69.8 -10.31 11.51 Favored 'Cis proline' 0 C--O 1.232 0.198 0 C-N-CA 122.713 -1.786 . . . . 41.530000000000001 112.307 0.007 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 76' ' ' TYR . . . . . 0.495 ' CB ' ' O ' ' A' ' 73' ' ' MET . 24.3 t80 -34.08 -45.84 0.22 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.264 -0.426 . . . . 72.129999999999995 110.914 -179.91 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 28.3 p -108.65 175.39 5.48 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.129 -0.487 . . . . 73.319999999999993 111.162 -179.969 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -100.55 127.69 32.07 Favored Pre-proline 0 C--N 1.329 -0.312 0 CA-C-O 121.541 0.686 . . . . 63.530000000000001 111.131 179.875 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.85 -168.82 0.3 Allowed 'Trans proline' 0 C--N 1.341 0.158 0 C-N-CA 122.656 2.237 . . . . 71.409999999999997 112.304 -179.947 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . 0.468 ' HG3' ' N ' ' A' ' 81' ' ' ILE . 0.3 OUTLIER -129.24 140.92 51.28 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.19 -0.459 . . . . 75.430000000000007 110.91 -179.976 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 81' ' ' ILE . . . . . 0.468 ' N ' ' HG3' ' A' ' 80' ' ' GLU . 3.1 mm -129.03 148.34 33.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.131 -0.486 . . . . 74.200000000000003 111.117 179.985 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . 0.497 ' HG3' ' CD ' ' A' ' 84' ' ' LYS . 4.1 pt-20 -147.83 142.85 27.0 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.195 -0.457 . . . . 63.240000000000002 110.908 179.966 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 83' ' ' PHE . . . . . 0.573 ' CE1' HD11 ' A' ' 97' ' ' LEU . 8.9 m-85 -99.39 138.64 36.19 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.171 -0.468 . . . . 71.109999999999999 110.899 -179.937 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 84' ' ' LYS . . . . . 0.497 ' CD ' ' HG3' ' A' ' 82' ' ' GLU . 7.7 mmmt -125.95 170.48 11.64 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.198 -0.455 . . . . 73.239999999999995 110.893 179.925 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 85' ' ' ASN . . . . . 0.62 ' N ' HD21 ' A' ' 85' ' ' ASN . 0.8 OUTLIER 63.86 -72.97 0.05 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.232 -0.44 . . . . 74.200000000000003 110.889 179.97 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 86' ' ' VAL . . . . . 0.444 ' N ' ' O ' ' A' ' 84' ' ' LYS . 4.7 m 35.62 89.96 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.18 -0.464 . . . . 75.519999999999996 111.098 179.906 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -95.09 -68.14 0.82 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.173 -0.467 . . . . 62.109999999999999 110.862 -179.991 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 88' ' ' ASN . . . . . 0.417 ' C ' HG23 ' A' ' 89' ' ' VAL . 19.9 t-20 -82.16 40.92 0.65 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.23 -0.441 . . . . 72.420000000000002 110.868 -179.943 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 89' ' ' VAL . . . . . 0.417 HG23 ' C ' ' A' ' 88' ' ' ASN . 6.6 t -132.95 149.19 31.54 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.223 -0.444 . . . . 73.030000000000001 111.142 179.902 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 90' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -101.86 -69.52 0.78 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.175 -0.466 . . . . 74.439999999999998 110.843 179.936 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 2.7 p30 -177.31 -43.44 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.208 -0.451 . . . . 72.340000000000003 110.848 -179.975 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -54.22 -38.93 66.23 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.173 -0.467 . . . . 73.0 110.886 -179.794 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 93' ' ' GLN . . . . . 0.54 ' OE1' ' CG ' ' A' ' 128' ' ' PHE . 4.0 tt0 -65.94 -45.18 82.75 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.083 -0.508 . . . . 75.010000000000005 110.932 -179.954 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 80.9 mt -60.51 -48.58 81.14 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.194 -0.457 . . . . 72.239999999999995 110.922 -179.994 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 2.7 mm-40 -63.66 -33.83 76.5 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.215 -0.448 . . . . 63.420000000000002 110.933 179.904 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 96' ' ' MET . . . . . . . . . . . . . 11.9 ttp -59.71 -39.49 84.8 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.191 -0.459 . . . . 73.519999999999996 110.901 179.946 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 97' ' ' LEU . . . . . 0.616 ' O ' ' CD1' ' A' ' 101' ' ' PHE . 29.1 mt -66.35 -39.13 88.98 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.193 -0.458 . . . . 73.519999999999996 110.934 -179.987 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 98' ' ' LYS . . . . . 0.437 ' HD3' ' CZ ' ' A' ' 83' ' ' PHE . 3.0 mmtp -61.62 -34.38 75.57 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.188 -0.46 . . . . 75.549999999999997 110.893 179.796 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 3.1 m -70.34 -45.88 65.28 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.233 -0.439 . . . . 74.409999999999997 110.872 -179.894 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 100' ' ' GLU . . . . . 0.403 ' HG2' ' O ' ' A' ' 97' ' ' LEU . 11.2 pt-20 -72.56 -23.79 61.03 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.159 -0.473 . . . . 62.520000000000003 110.906 -179.957 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 101' ' ' PHE . . . . . 0.616 ' CD1' ' O ' ' A' ' 97' ' ' LEU . 8.3 m-30 -59.87 -38.02 80.98 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.124 -0.489 . . . . 74.540000000000006 110.856 -179.918 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -62.33 -40.11 95.29 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.16 -0.473 . . . . 73.310000000000002 110.868 179.998 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 4.1 tmmt? -67.57 -39.81 84.89 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.31 -0.405 . . . . 72.439999999999998 110.873 179.877 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 1.8 mt -62.9 -47.15 94.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.217 -0.447 . . . . 61.140000000000001 111.16 179.861 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 105' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -62.84 -43.07 99.78 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.126 -0.488 . . . . 74.099999999999994 110.868 179.862 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -59.98 -31.04 69.53 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.198 -0.455 . . . . 64.409999999999997 110.907 -179.944 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 10.7 t -97.77 -9.66 26.18 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.15 -0.477 . . . . 73.420000000000002 111.152 -179.957 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 37.5 m -124.58 36.96 4.51 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.193 -0.458 . . . . 73.439999999999998 110.843 -179.827 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -97.18 93.83 6.77 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.155 -0.475 . . . . 75.140000000000001 110.878 -179.941 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 151.67 -13.88 0.79 Allowed Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.713 -0.756 . . . . 74.340000000000003 112.503 -179.954 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 111' ' ' GLN . . . . . . . . . . . . . 1.3 pt20 -132.09 -95.5 0.34 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.769 0.319 . . . . 75.230000000000004 110.884 -179.855 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 26.6 mt-10 -137.47 141.58 41.55 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.181 -0.463 . . . . 71.230000000000004 110.918 -179.942 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 113' ' ' ILE . . . . . . . . . . . . . 19.1 pt -124.17 -7.77 7.01 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.134 -0.484 . . . . 74.329999999999998 111.086 -179.977 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 114' ' ' ILE . . . . . 0.566 HG22 ' CE1' ' A' ' 68' ' ' PHE . 38.6 mm -67.07 -42.17 88.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.178 -0.464 . . . . 74.430000000000007 111.151 179.881 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 115' ' ' PHE . . . . . . . . . . . . . 29.2 t80 -72.53 -40.96 66.35 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.149 -0.478 . . . . 65.310000000000002 110.871 179.938 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 19.5 mm-40 -63.91 -42.57 97.37 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.16 -0.473 . . . . 74.230000000000004 110.923 -179.938 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 117' ' ' ILE . . . . . 0.576 HD12 ' CD2' ' A' ' 101' ' ' PHE . 0.4 OUTLIER -67.22 -41.97 87.37 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.116 -0.493 . . . . 74.519999999999996 111.179 179.952 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 118' ' ' THR . . . . . 0.481 ' N ' ' CG2' ' A' ' 117' ' ' ILE . 69.0 p -68.33 -43.12 78.26 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.158 -0.474 . . . . 61.539999999999999 111.141 179.903 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -64.51 -43.96 92.43 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.24 -0.436 . . . . 62.420000000000002 110.855 -179.809 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -63.1 -45.44 92.04 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.097 -0.501 . . . . 75.319999999999993 110.925 -179.986 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 25.0 p -69.17 -38.83 78.91 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.15 -0.477 . . . . 74.400000000000006 111.158 -179.982 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -64.21 -38.81 92.37 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.229 -0.441 . . . . 73.120000000000005 110.901 -179.999 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 123' ' ' GLU . . . . . 0.465 ' HG3' ' N ' ' A' ' 124' ' ' LYS . 6.4 pt-20 -77.65 -39.0 46.56 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.232 -0.44 . . . . 65.530000000000001 110.881 -179.925 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 124' ' ' LYS . . . . . 0.465 ' N ' ' HG3' ' A' ' 123' ' ' GLU . 0.1 OUTLIER -70.33 -39.64 74.63 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.214 -0.448 . . . . 74.120000000000005 110.865 179.982 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 1.3 tp -61.74 -50.43 72.45 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.253 -0.43 . . . . 65.409999999999997 110.928 179.929 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 3.1 t0 -57.84 -39.19 77.11 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.175 -0.466 . . . . 75.310000000000002 110.893 179.8 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 127' ' ' GLU . . . . . 0.469 ' HG3' ' N ' ' A' ' 128' ' ' PHE . 0.0 OUTLIER -63.96 -28.8 70.06 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.156 -0.474 . . . . 74.109999999999999 110.884 -179.879 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 128' ' ' PHE . . . . . 0.54 ' CG ' ' OE1' ' A' ' 93' ' ' GLN . 0.3 OUTLIER . . . . . 0 C--N 1.329 -0.316 0 CA-C-N 116.155 -0.475 . . . . 72.329999999999998 110.905 -179.949 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 63.3 mt . . . . . 0 C--O 1.231 0.11 0 CA-C-O 120.806 0.336 . . . . 73.109999999999999 110.88 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 1.2 t70 -50.5 -33.93 23.26 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.208 -0.451 . . . . 62.329999999999998 110.874 179.84 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 59.0 mm-40 -67.65 -36.8 81.42 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.195 -0.457 . . . . 73.239999999999995 110.904 -179.934 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 16.8 m-85 -62.82 -27.67 69.48 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.206 -0.452 . . . . 65.310000000000002 110.916 -179.841 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 1.5 t80 -60.07 -37.77 80.88 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.111 -0.495 . . . . 74.319999999999993 110.955 -179.924 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 2.1 mm-40 -61.47 -45.65 93.35 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.107 -0.497 . . . . 65.329999999999998 110.872 180.0 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 3.7 mp -65.76 -40.73 88.58 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.196 -0.456 . . . . 73.230000000000004 111.145 179.974 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 80.5 mt-30 -59.2 -47.03 86.83 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.197 -0.456 . . . . 62.109999999999999 110.902 179.954 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 4.6 t -63.86 -42.34 97.58 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.21 -0.45 . . . . 72.25 110.844 -179.924 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -57.8 -33.51 68.66 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.199 -0.455 . . . . 71.450000000000003 110.842 -179.844 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . 0.487 ' OE1' ' CD1' ' A' ' 114' ' ' ILE . 1.4 mm-40 -67.25 -38.72 85.61 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.193 -0.458 . . . . 75.140000000000001 110.908 -179.996 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . 0.531 HD13 ' CE1' ' A' ' 48' ' ' PHE . 8.6 mp -62.63 -51.53 66.9 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.142 -0.481 . . . . 74.409999999999997 110.916 179.993 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 1.8 pt-20 -68.72 -31.77 71.08 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.165 -0.47 . . . . 70.019999999999996 110.889 179.964 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -63.93 -48.39 76.75 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.177 -0.465 . . . . 75.319999999999993 111.082 179.928 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 0.7 OUTLIER -76.93 -37.1 26.53 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.234 -0.439 . . . . 74.430000000000007 111.122 179.981 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 2.7 mtt180 -52.55 -34.22 49.14 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.198 -0.456 . . . . 73.099999999999994 110.844 -179.985 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -66.18 -37.81 86.5 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.194 -0.457 . . . . 73.209999999999994 110.874 -179.809 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . 0.499 HD13 ' CE1' ' A' ' 115' ' ' PHE . 3.2 mt -78.81 -45.16 25.11 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.127 -0.488 . . . . 72.219999999999999 111.171 179.922 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 17.5 m-85 -106.94 45.11 1.0 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.168 -0.469 . . . . 74.299999999999997 110.916 179.998 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 1.5 mtm -45.15 -61.25 1.72 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.11 -0.496 . . . . 74.430000000000007 110.902 179.871 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 15.6 m-20 -75.5 -28.55 59.22 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.2 -0.454 . . . . 74.400000000000006 110.892 179.95 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -94.2 37.84 1.1 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.153 -0.476 . . . . 63.130000000000003 110.871 -179.99 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 9.3 t80 -117.71 129.06 55.48 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.191 -0.459 . . . . 74.219999999999999 110.889 -179.908 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 82.7 m -118.13 131.13 56.44 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.167 -0.47 . . . . 72.430000000000007 111.174 -179.962 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 9.4 t0 -105.12 114.46 28.67 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.244 -0.434 . . . . 75.209999999999994 110.833 179.959 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . 0.655 ' CD2' ' CE1' ' A' ' 67' ' ' HIS . 0.2 OUTLIER -111.05 -6.3 14.66 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.208 -0.451 . . . . 65.019999999999996 110.913 -179.965 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 34' ' ' THR . . . . . 0.473 ' N ' HD11 ' A' ' 33' ' ' LEU . 0.2 OUTLIER . . . . . 0 C--N 1.329 -0.295 0 CA-C-N 116.198 -0.456 . . . . 72.450000000000003 111.148 179.968 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 45' ' ' GLN . . . . . 0.519 ' O ' ' CB ' ' A' ' 46' ' ' ILE . 0.1 OUTLIER . . . . . 0 C--O 1.232 0.175 0 CA-C-O 120.765 0.317 . . . . 74.129999999999995 110.895 . . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 46' ' ' ILE . . . . . 0.519 ' CB ' ' O ' ' A' ' 45' ' ' GLN . 0.1 OUTLIER 86.82 -16.67 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.222 -0.444 . . . . 63.340000000000003 111.126 179.974 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . 0.523 ' N ' ' CD1' ' A' ' 47' ' ' ILE . 0.1 OUTLIER -45.62 149.63 0.31 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-N 116.16 -0.473 . . . . 74.430000000000007 111.105 179.872 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 48' ' ' PHE . . . . . 0.531 ' CE1' HD13 ' A' ' 19' ' ' LEU . 27.8 p90 -158.46 171.09 20.79 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.122 -0.49 . . . . 75.230000000000004 110.885 179.936 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . 0.492 ' CG ' ' HB2' ' A' ' 67' ' ' HIS . 5.8 mt-10 -119.35 161.16 20.94 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.168 -0.469 . . . . 74.230000000000004 110.884 -179.924 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 8.2 mm -142.96 137.43 26.86 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.147 -0.478 . . . . 72.400000000000006 111.087 179.994 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 85.5 m -83.9 131.58 34.85 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.17 -0.468 . . . . 60.130000000000003 111.105 179.971 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . 0.451 HD13 ' CD1' ' A' ' 66' ' ' LEU . 17.4 mt -134.79 159.5 41.15 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.187 -0.461 . . . . 72.030000000000001 110.873 179.989 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 53' ' ' ARG . . . . . 0.411 ' HD2' ' C ' ' A' ' 52' ' ' LEU . 0.0 OUTLIER 178.82 166.21 0.89 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.156 -0.474 . . . . 75.239999999999995 110.885 179.977 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -57.38 167.3 1.0 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.153 -0.476 . . . . 75.430000000000007 110.841 -179.789 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 19.2 m -78.91 -21.52 12.81 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.111 -0.495 . . . . 73.049999999999997 111.096 179.965 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 2.4 t70 -118.54 -172.05 2.2 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.201 -0.454 . . . . 73.439999999999998 110.837 179.97 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 3.3 mmmm -119.04 -17.51 8.98 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.218 -0.446 . . . . 74.239999999999995 110.919 179.962 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . 0.539 ' HA ' ' C ' ' A' ' 59' ' ' PRO . 4.7 pt-20 -120.08 145.77 40.74 Favored Pre-proline 0 C--N 1.33 -0.28 0 CA-C-O 121.664 0.745 . . . . 72.340000000000003 110.868 179.944 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 59' ' ' PRO . . . . . 0.539 ' C ' ' HA ' ' A' ' 58' ' ' GLU . 52.9 Cg_endo -69.81 -14.67 12.59 Favored 'Cis proline' 0 C--N 1.342 0.217 0 C-N-CA 122.697 -1.793 . . . . 74.329999999999998 112.303 0.073 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 60' ' ' VAL . . . . . 0.429 ' HB ' ' CG ' ' A' ' 88' ' ' ASN . 13.3 m -142.37 166.86 15.68 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.261 -0.427 . . . . 73.329999999999998 111.154 179.925 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 26.0 tt0 -102.88 -22.05 13.91 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.191 -0.459 . . . . 71.519999999999996 110.88 -179.952 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 62' ' ' SER . . . . . 0.461 ' CB ' HD22 ' A' ' 125' ' ' LEU . 2.5 m 40.77 92.31 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.205 -0.452 . . . . 73.349999999999994 110.821 -179.783 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 1.1 p -108.95 123.07 48.53 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.12 -0.491 . . . . 63.25 110.886 -179.863 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 64' ' ' ILE . . . . . . . . . . . . . 41.6 mt -136.98 137.4 46.94 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.115 -0.493 . . . . 70.010000000000005 111.155 179.958 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 16.3 m -101.24 115.69 31.09 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.206 -0.452 . . . . 75.129999999999995 111.17 179.951 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . 0.562 ' CD2' ' CE1' ' A' ' 83' ' ' PHE . 14.8 mt -95.93 109.24 21.64 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.202 -0.454 . . . . 64.299999999999997 110.909 179.989 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 67' ' ' HIS . . . . . 0.655 ' CE1' ' CD2' ' A' ' 33' ' ' LEU . 3.6 t60 -101.76 110.46 22.45 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.208 -0.451 . . . . 74.120000000000005 110.813 179.894 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 68' ' ' PHE . . . . . 0.494 ' CE1' HG21 ' A' ' 114' ' ' ILE . 0.0 OUTLIER -101.74 138.91 38.09 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.17 -0.468 . . . . 74.319999999999993 110.87 -179.938 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 69' ' ' ALA . . . . . 0.478 ' CB ' HG22 ' A' ' 47' ' ' ILE . . . -118.68 123.56 45.22 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.157 -0.474 . . . . 63.030000000000001 111.119 179.903 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 70' ' ' MET . . . . . 0.481 ' HE3' ' CD1' ' A' ' 114' ' ' ILE . 7.8 mmt -90.72 89.88 7.7 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.241 -0.436 . . . . 74.310000000000002 110.864 179.99 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -47.06 159.55 0.38 Allowed Pre-proline 0 C--N 1.33 -0.274 0 CA-C-O 121.589 0.709 . . . . 72.409999999999997 111.122 -179.957 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.76 2.15 3.79 Favored 'Trans proline' 0 C--N 1.342 0.201 0 C-N-CA 122.66 2.24 . . . . 75.310000000000002 112.348 179.926 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 73' ' ' MET . . . . . 0.555 ' HE1' ' CD2' ' A' ' 76' ' ' TYR . 0.0 OUTLIER -116.86 -25.82 7.14 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.245 -0.434 . . . . 74.230000000000004 110.873 179.886 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 74' ' ' TYR . . . . . 0.662 ' CD1' ' C ' ' A' ' 74' ' ' TYR . 0.0 OUTLIER -52.24 153.75 4.73 Favored Pre-proline 0 C--N 1.328 -0.364 0 CA-C-O 121.693 0.759 . . . . 75.340000000000003 110.898 -179.846 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 75' ' ' PRO . . . . . 0.567 ' HA ' ' CD2' ' A' ' 74' ' ' TYR . 53.6 Cg_endo -69.74 -11.11 11.77 Favored 'Cis proline' 0 C--N 1.341 0.182 0 C-N-CA 122.682 -1.799 . . . . 72.420000000000002 112.359 -0.114 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 76' ' ' TYR . . . . . 0.555 ' CD2' ' HE1' ' A' ' 73' ' ' MET . 10.2 t80 -33.91 -57.01 0.47 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.241 -0.436 . . . . 75.409999999999997 110.947 -179.947 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 30.4 p -97.72 -179.66 4.52 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.098 -0.501 . . . . 73.120000000000005 111.089 -179.955 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -94.88 129.25 36.45 Favored Pre-proline 0 C--N 1.329 -0.291 0 CA-C-O 121.623 0.725 . . . . 73.329999999999998 111.068 179.888 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 79' ' ' PRO . . . . . 0.449 ' HG3' ' CD1' ' A' ' 113' ' ' ILE . 53.4 Cg_endo -69.78 174.09 10.04 Favored 'Trans proline' 0 C--N 1.342 0.205 0 C-N-CA 122.666 2.244 . . . . 70.340000000000003 112.344 -179.988 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 3.1 tt0 -118.45 138.54 52.41 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.196 -0.456 . . . . 73.140000000000001 110.874 -179.975 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 81' ' ' ILE . . . . . 0.464 ' CG1' ' HA ' ' A' ' 68' ' ' PHE . 15.0 mt -144.56 148.93 17.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.131 -0.486 . . . . 75.109999999999999 111.118 179.983 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . 0.506 ' HG3' ' CD ' ' A' ' 84' ' ' LYS . 11.3 pt-20 -146.34 148.28 32.21 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.188 -0.46 . . . . 71.049999999999997 110.88 179.953 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 83' ' ' PHE . . . . . 0.562 ' CE1' ' CD2' ' A' ' 66' ' ' LEU . 49.6 m-85 -90.42 136.68 32.9 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.172 -0.467 . . . . 72.140000000000001 110.915 -179.975 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 84' ' ' LYS . . . . . 0.506 ' CD ' ' HG3' ' A' ' 82' ' ' GLU . 9.4 mmmt -125.82 169.95 12.1 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.12 -0.491 . . . . 74.030000000000001 110.893 -179.996 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 85' ' ' ASN . . . . . 0.477 ' C ' HG23 ' A' ' 86' ' ' VAL . 5.7 m-80 62.63 -73.03 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.251 -0.431 . . . . 72.420000000000002 110.903 179.981 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 86' ' ' VAL . . . . . 0.477 HG23 ' C ' ' A' ' 85' ' ' ASN . 30.5 m 31.86 91.34 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.226 -0.443 . . . . 75.439999999999998 111.132 179.919 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -96.18 -72.99 0.61 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.172 -0.467 . . . . 64.510000000000005 110.932 -179.98 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 88' ' ' ASN . . . . . 0.429 ' CG ' ' HB ' ' A' ' 60' ' ' VAL . 70.2 m-80 -76.95 54.12 0.99 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.158 -0.473 . . . . 64.340000000000003 110.927 -179.995 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 16.2 t -139.2 154.99 25.95 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.203 -0.453 . . . . 74.409999999999997 111.114 179.954 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 90' ' ' MET . . . . . . . . . . . . . 4.8 mtm -100.95 -69.59 0.77 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.177 -0.465 . . . . 75.310000000000002 110.866 179.938 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 4.3 p-10 173.62 -44.63 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.201 -0.454 . . . . 72.349999999999994 110.86 179.945 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -54.38 -38.69 66.43 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.222 -0.444 . . . . 74.200000000000003 110.857 -179.74 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 93' ' ' GLN . . . . . 0.596 ' OE1' ' CD2' ' A' ' 128' ' ' PHE . 0.0 OUTLIER -66.6 -42.69 86.52 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.169 -0.469 . . . . 54.329999999999998 110.91 -179.969 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . 0.469 HD21 ' CG1' ' A' ' 86' ' ' VAL . 84.1 mt -62.26 -48.29 80.58 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.158 -0.474 . . . . 74.299999999999997 110.927 -179.983 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -65.45 -34.27 77.88 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.205 -0.452 . . . . 75.420000000000002 110.92 179.88 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 96' ' ' MET . . . . . . . . . . . . . 26.8 ttp -59.99 -39.36 85.45 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.194 -0.457 . . . . 74.409999999999997 110.878 179.939 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 97' ' ' LEU . . . . . 0.552 ' O ' ' CD1' ' A' ' 101' ' ' PHE . 17.3 mt -66.85 -39.65 87.65 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.243 -0.435 . . . . 55.210000000000001 110.908 -179.98 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 5.2 mmtm -56.29 -38.0 70.63 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.198 -0.455 . . . . 73.420000000000002 110.876 179.853 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 1.7 m -69.58 -39.64 77.2 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.237 -0.438 . . . . 74.329999999999998 110.85 -179.885 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 68.4 mm-40 -69.22 -24.53 64.03 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.137 -0.483 . . . . 75.209999999999994 110.876 -179.912 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 101' ' ' PHE . . . . . 0.552 ' CD1' ' O ' ' A' ' 97' ' ' LEU . 6.9 m-30 -63.0 -32.39 73.74 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.155 -0.475 . . . . 75.109999999999999 110.886 -179.947 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 102' ' ' LYS . . . . . 0.42 ' HE2' ' C ' ' A' ' 102' ' ' LYS . 2.3 ttpt -70.5 -41.79 72.17 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.171 -0.468 . . . . 74.310000000000002 110.893 179.965 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 12.2 ttpt -66.87 -41.17 87.74 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.223 -0.444 . . . . 73.409999999999997 110.912 179.872 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 3.2 mt -64.84 -47.59 87.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.22 -0.445 . . . . 73.239999999999995 111.112 179.856 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 105' ' ' HIS . . . . . 0.429 ' O ' ' N ' ' A' ' 109' ' ' ARG . 10.1 t60 -62.91 -41.23 99.39 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.224 -0.444 . . . . 74.420000000000002 110.889 179.899 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -59.11 -42.59 90.9 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.217 -0.447 . . . . 65.219999999999999 110.904 -179.962 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 10.4 t -81.97 -27.14 33.38 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.184 -0.462 . . . . 75.420000000000002 111.152 -179.97 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 40.5 m -107.44 24.31 13.08 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.225 -0.443 . . . . 64.040000000000006 110.839 -179.869 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 109' ' ' ARG . . . . . 0.429 ' N ' ' O ' ' A' ' 105' ' ' HIS . 18.0 ttt180 -71.65 81.76 0.84 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.156 -0.475 . . . . 75.040000000000006 110.861 -179.924 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 155.51 -33.35 0.64 Allowed Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 120.774 -0.727 . . . . 33.030000000000001 112.54 -179.931 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 111' ' ' GLN . . . . . 0.403 ' HG3' ' N ' ' A' ' 112' ' ' GLU . 10.5 pt20 -112.09 -158.72 0.66 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.746 0.308 . . . . 72.519999999999996 110.92 -179.862 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 112' ' ' GLU . . . . . 0.403 ' N ' ' HG3' ' A' ' 111' ' ' GLN . 4.0 mt-10 -69.85 136.65 50.97 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.242 -0.435 . . . . 74.409999999999997 110.871 -179.943 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 113' ' ' ILE . . . . . 0.449 ' CD1' ' HG3' ' A' ' 79' ' ' PRO . 2.3 pt -123.95 -6.73 7.21 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.108 -0.496 . . . . 74.230000000000004 111.095 179.998 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 114' ' ' ILE . . . . . 0.495 ' H ' ' CD1' ' A' ' 114' ' ' ILE . 3.5 mp -68.22 -46.66 80.74 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-N 116.194 -0.457 . . . . 74.430000000000007 111.155 179.834 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 115' ' ' PHE . . . . . 0.499 ' CE1' HD13 ' A' ' 25' ' ' ILE . 11.4 t80 -65.19 -37.46 87.42 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.142 -0.481 . . . . 72.219999999999999 110.916 179.91 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 6.6 mm-40 -67.87 -45.24 75.11 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.106 -0.497 . . . . 74.430000000000007 110.897 -179.947 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 117' ' ' ILE . . . . . 0.506 HD12 ' CD2' ' A' ' 101' ' ' PHE . 0.4 OUTLIER -67.55 -40.92 85.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.157 -0.474 . . . . 73.340000000000003 111.085 -179.981 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 118' ' ' THR . . . . . 0.454 ' N ' ' CG2' ' A' ' 117' ' ' ILE . 81.3 p -68.79 -43.49 75.59 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.204 -0.453 . . . . 73.340000000000003 111.134 179.978 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 3.3 t -68.1 -44.42 76.24 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.262 -0.427 . . . . 74.010000000000005 110.836 -179.832 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 4.6 t80 -62.9 -45.2 93.63 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.146 -0.479 . . . . 75.420000000000002 110.887 -179.939 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 17.1 p -66.23 -45.32 81.06 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.099 -0.5 . . . . 74.329999999999998 111.138 -179.892 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 40.8 tt0 -65.26 -43.81 90.08 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.266 -0.425 . . . . 73.510000000000005 110.902 -179.99 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 11.1 pt-20 -70.61 -28.8 65.12 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.178 -0.465 . . . . 71.439999999999998 110.895 -179.945 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 124' ' ' LYS . . . . . 0.459 ' CE ' ' HA ' ' A' ' 124' ' ' LYS . 0.2 OUTLIER -78.99 -40.86 30.46 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.173 -0.467 . . . . 74.120000000000005 110.894 179.921 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 125' ' ' LEU . . . . . 0.461 HD22 ' CB ' ' A' ' 62' ' ' SER . 0.7 OUTLIER -69.98 -38.1 75.93 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.236 -0.438 . . . . 70.230000000000004 110.949 179.906 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -66.7 -46.31 75.97 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.185 -0.461 . . . . 73.439999999999998 110.837 179.866 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 127' ' ' GLU . . . . . 0.443 ' OE1' ' C ' ' A' ' 127' ' ' GLU . 1.6 pp20? -65.88 -28.19 68.77 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.185 -0.461 . . . . 72.420000000000002 110.873 -179.885 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 128' ' ' PHE . . . . . 0.596 ' CD2' ' OE1' ' A' ' 93' ' ' GLN . 0.2 OUTLIER . . . . . 0 C--N 1.329 -0.311 0 CA-C-N 116.144 -0.48 . . . . 74.510000000000005 110.9 -179.913 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . 0.446 ' CD2' ' HE1' ' A' ' 73' ' ' MET . 60.4 mt . . . . . 0 C--O 1.231 0.109 0 CA-C-O 120.829 0.347 . . . . 75.230000000000004 110.903 . . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . 0.417 ' O ' ' HB2' ' A' ' 12' ' ' TYR . 16.3 t70 -50.51 -33.38 21.28 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.21 -0.45 . . . . 75.120000000000005 110.841 179.831 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . 0.4 ' O ' ' HG2' ' A' ' 13' ' ' GLU . 2.3 mm-40 -70.11 -40.76 74.69 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.19 -0.459 . . . . 74.409999999999997 110.914 -179.865 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 12.7 m-85 -50.99 -24.72 3.92 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.199 -0.455 . . . . 72.409999999999997 110.929 -179.872 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 12' ' ' TYR . . . . . 0.417 ' HB2' ' O ' ' A' ' 9' ' ' ASP . 0.1 OUTLIER -59.17 -36.23 74.94 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.127 -0.488 . . . . 74.340000000000003 110.919 -179.947 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . 0.487 ' HG3' ' N ' ' A' ' 14' ' ' ILE . 6.5 pt-20 -60.28 -42.87 96.36 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.12 -0.491 . . . . 63.140000000000001 110.901 -179.938 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 14' ' ' ILE . . . . . 0.487 ' N ' ' HG3' ' A' ' 13' ' ' GLU . 3.9 mp -68.46 -39.95 81.46 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.144 -0.48 . . . . 72.400000000000006 111.149 179.927 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . 0.457 ' HG2' ' CE1' ' A' ' 74' ' ' TYR . 79.8 mt-30 -63.63 -48.28 77.91 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.175 -0.466 . . . . 71.209999999999994 110.888 179.941 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -64.84 -39.18 93.15 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.211 -0.449 . . . . 70.219999999999999 110.95 -179.958 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -59.08 -33.82 71.26 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.183 -0.462 . . . . 75.109999999999999 110.902 -179.927 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 2.1 mm-40 -66.61 -41.01 89.04 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.152 -0.477 . . . . 74.329999999999998 110.892 179.972 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . 0.401 ' CD1' HG13 ' A' ' 46' ' ' ILE . 6.0 mt -59.96 -51.39 69.88 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.164 -0.471 . . . . 75.450000000000003 110.898 -179.941 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 5.0 pt-20 -68.34 -34.95 77.02 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.191 -0.459 . . . . 75.329999999999998 110.891 179.916 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -62.76 -50.6 70.41 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.157 -0.474 . . . . 74.340000000000003 111.099 179.923 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . 0.437 ' N ' HD13 ' A' ' 22' ' ' ILE . 0.6 OUTLIER -77.65 -34.27 20.03 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.155 -0.475 . . . . 64.109999999999999 111.151 179.991 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 1.6 mtt180 -52.25 -35.23 49.23 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.202 -0.454 . . . . 70.420000000000002 110.887 179.94 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -67.23 -29.14 68.71 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.167 -0.47 . . . . 71.530000000000001 110.857 -179.743 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . 0.509 ' CD1' ' CE1' ' A' ' 115' ' ' PHE . 4.5 mt -84.49 -45.21 17.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.092 -0.504 . . . . 63.240000000000002 111.163 179.896 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 16.1 m-85 -110.38 46.69 1.02 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.196 -0.456 . . . . 75.140000000000001 110.904 -179.975 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 5.1 mtm -43.95 -61.83 1.32 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.114 -0.494 . . . . 64.5 110.9 179.897 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -82.7 -19.28 38.36 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.235 -0.438 . . . . 64.219999999999999 110.894 179.924 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 45.2 m-20 -100.55 37.15 1.75 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.209 -0.45 . . . . 74.200000000000003 110.885 179.967 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 3.9 t80 -125.5 126.28 44.61 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.186 -0.461 . . . . 74.230000000000004 110.869 -179.898 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 52.7 m -118.1 133.27 56.06 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.167 -0.47 . . . . 74.129999999999995 111.116 -179.958 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 5.7 t0 -103.74 114.32 28.49 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.236 -0.438 . . . . 74.540000000000006 110.892 179.863 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . 0.512 ' CD1' ' C ' ' A' ' 33' ' ' LEU . 0.2 OUTLIER -103.34 -5.44 22.99 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.182 -0.463 . . . . 74.109999999999999 110.885 -179.91 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 34' ' ' THR . . . . . 0.46 ' N ' HD12 ' A' ' 33' ' ' LEU . 0.3 OUTLIER . . . . . 0 C--N 1.329 -0.302 0 CA-C-N 116.198 -0.456 . . . . 72.349999999999994 111.143 179.933 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 45' ' ' GLN . . . . . 0.497 ' O ' ' CB ' ' A' ' 46' ' ' ILE . 18.0 pt20 . . . . . 0 C--O 1.232 0.145 0 CA-C-O 120.768 0.318 . . . . 64.140000000000001 110.906 . . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 46' ' ' ILE . . . . . 0.497 ' CB ' ' O ' ' A' ' 45' ' ' GLN . 0.0 OUTLIER 84.83 -24.46 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.236 -0.438 . . . . 74.310000000000002 111.089 179.946 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . 0.473 HG23 ' CG ' ' A' ' 45' ' ' GLN . 0.2 OUTLIER -32.7 143.66 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.181 -0.463 . . . . 75.540000000000006 111.154 179.864 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 11.8 p90 -156.92 174.43 15.52 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.216 -0.447 . . . . 72.219999999999999 110.873 179.958 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . 0.473 ' CG ' ' HB2' ' A' ' 67' ' ' HIS . 6.3 mt-10 -123.54 161.03 25.73 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.146 -0.479 . . . . 74.230000000000004 110.888 -179.908 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 13.6 mm -138.04 129.34 38.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.171 -0.468 . . . . 73.349999999999994 111.084 -179.988 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 89.3 m -84.01 121.91 28.04 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.142 -0.481 . . . . 72.129999999999995 111.141 179.932 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 27.4 mt -121.56 166.06 14.77 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.23 -0.441 . . . . 54.350000000000001 110.941 179.935 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 53' ' ' ARG . . . . . 0.41 ' C ' ' CD2' ' A' ' 125' ' ' LEU . 18.8 ptt180 -179.31 164.79 1.39 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.206 -0.452 . . . . 75.299999999999997 110.85 179.97 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 54' ' ' SER . . . . . 0.477 ' N ' HD23 ' A' ' 125' ' ' LEU . 1.7 m -60.65 167.8 2.52 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.164 -0.471 . . . . 63.219999999999999 110.867 -179.809 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 27.5 m -76.9 -24.72 15.42 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.119 -0.491 . . . . 75.129999999999995 111.155 179.93 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 3.2 t0 -120.5 -171.97 2.28 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.147 -0.479 . . . . 73.329999999999998 110.845 179.936 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 7.4 mmmt -116.11 -20.53 9.83 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.141 -0.481 . . . . 74.120000000000005 110.888 179.969 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . 0.548 ' HA ' ' C ' ' A' ' 59' ' ' PRO . 6.3 pt-20 -115.15 144.38 32.05 Favored Pre-proline 0 C--N 1.329 -0.298 0 CA-C-O 121.674 0.749 . . . . 73.430000000000007 110.831 179.959 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 59' ' ' PRO . . . . . 0.548 ' C ' ' HA ' ' A' ' 58' ' ' GLU . 53.5 Cg_endo -69.79 -13.88 12.5 Favored 'Cis proline' 0 C--N 1.342 0.192 0 C-N-CA 122.683 -1.799 . . . . 74.530000000000001 112.308 -0.017 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 60' ' ' VAL . . . . . 0.427 ' HB ' ' CG ' ' A' ' 88' ' ' ASN . 10.2 m -147.32 171.3 3.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-N 116.266 -0.424 . . . . 65.409999999999997 111.148 179.892 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . 0.462 ' O ' ' C ' ' A' ' 62' ' ' SER . 1.4 pt-20 -107.1 -18.41 13.9 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.165 -0.47 . . . . 72.420000000000002 110.914 179.967 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 62' ' ' SER . . . . . 0.462 ' C ' ' O ' ' A' ' 61' ' ' GLU . 71.1 m 32.72 90.55 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.143 -0.481 . . . . 74.299999999999997 110.915 -179.821 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 26.8 t -107.75 123.16 48.13 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.131 -0.486 . . . . 72.310000000000002 110.866 -179.802 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 64' ' ' ILE . . . . . . . . . . . . . 35.8 mt -134.77 135.39 53.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-N 116.125 -0.489 . . . . 74.540000000000006 111.161 179.921 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 53.1 m -104.98 114.58 28.88 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.171 -0.468 . . . . 74.010000000000005 111.078 -179.947 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . 0.55 HD21 ' CZ ' ' A' ' 83' ' ' PHE . 19.9 mt -91.46 109.8 21.09 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.234 -0.439 . . . . 75.5 110.913 179.929 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 67' ' ' HIS . . . . . 0.501 ' CE1' HD23 ' A' ' 33' ' ' LEU . 0.8 OUTLIER -90.25 109.48 20.57 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.18 -0.464 . . . . 74.219999999999999 110.855 179.844 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 68' ' ' PHE . . . . . 0.529 ' CE2' HG21 ' A' ' 117' ' ' ILE . 0.0 OUTLIER -104.33 139.54 39.17 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.219 -0.446 . . . . 74.439999999999998 110.872 -179.904 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 69' ' ' ALA . . . . . 0.466 ' CB ' HG22 ' A' ' 47' ' ' ILE . . . -121.84 129.33 52.52 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.149 -0.478 . . . . 72.450000000000003 111.085 179.942 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 70' ' ' MET . . . . . 0.474 ' HE1' ' CG1' ' A' ' 114' ' ' ILE . 1.0 OUTLIER -100.64 102.61 13.78 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.219 -0.446 . . . . 74.099999999999994 110.898 179.929 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -58.66 160.12 11.08 Favored Pre-proline 0 C--N 1.329 -0.283 0 CA-C-O 121.595 0.712 . . . . 74.340000000000003 111.137 -179.908 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.75 -2.2 9.76 Favored 'Trans proline' 0 C--N 1.341 0.162 0 C-N-CA 122.706 2.271 . . . . 73.430000000000007 112.333 179.992 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 73' ' ' MET . . . . . 0.486 ' HG2' ' CG2' ' A' ' 77' ' ' THR . 2.0 ttm -117.58 -18.28 9.77 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.232 -0.44 . . . . 71.540000000000006 110.889 179.886 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 74' ' ' TYR . . . . . 0.685 ' CD1' ' C ' ' A' ' 74' ' ' TYR . 0.0 OUTLIER -58.58 162.28 6.73 Favored Pre-proline 0 C--N 1.328 -0.354 0 CA-C-O 121.729 0.776 . . . . 71.129999999999995 110.875 -179.832 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 75' ' ' PRO . . . . . 0.592 ' HA ' ' CD2' ' A' ' 74' ' ' TYR . 53.3 Cg_endo -69.75 -4.83 8.52 Favored 'Cis proline' 0 C--N 1.341 0.156 0 C-N-CA 122.678 -1.801 . . . . 72.420000000000002 112.343 -0.087 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 76' ' ' TYR . . . . . 0.435 ' N ' ' HA ' ' A' ' 74' ' ' TYR . 0.3 OUTLIER -35.95 -60.49 0.54 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.199 -0.455 . . . . 74.430000000000007 110.877 -179.912 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 77' ' ' THR . . . . . 0.486 ' CG2' ' HG2' ' A' ' 73' ' ' MET . 33.6 p -88.08 -170.57 3.03 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.141 -0.481 . . . . 75.430000000000007 111.123 -179.973 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -105.01 123.1 40.93 Favored Pre-proline 0 C--N 1.33 -0.282 0 CA-C-O 121.593 0.711 . . . . 54.530000000000001 111.069 179.878 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 79' ' ' PRO . . . . . 0.456 ' HG3' ' CD1' ' A' ' 113' ' ' ILE . 53.8 Cg_endo -69.79 -165.46 0.16 Allowed 'Trans proline' 0 C--N 1.341 0.176 0 C-N-CA 122.696 2.264 . . . . 74.230000000000004 112.339 179.952 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . 0.449 ' HG3' ' N ' ' A' ' 81' ' ' ILE . 1.5 tt0 -128.0 141.7 51.44 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.19 -0.459 . . . . 73.150000000000006 110.846 -179.968 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 81' ' ' ILE . . . . . 0.449 ' N ' ' HG3' ' A' ' 80' ' ' GLU . 9.1 mm -138.41 138.09 43.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.113 -0.494 . . . . 74.310000000000002 111.109 179.969 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . 0.482 ' HG3' ' CD ' ' A' ' 84' ' ' LYS . 4.4 pt-20 -147.7 144.69 28.5 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.144 -0.48 . . . . 71.219999999999999 110.885 179.958 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 83' ' ' PHE . . . . . 0.55 ' CZ ' HD21 ' A' ' 66' ' ' LEU . 1.8 m-85 -95.16 139.82 30.95 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.156 -0.474 . . . . 72.409999999999997 110.922 -179.943 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 84' ' ' LYS . . . . . 0.482 ' CD ' ' HG3' ' A' ' 82' ' ' GLU . 10.6 mmmt -124.64 175.26 7.31 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.164 -0.471 . . . . 72.329999999999998 110.888 -179.998 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 85' ' ' ASN . . . . . 0.428 ' C ' HG23 ' A' ' 86' ' ' VAL . 3.9 m-80 61.63 -75.01 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.223 -0.444 . . . . 65.319999999999993 110.914 179.956 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 86' ' ' VAL . . . . . 0.472 ' N ' ' O ' ' A' ' 84' ' ' LYS . 4.2 m 37.4 87.04 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.178 -0.465 . . . . 73.409999999999997 111.141 179.878 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -98.74 -69.15 0.77 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.207 -0.452 . . . . 74.340000000000003 110.889 -179.98 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 88' ' ' ASN . . . . . 0.427 ' CG ' ' HB ' ' A' ' 60' ' ' VAL . 62.3 m-80 -83.28 42.24 0.81 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.248 -0.433 . . . . 62.240000000000002 110.889 -179.978 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 89' ' ' VAL . . . . . 0.455 ' CG1' ' HG ' ' A' ' 94' ' ' LEU . 38.7 t -134.48 146.75 30.51 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.191 -0.459 . . . . 75.349999999999994 111.143 179.923 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 90' ' ' MET . . . . . . . . . . . . . 16.5 mtm -96.51 -70.99 0.69 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.144 -0.48 . . . . 74.409999999999997 110.876 179.918 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER 171.29 -31.62 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.192 -0.458 . . . . 73.0 110.92 179.993 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -55.96 -46.66 78.53 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.157 -0.474 . . . . 74.049999999999997 110.879 -179.776 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 93' ' ' GLN . . . . . 0.601 ' OE1' ' CE2' ' A' ' 128' ' ' PHE . 3.4 pt20 -70.56 -40.75 73.16 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.155 -0.475 . . . . 74.540000000000006 110.935 179.991 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . 0.541 HD21 ' CD2' ' A' ' 83' ' ' PHE . 54.8 mt -57.81 -48.98 78.15 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.159 -0.473 . . . . 72.209999999999994 110.914 -179.963 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -65.86 -33.83 76.74 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.151 -0.477 . . . . 70.049999999999997 110.879 179.949 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 96' ' ' MET . . . . . 0.475 ' HG2' ' N ' ' A' ' 97' ' ' LEU . 0.0 OUTLIER -59.73 -36.49 76.68 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.213 -0.448 . . . . 75.230000000000004 110.867 179.98 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 97' ' ' LEU . . . . . 0.483 ' O ' ' CD1' ' A' ' 101' ' ' PHE . 17.0 mt -69.01 -41.68 77.42 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.194 -0.457 . . . . 73.140000000000001 110.925 -179.962 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -55.04 -36.65 65.76 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.159 -0.473 . . . . 73.439999999999998 110.895 179.864 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -67.46 -43.38 81.2 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.226 -0.443 . . . . 62.25 110.883 -179.948 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -71.92 -25.22 61.82 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.119 -0.491 . . . . 72.140000000000001 110.87 -179.953 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 101' ' ' PHE . . . . . 0.562 ' CD2' HD11 ' A' ' 117' ' ' ILE . 10.8 m-30 -59.51 -26.84 65.64 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.188 -0.46 . . . . 75.450000000000003 110.897 -179.944 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 102' ' ' LYS . . . . . 0.416 ' HE2' ' C ' ' A' ' 102' ' ' LYS . 0.2 OUTLIER -72.18 -41.72 66.69 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.141 -0.482 . . . . 74.129999999999995 110.875 179.967 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.39 -40.48 73.92 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.244 -0.434 . . . . 74.299999999999997 110.869 179.895 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 104' ' ' ILE . . . . . 0.575 HD12 ' CD2' ' A' ' 120' ' ' PHE . 4.0 mt -62.46 -47.11 94.55 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-N 116.245 -0.434 . . . . 74.120000000000005 111.093 179.881 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 105' ' ' HIS . . . . . 0.481 ' CE1' ' HG3' ' A' ' 109' ' ' ARG . 16.8 t60 -62.97 -41.0 99.4 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.184 -0.462 . . . . 75.430000000000007 110.865 179.91 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 1.1 t-20 -59.51 -38.25 80.46 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.205 -0.452 . . . . 74.109999999999999 110.927 -179.945 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 6.8 t -83.21 -27.95 29.62 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.155 -0.475 . . . . 75.430000000000007 111.096 179.995 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 1.6 m -112.89 46.7 1.18 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.278 -0.419 . . . . 73.230000000000004 110.85 -179.837 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 109' ' ' ARG . . . . . 0.481 ' HG3' ' CE1' ' A' ' 105' ' ' HIS . 2.7 ttp-105 -97.89 84.5 3.34 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.143 -0.481 . . . . 75.219999999999999 110.873 -179.976 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 110' ' ' GLY . . . . . 0.418 ' HA2' ' CG ' ' A' ' 75' ' ' PRO . . . 137.99 1.3 2.35 Favored Glycine 0 N--CA 1.452 -0.296 0 C-N-CA 120.768 -0.73 . . . . 71.530000000000001 112.488 -179.981 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 111' ' ' GLN . . . . . 0.505 ' O ' ' CG ' ' A' ' 112' ' ' GLU . 11.4 mm-40 -127.64 -75.11 0.57 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.732 0.301 . . . . 75.450000000000003 110.934 -179.923 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 112' ' ' GLU . . . . . 0.505 ' CG ' ' O ' ' A' ' 111' ' ' GLN . 31.0 mt-10 -163.6 141.74 7.68 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.223 -0.444 . . . . 74.430000000000007 110.875 -179.945 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 113' ' ' ILE . . . . . 0.456 ' CD1' ' HG3' ' A' ' 79' ' ' PRO . 21.7 pt -128.34 -10.93 3.4 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.118 -0.492 . . . . 72.430000000000007 111.16 179.963 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 114' ' ' ILE . . . . . 0.474 ' CG1' ' HE1' ' A' ' 70' ' ' MET . 25.5 mm -66.87 -44.72 88.75 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.148 -0.478 . . . . 71.430000000000007 111.149 179.846 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 115' ' ' PHE . . . . . 0.509 ' CE1' ' CD1' ' A' ' 25' ' ' ILE . 11.3 t80 -72.55 -37.04 68.37 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.141 -0.481 . . . . 74.329999999999998 110.873 179.976 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 6.7 mm-40 -67.39 -45.51 76.0 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.141 -0.481 . . . . 73.549999999999997 110.901 -179.924 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 117' ' ' ILE . . . . . 0.562 HD11 ' CD2' ' A' ' 101' ' ' PHE . 1.0 OUTLIER -66.91 -42.12 88.48 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.101 -0.499 . . . . 73.340000000000003 111.137 179.97 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 118' ' ' THR . . . . . 0.483 ' N ' ' CG2' ' A' ' 117' ' ' ILE . 79.8 p -68.21 -40.16 82.19 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.172 -0.467 . . . . 74.120000000000005 111.132 179.953 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 4.5 t -68.03 -44.03 77.39 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.226 -0.443 . . . . 71.230000000000004 110.857 -179.82 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 120' ' ' PHE . . . . . 0.575 ' CD2' HD12 ' A' ' 104' ' ' ILE . 0.3 OUTLIER -60.5 -46.23 90.9 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.111 -0.495 . . . . 71.310000000000002 110.868 -179.928 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 44.4 p -69.34 -39.09 78.37 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.183 -0.462 . . . . 73.25 111.132 -179.921 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 2.4 tt0 -67.24 -39.68 86.21 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.251 -0.431 . . . . 75.299999999999997 110.946 179.958 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 123' ' ' GLU . . . . . 0.489 ' HG3' ' N ' ' A' ' 124' ' ' LYS . 10.1 pt-20 -73.83 -40.47 63.31 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.167 -0.47 . . . . 71.420000000000002 110.889 -179.946 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 124' ' ' LYS . . . . . 0.489 ' N ' ' HG3' ' A' ' 123' ' ' GLU . 2.0 mmpt? -78.73 -19.52 52.14 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.174 -0.466 . . . . 65.030000000000001 110.894 179.949 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 125' ' ' LEU . . . . . 0.477 HD23 ' N ' ' A' ' 54' ' ' SER . 1.9 tp -69.49 -52.45 26.46 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.255 -0.429 . . . . 74.519999999999996 110.941 179.863 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 10.7 t70 -69.51 -36.86 76.84 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.199 -0.455 . . . . 74.409999999999997 110.826 179.854 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 127' ' ' GLU . . . . . 0.486 ' HG3' ' N ' ' A' ' 128' ' ' PHE . 0.4 OUTLIER -59.73 -36.22 76.14 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.221 -0.445 . . . . 71.200000000000003 110.858 -179.865 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 128' ' ' PHE . . . . . 0.601 ' CE2' ' OE1' ' A' ' 93' ' ' GLN . 0.0 OUTLIER . . . . . 0 C--N 1.328 -0.33 0 CA-C-N 116.15 -0.477 . . . . 72.019999999999996 110.894 -179.927 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 20.5 mt . . . . . 0 C--O 1.231 0.093 0 CA-C-O 120.767 0.318 . . . . 74.109999999999999 110.91 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 9.3 t0 -55.13 -34.97 64.2 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.202 -0.454 . . . . 74.299999999999997 110.862 179.856 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 94.2 mm-40 -63.59 -35.78 81.63 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.223 -0.444 . . . . 73.040000000000006 110.859 -179.891 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 21.6 m-85 -65.77 -24.97 67.05 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.236 -0.438 . . . . 74.439999999999998 110.897 -179.853 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -58.93 -41.05 86.43 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.167 -0.47 . . . . 75.010000000000005 110.893 -179.898 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 2.0 mm-40 -59.65 -45.94 90.51 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.142 -0.481 . . . . 72.400000000000006 110.904 -179.964 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 4.2 mp -68.03 -41.08 84.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.138 -0.483 . . . . 70.329999999999998 111.145 179.955 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 57.1 mt-30 -62.79 -48.06 80.77 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.192 -0.458 . . . . 72.340000000000003 110.944 179.922 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -61.84 -45.1 95.28 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.152 -0.477 . . . . 65.099999999999994 110.887 -179.981 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -57.84 -33.82 69.05 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.215 -0.448 . . . . 73.439999999999998 110.883 -179.907 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 2.9 mt-10 -64.03 -38.62 91.72 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.197 -0.456 . . . . 72.230000000000004 110.887 -179.96 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . 0.567 HD13 ' CE1' ' A' ' 48' ' ' PHE . 7.8 mp -66.06 -51.52 57.4 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.116 -0.493 . . . . 75.430000000000007 110.95 179.986 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 1.5 pt-20 -68.91 -33.77 74.3 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.145 -0.479 . . . . 70.109999999999999 110.869 179.948 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -65.98 -50.04 65.71 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.21 -0.45 . . . . 73.230000000000004 111.122 179.896 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . 0.463 ' N ' HD13 ' A' ' 22' ' ' ILE . 0.7 OUTLIER -72.19 -34.16 48.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.22 -0.446 . . . . 74.209999999999994 111.166 179.975 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -52.39 -36.19 53.46 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.164 -0.471 . . . . 73.299999999999997 110.899 179.931 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -67.27 -30.23 70.06 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.165 -0.47 . . . . 52.340000000000003 110.799 -179.777 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . 0.544 ' CD1' ' CE1' ' A' ' 115' ' ' PHE . 4.3 mt -83.31 -45.21 18.8 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.141 -0.481 . . . . 65.239999999999995 111.112 179.976 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 26' ' ' TYR . . . . . 0.466 ' CD2' HG22 ' A' ' 50' ' ' ILE . 25.7 m-85 -108.5 42.25 1.43 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.168 -0.469 . . . . 65.230000000000004 110.923 -179.96 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER -40.12 -59.07 1.32 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.128 -0.487 . . . . 75.450000000000003 110.887 179.884 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -86.14 -20.89 27.97 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.25 -0.432 . . . . 73.409999999999997 110.834 179.99 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 42.4 m-20 -96.29 34.79 1.54 Allowed 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.204 -0.453 . . . . 72.349999999999994 110.864 -179.996 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 16.1 t80 -118.67 138.48 52.59 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.215 -0.448 . . . . 74.439999999999998 110.899 -179.928 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 94.7 m -117.66 134.11 55.24 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.145 -0.48 . . . . 74.140000000000001 111.116 -179.894 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -101.23 118.51 37.13 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.249 -0.432 . . . . 74.219999999999999 110.901 179.923 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . 0.502 ' CD2' ' O ' ' A' ' 47' ' ' ILE . 0.4 OUTLIER -125.69 -5.68 6.95 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.235 -0.438 . . . . 75.219999999999999 110.916 -179.94 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--N 1.33 -0.27 0 CA-C-N 116.171 -0.468 . . . . 73.030000000000001 111.141 179.914 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 45' ' ' GLN . . . . . 0.486 ' O ' ' CB ' ' A' ' 46' ' ' ILE . 26.3 pt20 . . . . . 0 C--O 1.232 0.162 0 CA-C-O 120.719 0.295 . . . . 70.200000000000003 110.905 . . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 46' ' ' ILE . . . . . 0.486 ' CB ' ' O ' ' A' ' 45' ' ' GLN . 0.1 OUTLIER 84.72 -1.27 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 116.235 -0.439 . . . . 74.430000000000007 111.144 179.963 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . 0.502 ' O ' ' CD2' ' A' ' 33' ' ' LEU . 0.3 OUTLIER -62.61 146.83 12.27 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.167 -0.47 . . . . 73.209999999999994 111.137 179.846 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 48' ' ' PHE . . . . . 0.567 ' CE1' HD13 ' A' ' 19' ' ' LEU . 3.6 p90 -151.05 153.8 35.78 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.174 -0.466 . . . . 72.25 110.876 179.943 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 10.7 mt-10 -108.52 143.85 36.98 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.117 -0.492 . . . . 73.140000000000001 110.864 -179.88 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . 0.466 HG22 ' CD2' ' A' ' 26' ' ' TYR . 30.8 mm -125.94 131.74 71.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.176 -0.466 . . . . 73.200000000000003 111.155 179.95 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 85.2 m -85.1 125.6 32.91 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.187 -0.46 . . . . 73.030000000000001 111.137 179.975 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . 0.457 HD11 ' CD1' ' A' ' 66' ' ' LEU . 19.9 mt -122.52 164.89 17.29 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.184 -0.462 . . . . 74.319999999999993 110.889 179.988 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER 179.11 172.87 0.81 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.205 -0.452 . . . . 74.230000000000004 110.861 179.954 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -62.91 170.96 2.38 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.2 -0.454 . . . . 70.409999999999997 110.843 -179.799 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 21.8 m -84.85 -24.2 7.21 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 116.14 -0.482 . . . . 72.109999999999999 111.143 179.964 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -117.83 -172.72 2.3 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.176 -0.466 . . . . 62.409999999999997 110.868 179.92 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -115.19 -12.58 11.85 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.222 -0.444 . . . . 74.340000000000003 110.914 -179.972 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . 0.533 ' HA ' ' C ' ' A' ' 59' ' ' PRO . 6.3 pm0 -126.79 149.45 68.67 Favored Pre-proline 0 C--N 1.33 -0.257 0 CA-C-O 121.674 0.75 . . . . 61.340000000000003 110.879 179.929 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 59' ' ' PRO . . . . . 0.533 ' C ' ' HA ' ' A' ' 58' ' ' GLU . 53.3 Cg_endo -69.8 -8.83 10.78 Favored 'Cis proline' 0 C--N 1.342 0.219 0 C-N-CA 122.674 -1.802 . . . . 72.230000000000004 112.303 0.076 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 60' ' ' VAL . . . . . 0.421 HG21 ' CG ' ' A' ' 88' ' ' ASN . 22.3 m -142.51 165.26 16.8 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.197 -0.456 . . . . 74.340000000000003 111.093 179.923 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . 0.405 ' O ' ' O ' ' A' ' 62' ' ' SER . 7.5 tt0 -93.58 -25.05 17.71 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.143 -0.481 . . . . 75.010000000000005 110.848 -179.918 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 62' ' ' SER . . . . . 0.405 ' O ' ' O ' ' A' ' 61' ' ' GLU . 0.5 OUTLIER 41.63 94.15 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.185 -0.461 . . . . 75.040000000000006 110.836 -179.79 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 9.2 p -116.57 122.74 45.52 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.145 -0.48 . . . . 72.540000000000006 110.874 -179.854 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 64' ' ' ILE . . . . . . . . . . . . . 21.1 mt -137.89 138.61 43.79 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.132 -0.485 . . . . 75.209999999999994 111.097 179.992 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 20.1 m -104.49 113.87 27.72 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.2 -0.455 . . . . 72.319999999999993 111.126 179.939 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . 0.564 HD23 ' CE1' ' A' ' 83' ' ' PHE . 6.5 mt -99.17 112.19 24.39 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.174 -0.466 . . . . 73.329999999999998 110.927 179.964 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -109.6 114.32 27.84 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.217 -0.447 . . . . 75.310000000000002 110.826 179.897 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 68' ' ' PHE . . . . . 0.569 ' CD1' HG22 ' A' ' 114' ' ' ILE . 0.0 OUTLIER -103.31 140.43 37.42 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.213 -0.448 . . . . 63.020000000000003 110.865 -179.928 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -117.28 131.33 56.84 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.128 -0.487 . . . . 74.25 111.114 179.944 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 70' ' ' MET . . . . . 0.503 ' SD ' ' CZ ' ' A' ' 74' ' ' TYR . 3.1 mmt -93.49 98.82 11.44 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.224 -0.443 . . . . 73.010000000000005 110.858 179.998 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -55.49 163.49 1.84 Allowed Pre-proline 0 C--N 1.33 -0.262 0 CA-C-O 121.57 0.7 . . . . 74.450000000000003 111.125 -179.923 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.77 3.14 2.95 Favored 'Trans proline' 0 C--N 1.341 0.168 0 C-N-CA 122.668 2.245 . . . . 61.340000000000003 112.348 179.935 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 73' ' ' MET . . . . . 0.507 ' O ' ' CB ' ' A' ' 76' ' ' TYR . 0.1 OUTLIER -126.31 -22.99 3.91 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.21 -0.45 . . . . 55.399999999999999 110.868 179.927 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 74' ' ' TYR . . . . . 0.643 ' CD1' ' C ' ' A' ' 74' ' ' TYR . 0.0 OUTLIER -49.56 150.04 3.77 Favored Pre-proline 0 C--N 1.329 -0.32 0 CA-C-O 121.67 0.748 . . . . 64.25 110.959 -179.872 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 75' ' ' PRO . . . . . 0.566 ' HA ' ' CD2' ' A' ' 74' ' ' TYR . 53.8 Cg_endo -69.74 -14.06 12.42 Favored 'Cis proline' 0 C--O 1.231 0.157 0 C-N-CA 122.706 -1.789 . . . . 75.310000000000002 112.32 -0.006 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 76' ' ' TYR . . . . . 0.507 ' CB ' ' O ' ' A' ' 73' ' ' MET . 9.0 t80 -33.6 -45.75 0.18 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.239 -0.437 . . . . 75.109999999999999 110.949 -179.855 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 45.6 p -108.79 164.86 12.01 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.147 -0.479 . . . . 74.239999999999995 111.165 -179.997 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -79.84 125.96 81.07 Favored Pre-proline 0 C--N 1.329 -0.292 0 CA-C-O 121.579 0.704 . . . . 51.329999999999998 111.119 179.839 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.74 176.43 6.76 Favored 'Trans proline' 0 C--N 1.341 0.147 0 C-N-CA 122.673 2.248 . . . . 72.329999999999998 112.343 -179.961 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -119.04 135.13 54.79 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.248 -0.433 . . . . 75.120000000000005 110.877 -179.983 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 81' ' ' ILE . . . . . 0.474 ' CG1' ' HA ' ' A' ' 68' ' ' PHE . 13.7 mt -143.27 151.29 17.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.156 -0.475 . . . . 74.430000000000007 111.135 179.949 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . 0.487 ' HG3' ' CD ' ' A' ' 84' ' ' LYS . 11.2 pt-20 -148.99 147.94 29.17 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.144 -0.48 . . . . 74.439999999999998 110.868 179.996 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 83' ' ' PHE . . . . . 0.564 ' CE1' HD23 ' A' ' 66' ' ' LEU . 64.6 m-85 -90.63 140.27 29.92 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.16 -0.473 . . . . 74.120000000000005 110.897 -179.937 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 84' ' ' LYS . . . . . 0.487 ' CD ' ' HG3' ' A' ' 82' ' ' GLU . 8.0 mmmt -126.4 165.58 18.78 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.201 -0.454 . . . . 74.120000000000005 110.877 179.964 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 85' ' ' ASN . . . . . 0.479 ' C ' HG22 ' A' ' 86' ' ' VAL . 4.1 m-80 63.55 -71.82 0.06 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.235 -0.439 . . . . 73.099999999999994 110.893 179.97 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 86' ' ' VAL . . . . . 0.479 HG22 ' C ' ' A' ' 85' ' ' ASN . 28.0 m 30.81 91.21 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.156 -0.475 . . . . 73.219999999999999 111.106 179.924 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -94.28 -85.25 0.3 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.117 -0.492 . . . . 64.239999999999995 110.881 -179.988 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 88' ' ' ASN . . . . . 0.421 ' CG ' HG21 ' A' ' 60' ' ' VAL . 1.0 OUTLIER -45.52 -38.14 6.04 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.207 -0.451 . . . . 74.230000000000004 110.923 -179.933 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 3.4 t -61.91 142.92 15.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.134 -0.485 . . . . 74.230000000000004 111.103 179.905 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 90' ' ' MET . . . . . . . . . . . . . 7.2 mtm -95.15 -56.46 2.72 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.134 -0.485 . . . . 74.530000000000001 110.899 179.91 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER 170.21 -41.87 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.197 -0.456 . . . . 71.230000000000004 110.9 179.98 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -54.27 -38.66 66.09 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.188 -0.46 . . . . 55.329999999999998 110.87 -179.781 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 93' ' ' GLN . . . . . 0.646 ' CD ' ' CD1' ' A' ' 128' ' ' PHE . 0.0 OUTLIER -68.25 -43.22 78.36 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.151 -0.477 . . . . 71.010000000000005 110.906 -179.977 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . 0.449 HD21 ' CG1' ' A' ' 86' ' ' VAL . 62.8 mt -60.52 -48.34 82.21 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.228 -0.442 . . . . 74.439999999999998 110.912 -179.957 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -63.38 -34.14 77.07 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.163 -0.471 . . . . 74.319999999999993 110.934 179.934 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 96' ' ' MET . . . . . . . . . . . . . 35.3 ttp -60.65 -40.36 91.72 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.175 -0.466 . . . . 73.549999999999997 110.832 179.982 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 97' ' ' LEU . . . . . 0.509 ' O ' ' CD1' ' A' ' 101' ' ' PHE . 81.2 mt -65.91 -39.88 90.98 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.247 -0.433 . . . . 73.010000000000005 110.896 -179.997 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 11.3 mmtm -54.69 -47.19 73.98 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.213 -0.449 . . . . 73.030000000000001 110.892 179.831 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 15.7 m -60.3 -36.75 78.59 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.235 -0.438 . . . . 60.240000000000002 110.87 -179.888 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 78.2 mm-40 -71.13 -30.21 66.21 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.16 -0.473 . . . . 71.219999999999999 110.885 -179.951 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 101' ' ' PHE . . . . . 0.554 ' CD2' HD12 ' A' ' 117' ' ' ILE . 9.0 m-30 -59.33 -37.52 78.01 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.173 -0.467 . . . . 73.319999999999993 110.877 -179.98 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -64.8 -40.36 95.09 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.201 -0.454 . . . . 74.099999999999994 110.93 179.986 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 25.8 ttpp -70.16 -43.39 70.94 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.197 -0.456 . . . . 75.549999999999997 110.88 179.859 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 104' ' ' ILE . . . . . 0.408 ' O ' ' N ' ' A' ' 108' ' ' SER . 4.5 mt -62.14 -47.53 92.68 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 116.232 -0.44 . . . . 73.510000000000005 111.128 179.903 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 105' ' ' HIS . . . . . . . . . . . . . 3.2 t60 -62.98 -43.47 98.71 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.187 -0.46 . . . . 73.209999999999994 110.839 179.889 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -57.38 -40.26 77.79 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.229 -0.441 . . . . 72.340000000000003 110.92 -179.997 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 14.3 t -89.14 -21.22 23.45 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.167 -0.469 . . . . 64.5 111.146 -179.968 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 108' ' ' SER . . . . . 0.408 ' N ' ' O ' ' A' ' 104' ' ' ILE . 60.0 m -109.54 31.16 6.0 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.229 -0.441 . . . . 71.540000000000006 110.838 -179.846 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 6.6 ttp180 -79.5 88.1 5.08 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.14 -0.482 . . . . 75.109999999999999 110.855 -179.92 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 113.31 44.82 0.77 Allowed Glycine 0 N--CA 1.451 -0.339 0 C-N-CA 120.747 -0.74 . . . . 50.030000000000001 112.473 -179.981 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 111' ' ' GLN . . . . . . . . . . . . . 21.5 pt20 -174.77 28.31 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.775 0.321 . . . . 74.420000000000002 110.924 -179.886 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER 70.97 140.45 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.198 -0.455 . . . . 75.030000000000001 110.935 -179.901 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 113' ' ' ILE . . . . . . . . . . . . . 34.1 pt -134.78 0.1 1.15 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.167 -0.469 . . . . 73.140000000000001 111.158 179.987 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 114' ' ' ILE . . . . . 0.569 HG22 ' CD1' ' A' ' 68' ' ' PHE . 18.8 mm -63.29 -45.88 97.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.148 -0.478 . . . . 74.219999999999999 111.158 179.872 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 115' ' ' PHE . . . . . 0.544 ' CE1' ' CD1' ' A' ' 25' ' ' ILE . 22.2 t80 -72.66 -32.03 65.53 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.114 -0.494 . . . . 75.430000000000007 110.835 179.964 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 20.5 mm-40 -67.91 -45.97 72.9 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.187 -0.46 . . . . 74.030000000000001 110.915 -179.967 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 117' ' ' ILE . . . . . 0.554 HD12 ' CD2' ' A' ' 101' ' ' PHE . 0.9 OUTLIER -66.39 -43.7 91.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.194 -0.457 . . . . 71.209999999999994 111.105 179.989 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 118' ' ' THR . . . . . 0.519 ' N ' ' CG2' ' A' ' 117' ' ' ILE . 43.9 p -67.95 -41.78 81.95 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.145 -0.48 . . . . 75.239999999999995 111.122 179.979 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 43.2 t -68.06 -43.18 79.24 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.242 -0.435 . . . . 73.049999999999997 110.833 -179.839 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 3.7 t80 -67.83 -48.63 65.66 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.179 -0.464 . . . . 64.010000000000005 110.894 -179.965 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 29.0 p -61.88 -39.56 92.38 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.18 -0.464 . . . . 71.219999999999999 111.128 -179.919 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 7.7 tm0? -66.68 -50.81 61.67 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.216 -0.447 . . . . 74.109999999999999 110.883 -179.968 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 123' ' ' GLU . . . . . 0.404 ' O ' ' CG ' ' A' ' 127' ' ' GLU . 5.5 pt-20 -63.01 -38.17 90.12 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.221 -0.445 . . . . 72.230000000000004 110.88 -179.96 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 124' ' ' LYS . . . . . 0.431 ' CE ' ' HA ' ' A' ' 124' ' ' LYS . 0.0 OUTLIER -75.82 -35.08 60.13 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.182 -0.463 . . . . 64.439999999999998 110.895 179.996 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 125' ' ' LEU . . . . . 0.504 ' C ' ' CD2' ' A' ' 125' ' ' LEU . 4.2 tt -70.57 -50.85 33.02 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.201 -0.454 . . . . 74.530000000000001 110.927 179.88 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 126' ' ' ASP . . . . . 0.411 ' CG ' ' N ' ' A' ' 127' ' ' GLU . 0.0 OUTLIER -57.56 -46.58 83.78 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.147 -0.478 . . . . 75.109999999999999 110.827 179.888 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 127' ' ' GLU . . . . . 0.454 ' OE1' ' C ' ' A' ' 127' ' ' GLU . 0.9 OUTLIER -65.08 -28.15 69.26 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.221 -0.445 . . . . 74.409999999999997 110.872 -179.896 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 128' ' ' PHE . . . . . 0.646 ' CD1' ' CD ' ' A' ' 93' ' ' GLN . 0.2 OUTLIER . . . . . 0 C--N 1.329 -0.304 0 CA-C-N 116.155 -0.475 . . . . 75.409999999999997 110.878 -179.908 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 29.0 mt . . . . . 0 C--O 1.231 0.096 0 CA-C-O 120.8 0.333 . . . . 74.439999999999998 110.925 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -55.2 -30.18 59.42 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.201 -0.454 . . . . 73.099999999999994 110.835 179.867 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 77.5 mm-40 -67.2 -35.75 80.28 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.232 -0.44 . . . . 74.519999999999996 110.916 -179.852 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 11' ' ' TYR . . . . . 0.473 ' CD1' ' HD2' ' A' ' 75' ' ' PRO . 26.9 m-85 -66.6 -28.1 68.24 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.158 -0.474 . . . . 72.340000000000003 110.875 -179.876 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -59.3 -39.24 82.39 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.131 -0.486 . . . . 73.299999999999997 110.923 -179.865 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -59.04 -44.25 91.76 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.163 -0.471 . . . . 63.140000000000001 110.894 179.976 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 14' ' ' ILE . . . . . 0.419 ' O ' ' CD ' ' A' ' 18' ' ' GLU . 3.8 mp -66.94 -48.01 80.77 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.156 -0.475 . . . . 73.430000000000007 111.108 179.976 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 57.6 mt-30 -57.85 -46.55 84.63 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.231 -0.44 . . . . 73.109999999999999 110.927 179.934 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 6.7 t -58.6 -44.93 90.03 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.226 -0.443 . . . . 74.540000000000006 110.91 -179.964 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 1.1 t30 -59.03 -33.88 71.27 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.152 -0.476 . . . . 74.409999999999997 110.918 -179.912 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . 0.419 ' CD ' ' O ' ' A' ' 14' ' ' ILE . 2.2 mp0 -64.35 -39.09 93.2 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.174 -0.466 . . . . 73.400000000000006 110.91 179.961 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . 0.538 HD23 ' CE1' ' A' ' 48' ' ' PHE . 5.7 mt -63.56 -51.27 66.12 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.165 -0.471 . . . . 71.329999999999998 110.92 -179.971 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 6.6 pt-20 -68.59 -35.02 76.78 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.163 -0.471 . . . . 73.5 110.894 179.914 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -62.7 -50.67 70.2 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.161 -0.472 . . . . 73.349999999999994 111.072 179.962 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . 0.473 HD11 ' N ' ' A' ' 22' ' ' ILE . 0.6 OUTLIER -74.72 -34.98 35.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.234 -0.439 . . . . 74.239999999999995 111.163 179.96 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 16.4 mtt180 -52.6 -35.78 54.95 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.151 -0.477 . . . . 74.420000000000002 110.846 179.95 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -67.51 -31.2 71.16 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.212 -0.449 . . . . 60.240000000000002 110.88 -179.798 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 4.8 mt -80.32 -45.22 22.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.114 -0.494 . . . . 71.549999999999997 111.102 -179.997 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 17.5 m-85 -109.84 44.02 1.26 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.17 -0.468 . . . . 74.230000000000004 110.925 -179.975 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 1.3 mtm -43.49 -40.81 4.04 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.124 -0.489 . . . . 73.409999999999997 110.843 179.929 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -104.72 -20.12 13.72 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.275 -0.42 . . . . 61.43 110.863 179.963 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 3.6 m-20 -95.17 22.9 6.21 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.238 -0.437 . . . . 75.129999999999995 110.852 179.996 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 30' ' ' PHE . . . . . 0.577 ' C ' ' CD1' ' A' ' 30' ' ' PHE . 0.1 OUTLIER -114.52 143.78 44.42 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.231 -0.441 . . . . 74.239999999999995 110.866 -179.912 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 23.7 m -123.99 130.94 53.4 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.11 -0.495 . . . . 73.5 111.147 -179.936 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 1.2 t70 -94.05 114.3 26.43 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.202 -0.454 . . . . 74.530000000000001 110.849 179.926 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . 0.487 ' CD2' ' N ' ' A' ' 34' ' ' THR . 0.2 OUTLIER -117.89 -17.36 9.79 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.229 -0.441 . . . . 75.209999999999994 110.934 -179.967 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 34' ' ' THR . . . . . 0.487 ' N ' ' CD2' ' A' ' 33' ' ' LEU . 4.7 m . . . . . 0 C--N 1.329 -0.293 0 CA-C-N 116.181 -0.463 . . . . 65.239999999999995 111.123 179.952 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 45' ' ' GLN . . . . . 0.428 ' O ' ' CB ' ' A' ' 46' ' ' ILE . 27.4 tt0 . . . . . 0 C--O 1.232 0.154 0 CA-C-O 120.764 0.316 . . . . 72.420000000000002 110.917 . . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 46' ' ' ILE . . . . . 0.464 HG21 ' N ' ' A' ' 47' ' ' ILE . 0.0 OUTLIER 79.72 -42.35 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.24 -0.436 . . . . 65.219999999999999 111.13 179.991 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . 0.488 ' N ' HD12 ' A' ' 47' ' ' ILE . 0.2 OUTLIER -34.03 143.27 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.206 -0.452 . . . . 75.340000000000003 111.156 179.87 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 48' ' ' PHE . . . . . 0.538 ' CE1' HD23 ' A' ' 19' ' ' LEU . 1.1 p90 -150.05 164.7 34.85 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.16 -0.473 . . . . 75.5 110.833 -179.989 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . 0.441 ' HG3' ' CD1' ' A' ' 33' ' ' LEU . 34.3 mt-10 -108.84 147.56 31.92 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.123 -0.489 . . . . 75.120000000000005 110.879 -179.945 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 14.4 mm -128.31 135.89 61.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.185 -0.461 . . . . 74.019999999999996 111.157 179.951 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 25.9 m -93.73 125.19 38.22 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.168 -0.469 . . . . 72.140000000000001 111.14 179.974 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . 0.424 HD11 ' CD1' ' A' ' 66' ' ' LEU . 13.9 mt -119.72 165.02 15.06 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.206 -0.452 . . . . 72.409999999999997 110.869 179.979 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -166.41 154.35 10.16 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.178 -0.464 . . . . 71.530000000000001 110.894 179.985 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 1.9 m -56.8 -172.95 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.162 -0.472 . . . . 73.439999999999998 110.868 -179.797 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 34.5 m -87.75 -33.04 6.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.145 -0.48 . . . . 75.140000000000001 111.096 179.978 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 5.1 t0 -119.42 -166.55 1.28 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.23 -0.441 . . . . 74.420000000000002 110.875 179.922 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . 0.446 ' O ' ' C ' ' A' ' 60' ' ' VAL . 1.6 mmmp? -119.31 -25.9 5.99 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.215 -0.448 . . . . 73.219999999999999 110.866 -179.995 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . 0.545 ' HA ' ' C ' ' A' ' 59' ' ' PRO . 7.0 pt-20 -112.14 144.46 30.82 Favored Pre-proline 0 C--N 1.329 -0.286 0 CA-C-O 121.613 0.721 . . . . 73.310000000000002 110.877 179.982 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 59' ' ' PRO . . . . . 0.545 ' C ' ' HA ' ' A' ' 58' ' ' GLU . 53.4 Cg_endo -69.81 -14.44 12.57 Favored 'Cis proline' 0 C--O 1.231 0.171 0 C-N-CA 122.684 -1.798 . . . . 72.099999999999994 112.348 0.051 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 60' ' ' VAL . . . . . 0.446 ' C ' ' O ' ' A' ' 57' ' ' LYS . 15.5 m -140.95 -177.88 1.37 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.211 -0.45 . . . . 74.450000000000003 111.128 179.938 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . 0.441 ' O ' ' C ' ' A' ' 62' ' ' SER . 2.3 pt-20 -119.6 -12.91 9.22 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.177 -0.465 . . . . 65.129999999999995 110.891 -179.98 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 62' ' ' SER . . . . . 0.46 ' CB ' HD12 ' A' ' 125' ' ' LEU . 3.6 m 34.26 90.02 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.162 -0.472 . . . . 74.450000000000003 110.869 -179.769 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 9.7 p -110.19 122.97 48.89 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.152 -0.476 . . . . 63.329999999999998 110.891 -179.865 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 64' ' ' ILE . . . . . 0.436 HG23 ' CG1' ' A' ' 86' ' ' VAL . 19.8 mt -135.69 142.0 40.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.127 -0.488 . . . . 54.240000000000002 111.124 179.944 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 99.6 m -109.71 116.2 31.26 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.194 -0.457 . . . . 74.329999999999998 111.115 179.94 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . 0.424 ' CD1' HD11 ' A' ' 52' ' ' LEU . 53.0 mt -95.16 116.52 28.84 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.2 -0.454 . . . . 72.510000000000005 110.942 179.904 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 13.4 t60 -105.64 113.83 27.63 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.152 -0.477 . . . . 74.540000000000006 110.87 179.861 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 68' ' ' PHE . . . . . 0.559 ' CE1' HG23 ' A' ' 114' ' ' ILE . 0.0 OUTLIER -103.83 139.92 38.37 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.229 -0.441 . . . . 73.209999999999994 110.899 -179.927 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -115.47 107.25 14.94 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.188 -0.46 . . . . 74.349999999999994 111.122 179.921 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 70' ' ' MET . . . . . 0.429 ' HE1' ' CG1' ' A' ' 114' ' ' ILE . 0.3 OUTLIER -74.7 81.98 2.07 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.248 -0.433 . . . . 73.329999999999998 110.911 179.949 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -40.61 158.75 0.16 Allowed Pre-proline 0 C--N 1.33 -0.273 0 CA-C-O 121.579 0.704 . . . . 64.099999999999994 111.143 -179.928 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.74 -1.12 7.92 Favored 'Trans proline' 0 C--N 1.341 0.179 0 C-N-CA 122.701 2.267 . . . . 62.439999999999998 112.39 179.886 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 73' ' ' MET . . . . . 0.49 ' O ' ' CB ' ' A' ' 76' ' ' TYR . 0.1 OUTLIER -112.75 -26.02 8.79 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.198 -0.455 . . . . 73.420000000000002 110.88 179.899 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 74' ' ' TYR . . . . . 0.635 ' CD1' ' C ' ' A' ' 74' ' ' TYR . 0.0 OUTLIER -48.87 149.93 2.92 Favored Pre-proline 0 C--N 1.328 -0.327 0 CA-C-O 121.681 0.753 . . . . 73.099999999999994 110.939 -179.893 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 75' ' ' PRO . . . . . 0.559 ' HA ' ' CD2' ' A' ' 74' ' ' TYR . 53.9 Cg_endo -69.72 -12.88 12.24 Favored 'Cis proline' 0 C--O 1.232 0.187 0 C-N-CA 122.761 -1.766 . . . . 73.400000000000006 112.329 -0.056 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 76' ' ' TYR . . . . . 0.49 ' CB ' ' O ' ' A' ' 73' ' ' MET . 6.5 t80 -35.74 -51.29 0.67 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.251 -0.431 . . . . 74.129999999999995 110.93 -179.9 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 48.2 p -107.1 167.51 9.85 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.12 -0.491 . . . . 74.420000000000002 111.122 -179.992 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -88.93 129.39 48.53 Favored Pre-proline 0 C--N 1.329 -0.314 0 CA-C-O 121.59 0.709 . . . . 72.530000000000001 111.122 179.858 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_endo -69.77 -172.47 0.58 Allowed 'Trans proline' 0 C--N 1.341 0.171 0 C-N-CA 122.667 2.244 . . . . 72.340000000000003 112.321 -179.948 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -120.57 132.98 55.42 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.212 -0.449 . . . . 63.240000000000002 110.871 -179.957 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 9.8 mm -122.96 142.31 40.04 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-N 116.161 -0.472 . . . . 71.430000000000007 111.159 179.97 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . 0.503 ' HG3' ' CD ' ' A' ' 84' ' ' LYS . 4.6 pt-20 -145.09 144.93 31.21 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.217 -0.447 . . . . 51.32 110.893 179.972 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 83' ' ' PHE . . . . . 0.504 ' CE2' ' HD3' ' A' ' 98' ' ' LYS . 33.7 m-85 -99.04 135.28 40.68 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.157 -0.474 . . . . 71.409999999999997 110.888 -179.94 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 84' ' ' LYS . . . . . 0.503 ' CD ' ' HG3' ' A' ' 82' ' ' GLU . 9.2 mmmt -125.4 171.84 10.13 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.165 -0.471 . . . . 75.310000000000002 110.847 -179.989 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 85' ' ' ASN . . . . . 0.486 ' O ' ' C ' ' A' ' 86' ' ' VAL . 2.8 m-80 62.41 -73.87 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.216 -0.447 . . . . 71.340000000000003 110.878 179.954 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 86' ' ' VAL . . . . . 0.486 ' C ' ' O ' ' A' ' 85' ' ' ASN . 33.6 m 29.74 91.51 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.18 -0.464 . . . . 75.439999999999998 111.11 179.911 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -93.64 -63.57 1.19 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.138 -0.483 . . . . 74.049999999999997 110.909 -179.958 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 88' ' ' ASN . . . . . 0.426 ' ND2' HG21 ' A' ' 60' ' ' VAL . 17.1 t30 -81.82 39.22 0.54 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.202 -0.454 . . . . 75.109999999999999 110.925 -179.987 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 89' ' ' VAL . . . . . 0.421 HG12 ' CD1' ' A' ' 94' ' ' LEU . 15.6 t -141.2 149.49 20.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.171 -0.468 . . . . 73.409999999999997 111.135 179.905 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 90' ' ' MET . . . . . . . . . . . . . 6.2 mtm -107.72 -61.49 1.56 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.152 -0.476 . . . . 74.329999999999998 110.865 179.927 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 91' ' ' ASP . . . . . 0.417 ' OD1' ' N ' ' A' ' 92' ' ' SER . 0.0 OUTLIER -177.64 -30.84 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.233 -0.439 . . . . 75.340000000000003 110.908 179.988 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 92' ' ' SER . . . . . 0.417 ' N ' ' OD1' ' A' ' 91' ' ' ASP . 47.4 t -55.46 -45.7 76.89 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.175 -0.466 . . . . 73.209999999999994 110.89 -179.807 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 93' ' ' GLN . . . . . 0.502 ' HG3' ' CE2' ' A' ' 128' ' ' PHE . 3.9 mp0 -68.58 -41.71 79.28 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.125 -0.489 . . . . 74.049999999999997 110.903 -179.985 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . 0.421 ' CD1' HG12 ' A' ' 89' ' ' VAL . 7.5 mp -58.61 -48.98 79.16 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.211 -0.45 . . . . 73.010000000000005 110.916 -179.986 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 45.7 mt-30 -66.16 -34.45 78.06 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.226 -0.443 . . . . 72.219999999999999 110.93 179.928 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 96' ' ' MET . . . . . 0.424 ' SD ' ' CE1' ' A' ' 128' ' ' PHE . 5.7 ttp -59.74 -39.7 85.62 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.159 -0.473 . . . . 74.439999999999998 110.864 179.972 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 97' ' ' LEU . . . . . 0.582 ' O ' ' CD1' ' A' ' 101' ' ' PHE . 13.4 mt -67.24 -42.18 84.39 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.288 -0.415 . . . . 70.420000000000002 110.892 -179.972 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 98' ' ' LYS . . . . . 0.504 ' HD3' ' CE2' ' A' ' 83' ' ' PHE . 3.2 mmmp? -55.23 -42.35 73.28 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.22 -0.445 . . . . 73.400000000000006 110.893 179.876 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -59.81 -44.57 93.94 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.206 -0.452 . . . . 72.420000000000002 110.883 -179.887 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 19.3 mt-10 -69.88 -27.44 64.82 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.111 -0.495 . . . . 75.349999999999994 110.872 -179.97 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 101' ' ' PHE . . . . . 0.582 ' CD1' ' O ' ' A' ' 97' ' ' LEU . 11.8 m-30 -59.37 -28.83 67.22 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.198 -0.455 . . . . 74.109999999999999 110.869 -179.945 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 6.5 ttmt -71.79 -43.38 65.77 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.136 -0.484 . . . . 72.510000000000005 110.903 179.983 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 16.8 ttpp -69.07 -42.97 75.5 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.235 -0.439 . . . . 75.340000000000003 110.882 179.857 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 3.5 mt -62.59 -47.46 92.82 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.248 -0.433 . . . . 75.040000000000006 111.148 179.854 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 105' ' ' HIS . . . . . . . . . . . . . 35.6 t-80 -62.84 -41.94 99.54 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.185 -0.461 . . . . 64.230000000000004 110.872 179.884 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -57.33 -41.25 79.65 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.172 -0.467 . . . . 75.519999999999996 110.866 -179.952 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 9.4 t -83.57 -15.61 48.55 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.226 -0.443 . . . . 73.510000000000005 111.137 -179.954 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 1.8 m -124.54 43.55 2.99 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.203 -0.453 . . . . 73.25 110.857 -179.899 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 4.9 ttt180 -90.38 83.23 5.9 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.123 -0.49 . . . . 73.099999999999994 110.845 -179.955 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 110' ' ' GLY . . . . . 0.473 ' HA2' ' CB ' ' A' ' 75' ' ' PRO . . . 136.63 -4.43 3.65 Favored Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.712 -0.756 . . . . 53.210000000000001 112.486 -179.971 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 111' ' ' GLN . . . . . . . . . . . . . 13.2 mm-40 -116.46 -94.76 0.48 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.784 0.326 . . . . 64.310000000000002 110.892 -179.909 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 39.9 mt-10 -149.05 131.4 15.62 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.236 -0.438 . . . . 71.349999999999994 110.915 -179.935 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 113' ' ' ILE . . . . . . . . . . . . . 16.3 pt -121.29 -9.52 9.71 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.157 -0.474 . . . . 73.420000000000002 111.166 179.932 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 114' ' ' ILE . . . . . 0.559 HG23 ' CE1' ' A' ' 68' ' ' PHE . 30.2 mm -65.53 -45.85 91.42 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.187 -0.461 . . . . 74.230000000000004 111.18 179.819 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 115' ' ' PHE . . . . . . . . . . . . . 31.8 t80 -73.03 -34.49 66.38 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.173 -0.467 . . . . 71.129999999999995 110.901 179.917 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 9.0 mm-40 -68.06 -47.88 67.11 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.131 -0.486 . . . . 73.230000000000004 110.92 -179.934 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 117' ' ' ILE . . . . . 0.545 HG13 ' CE1' ' A' ' 101' ' ' PHE . 0.9 OUTLIER -63.53 -39.98 87.35 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.13 -0.487 . . . . 73.310000000000002 111.133 179.938 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 118' ' ' THR . . . . . 0.499 ' CG2' ' O ' ' A' ' 114' ' ' ILE . 46.9 p -68.0 -43.54 78.65 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.18 -0.464 . . . . 74.230000000000004 111.13 179.972 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -68.01 -44.15 77.21 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.206 -0.452 . . . . 75.239999999999995 110.876 -179.877 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 1.2 t80 -60.79 -49.45 77.43 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.147 -0.479 . . . . 74.219999999999999 110.881 -179.948 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 121' ' ' THR . . . . . 0.443 ' O ' ' CB ' ' A' ' 125' ' ' LEU . 75.5 p -60.04 -40.37 89.14 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.143 -0.481 . . . . 73.230000000000004 111.171 -179.891 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -68.07 -51.34 47.65 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.208 -0.451 . . . . 74.109999999999999 110.894 179.972 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 123' ' ' GLU . . . . . 0.47 ' CG ' ' N ' ' A' ' 124' ' ' LYS . 4.5 pt-20 -58.91 -46.21 88.43 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.267 -0.424 . . . . 72.109999999999999 110.876 -179.908 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 124' ' ' LYS . . . . . 0.47 ' N ' ' CG ' ' A' ' 123' ' ' GLU . 0.0 OUTLIER -73.77 -26.91 60.89 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.17 -0.468 . . . . 73.049999999999997 110.896 179.966 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 125' ' ' LEU . . . . . 0.46 HD12 ' CB ' ' A' ' 62' ' ' SER . 2.5 tp -67.9 -50.21 57.5 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.234 -0.439 . . . . 74.319999999999993 110.944 179.913 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -61.41 -38.44 87.09 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.175 -0.466 . . . . 60.310000000000002 110.872 179.803 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 127' ' ' GLU . . . . . 0.441 ' HG3' ' N ' ' A' ' 128' ' ' PHE . 0.0 OUTLIER -62.27 -28.97 70.09 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.218 -0.446 . . . . 74.129999999999995 110.868 -179.879 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 128' ' ' PHE . . . . . 0.502 ' CE2' ' HG3' ' A' ' 93' ' ' GLN . 0.6 OUTLIER . . . . . 0 C--N 1.329 -0.304 0 CA-C-N 116.148 -0.478 . . . . 62.420000000000002 110.882 -179.912 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 50.9 mt . . . . . 0 C--O 1.231 0.117 0 CA-C-O 120.825 0.345 . . . . 72.150000000000006 110.916 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 37.2 t70 -50.61 -31.13 15.11 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.187 -0.46 . . . . 74.540000000000006 110.894 179.819 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 82.6 mm-40 -67.51 -39.65 85.11 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.185 -0.461 . . . . 74.510000000000005 110.931 -179.938 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 19.2 m-85 -59.41 -25.4 64.29 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.176 -0.466 . . . . 74.319999999999993 110.945 -179.925 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 1.6 t80 -59.33 -38.98 81.7 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.155 -0.475 . . . . 70.299999999999997 110.901 -179.905 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -61.43 -42.52 98.88 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.166 -0.47 . . . . 61.229999999999997 110.879 -179.964 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 3.1 mp -67.54 -41.9 86.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.171 -0.468 . . . . 73.109999999999999 111.169 179.957 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . 0.42 ' NE2' ' O ' ' A' ' 71' ' ' THR . 73.0 mt-30 -60.88 -44.7 96.71 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.12 -0.491 . . . . 75.25 110.901 179.917 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 6.9 t -64.02 -39.6 94.47 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.217 -0.447 . . . . 64.219999999999999 110.911 -179.919 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 8.0 m-20 -58.02 -33.92 69.48 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.158 -0.474 . . . . 72.040000000000006 110.889 -179.9 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . 0.4 ' CD ' ' OH ' ' A' ' 74' ' ' TYR . 1.6 mm-40 -65.38 -37.67 87.71 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.173 -0.467 . . . . 73.439999999999998 110.886 -179.986 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . 0.485 HD12 ' CE1' ' A' ' 48' ' ' PHE . 5.9 mp -66.14 -51.4 58.23 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.134 -0.485 . . . . 73.340000000000003 110.952 179.99 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -68.68 -34.18 75.24 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.196 -0.457 . . . . 74.019999999999996 110.881 179.915 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -64.54 -50.85 65.68 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.145 -0.479 . . . . 73.140000000000001 111.113 179.906 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 0.6 OUTLIER -75.1 -34.46 31.82 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 116.252 -0.431 . . . . 75.340000000000003 111.161 179.943 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . 0.519 ' O ' ' CA ' ' A' ' 27' ' ' MET . 0.0 OUTLIER -52.43 -35.53 52.33 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.177 -0.465 . . . . 74.409999999999997 110.896 179.972 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -68.43 -28.53 67.15 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.132 -0.486 . . . . 74.209999999999994 110.908 -179.833 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 4.7 mt -84.13 -45.15 18.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.134 -0.485 . . . . 72.519999999999996 111.137 179.939 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 26' ' ' TYR . . . . . 0.508 ' O ' ' N ' ' A' ' 29' ' ' ASP . 32.3 m-85 -106.32 21.01 18.1 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.146 -0.479 . . . . 73.310000000000002 110.915 -179.991 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 27' ' ' MET . . . . . 0.519 ' CA ' ' O ' ' A' ' 23' ' ' ARG . 0.0 OUTLIER -33.87 -45.56 0.19 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.112 -0.494 . . . . 75.230000000000004 110.873 179.951 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 31.1 t70 -86.19 -31.19 21.9 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.209 -0.45 . . . . 74.349999999999994 110.871 179.965 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . 0.508 ' N ' ' O ' ' A' ' 26' ' ' TYR . 1.3 m-20 -103.21 37.77 1.91 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.151 -0.477 . . . . 73.5 110.907 179.972 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 30' ' ' PHE . . . . . 0.411 ' N ' ' O ' ' A' ' 26' ' ' TYR . 0.6 OUTLIER -109.91 135.13 51.26 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.183 -0.462 . . . . 65.400000000000006 110.876 -179.881 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 45.4 m -115.24 130.9 57.04 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.132 -0.485 . . . . 72.5 111.182 -179.934 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -104.9 115.3 30.06 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.283 -0.417 . . . . 70.230000000000004 110.904 179.925 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . 0.57 HD21 ' CE1' ' A' ' 67' ' ' HIS . 0.5 OUTLIER -119.18 4.01 11.34 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.223 -0.444 . . . . 54.509999999999998 110.882 -179.915 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 1.3 m . . . . . 0 C--N 1.329 -0.283 0 CA-C-N 116.213 -0.449 . . . . 74.109999999999999 111.125 179.945 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 45' ' ' GLN . . . . . 0.451 ' O ' ' CG ' ' A' ' 45' ' ' GLN . 17.6 tt0 . . . . . 0 C--O 1.232 0.137 0 CA-C-O 120.765 0.317 . . . . 72.319999999999993 110.899 . . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 46' ' ' ILE . . . . . 0.441 ' CB ' ' O ' ' A' ' 45' ' ' GLN . 0.0 OUTLIER 81.67 -11.56 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.178 -0.465 . . . . 74.310000000000002 111.108 179.936 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . 0.441 HG12 ' CD1' ' A' ' 33' ' ' LEU . 0.2 OUTLIER -51.5 150.57 0.91 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 116.157 -0.474 . . . . 74.319999999999993 111.114 179.879 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 48' ' ' PHE . . . . . 0.485 ' CE1' HD12 ' A' ' 19' ' ' LEU . 6.8 p90 -161.95 161.19 28.57 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.118 -0.492 . . . . 73.030000000000001 110.875 179.968 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . 0.474 ' CG ' ' HB2' ' A' ' 67' ' ' HIS . 8.6 mt-10 -111.25 161.02 16.44 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.137 -0.483 . . . . 73.129999999999995 110.858 -179.942 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 7.8 mm -140.27 132.38 32.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.114 -0.493 . . . . 73.519999999999996 111.173 179.941 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 24.2 m -84.44 123.29 30.07 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.205 -0.452 . . . . 75.209999999999994 111.164 179.995 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 31.2 mt -121.72 164.98 16.48 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.229 -0.442 . . . . 74.209999999999994 110.928 179.979 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 7.6 ptt180 175.68 163.42 0.32 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.231 -0.44 . . . . 72.030000000000001 110.848 179.943 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 54' ' ' SER . . . . . 0.463 ' CB ' HD11 ' A' ' 125' ' ' LEU . 1.4 t -60.59 -156.47 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.184 -0.462 . . . . 73.120000000000005 110.87 -179.842 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 15.7 m -122.31 -22.84 2.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.114 -0.494 . . . . 73.299999999999997 111.144 179.896 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 56' ' ' ASP . . . . . 0.439 ' OD1' ' N ' ' A' ' 56' ' ' ASP . 0.2 OUTLIER -110.5 -175.39 2.71 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.181 -0.463 . . . . 65.329999999999998 110.889 179.906 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 3.9 mmmm -118.47 -10.87 10.04 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.173 -0.467 . . . . 72.319999999999993 110.884 179.999 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . 0.546 ' HA ' ' C ' ' A' ' 59' ' ' PRO . 44.3 mt-10 -126.34 141.89 41.24 Favored Pre-proline 0 C--N 1.329 -0.288 0 CA-C-O 121.659 0.742 . . . . 74.25 110.885 179.974 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 59' ' ' PRO . . . . . 0.546 ' C ' ' HA ' ' A' ' 58' ' ' GLU . 53.4 Cg_endo -69.79 -3.18 7.58 Favored 'Cis proline' 0 C--N 1.342 0.205 0 C-N-CA 122.653 -1.811 . . . . 75.5 112.36 0.035 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 60' ' ' VAL . . . . . 0.462 ' HB ' ' ND2' ' A' ' 88' ' ' ASN . 18.3 m -157.61 -173.29 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.232 -0.44 . . . . 74.530000000000001 111.144 179.918 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . 0.408 ' O ' ' O ' ' A' ' 62' ' ' SER . 8.3 tt0 -114.86 -22.1 9.8 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.184 -0.462 . . . . 72.129999999999995 110.873 -179.969 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 62' ' ' SER . . . . . 0.408 ' O ' ' O ' ' A' ' 61' ' ' GLU . 0.4 OUTLIER 49.4 101.63 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.137 -0.483 . . . . 61.149999999999999 110.864 -179.787 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 26.0 t -125.31 123.26 39.05 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.14 -0.482 . . . . 75.299999999999997 110.887 -179.83 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 64' ' ' ILE . . . . . . . . . . . . . 64.7 mt -145.16 142.56 22.59 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.178 -0.465 . . . . 61.109999999999999 111.163 179.938 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 23.5 m -107.52 119.07 38.4 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.198 -0.455 . . . . 51.229999999999997 111.123 -179.994 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . 0.458 HD22 ' CE1' ' A' ' 83' ' ' PHE . 54.1 mt -99.01 109.97 22.64 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.242 -0.436 . . . . 75.099999999999994 110.915 179.913 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 67' ' ' HIS . . . . . 0.57 ' CE1' HD21 ' A' ' 33' ' ' LEU . 1.9 t60 -96.47 109.76 22.26 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.152 -0.476 . . . . 74.049999999999997 110.853 179.869 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -103.92 139.91 38.42 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.245 -0.434 . . . . 73.140000000000001 110.875 -179.911 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 69' ' ' ALA . . . . . 0.451 ' O ' ' CB ' ' A' ' 79' ' ' PRO . . . -126.64 129.04 47.71 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.145 -0.479 . . . . 75.5 111.119 179.908 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -94.64 157.86 15.78 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.234 -0.439 . . . . 75.25 110.854 179.982 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 71' ' ' THR . . . . . 0.42 ' O ' ' NE2' ' A' ' 15' ' ' GLN . 0.1 OUTLIER -112.16 162.93 19.09 Favored Pre-proline 0 C--N 1.33 -0.241 0 CA-C-O 121.601 0.715 . . . . 60.219999999999999 111.096 -179.945 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.76 0.1 6.13 Favored 'Trans proline' 0 C--N 1.341 0.173 0 C-N-CA 122.71 2.273 . . . . 60.109999999999999 112.348 179.933 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 73' ' ' MET . . . . . 0.465 ' CB ' HG23 ' A' ' 77' ' ' THR . 0.0 OUTLIER -115.06 -26.71 7.6 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.241 -0.436 . . . . 63.240000000000002 110.911 179.895 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 74' ' ' TYR . . . . . 0.66 ' CD1' ' C ' ' A' ' 74' ' ' TYR . 0.0 OUTLIER -45.76 151.66 0.81 Allowed Pre-proline 0 C--N 1.329 -0.323 0 CA-C-O 121.675 0.75 . . . . 72.329999999999998 110.935 -179.873 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 75' ' ' PRO . . . . . 0.586 ' HA ' ' CD2' ' A' ' 74' ' ' TYR . 53.6 Cg_endo -69.8 2.15 5.02 Favored 'Cis proline' 0 C--O 1.232 0.205 0 C-N-CA 122.634 -1.819 . . . . 72.0 112.329 -0.036 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 76' ' ' TYR . . . . . 0.497 ' N ' ' HA ' ' A' ' 74' ' ' TYR . 19.6 t80 -75.3 44.46 0.26 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.258 -0.428 . . . . 74.519999999999996 110.967 -179.968 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 77' ' ' THR . . . . . 0.465 HG23 ' CB ' ' A' ' 73' ' ' MET . 0.6 OUTLIER -172.61 -177.57 1.75 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.086 -0.506 . . . . 75.409999999999997 111.181 -179.971 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -118.73 116.59 34.58 Favored Pre-proline 0 C--N 1.329 -0.313 0 CA-C-O 121.587 0.708 . . . . 73.099999999999994 111.075 179.863 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 79' ' ' PRO . . . . . 0.454 ' HG3' ' CD1' ' A' ' 113' ' ' ILE . 53.7 Cg_endo -69.72 -164.66 0.13 Allowed 'Trans proline' 0 C--N 1.342 0.192 0 C-N-CA 122.674 2.249 . . . . 73.150000000000006 112.356 179.978 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -135.32 136.03 41.24 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.19 -0.459 . . . . 73.329999999999998 110.907 179.985 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 10.0 mm -127.99 144.34 37.98 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.113 -0.494 . . . . 74.120000000000005 111.168 179.954 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . 0.435 ' HG3' ' CD ' ' A' ' 84' ' ' LYS . 1.2 pt-20 -148.51 145.93 28.12 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.162 -0.472 . . . . 72.230000000000004 110.888 179.973 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 83' ' ' PHE . . . . . 0.574 ' CE2' ' HD3' ' A' ' 98' ' ' LYS . 7.3 m-85 -99.33 139.95 34.22 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.171 -0.468 . . . . 74.420000000000002 110.895 -179.965 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 84' ' ' LYS . . . . . 0.478 ' O ' ' N ' ' A' ' 86' ' ' VAL . 5.3 mmmt -127.06 173.62 9.53 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.172 -0.467 . . . . 74.129999999999995 110.889 179.981 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 85' ' ' ASN . . . . . 0.544 ' N ' HD21 ' A' ' 85' ' ' ASN . 1.2 m-80 61.35 -75.51 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.191 -0.459 . . . . 73.040000000000006 110.907 179.946 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 86' ' ' VAL . . . . . 0.478 ' N ' ' O ' ' A' ' 84' ' ' LYS . 3.6 m 40.22 91.35 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.151 -0.477 . . . . 75.239999999999995 111.099 179.858 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -96.79 -65.08 0.99 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.143 -0.48 . . . . 74.299999999999997 110.934 179.974 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 88' ' ' ASN . . . . . 0.462 ' ND2' ' HB ' ' A' ' 60' ' ' VAL . 8.5 m120 -84.95 34.23 0.54 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.218 -0.447 . . . . 74.140000000000001 110.907 -179.995 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 89' ' ' VAL . . . . . 0.448 HG11 ' CD1' ' A' ' 94' ' ' LEU . 17.1 t -138.06 146.57 26.86 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.205 -0.452 . . . . 62.439999999999998 111.148 179.925 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 90' ' ' MET . . . . . . . . . . . . . 13.7 mtm -101.75 -62.97 1.19 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.186 -0.461 . . . . 71.219999999999999 110.857 179.932 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -179.53 -32.73 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.215 -0.448 . . . . 74.450000000000003 110.848 179.973 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 39.0 t -53.97 -42.3 68.8 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.206 -0.452 . . . . 74.219999999999999 110.872 -179.789 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 93' ' ' GLN . . . . . 0.554 ' HG3' ' CZ ' ' A' ' 128' ' ' PHE . 0.2 OUTLIER -70.36 -39.69 74.46 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.132 -0.485 . . . . 74.129999999999995 110.945 -179.98 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . 0.499 ' HG ' ' CG ' ' A' ' 83' ' ' PHE . 7.4 mp -59.76 -48.16 82.77 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.174 -0.466 . . . . 73.040000000000006 110.927 179.992 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 73.7 mt-30 -65.52 -33.91 77.03 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.186 -0.461 . . . . 71.340000000000003 110.944 179.91 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 96' ' ' MET . . . . . 0.414 ' HE2' ' CE2' ' A' ' 128' ' ' PHE . 46.7 ttp -59.8 -38.01 80.73 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.193 -0.458 . . . . 75.540000000000006 110.891 179.947 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 97' ' ' LEU . . . . . 0.596 ' O ' ' CD1' ' A' ' 101' ' ' PHE . 30.4 mt -72.21 -38.97 68.89 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.226 -0.443 . . . . 74.140000000000001 110.954 179.992 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 98' ' ' LYS . . . . . 0.574 ' HD3' ' CE2' ' A' ' 83' ' ' PHE . 2.3 mmmp? -57.1 -38.36 73.28 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.169 -0.469 . . . . 60.130000000000003 110.945 179.797 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 5.1 m -63.26 -40.32 97.08 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.185 -0.462 . . . . 74.540000000000006 110.872 -179.897 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 4.2 mm-40 -74.24 -26.46 60.25 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.129 -0.487 . . . . 72.200000000000003 110.894 -179.961 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 101' ' ' PHE . . . . . 0.596 ' CD1' ' O ' ' A' ' 97' ' ' LEU . 12.7 m-30 -59.44 -29.95 68.14 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.171 -0.468 . . . . 74.439999999999998 110.887 -179.94 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 1.9 tmpt? -74.82 -42.43 58.05 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.158 -0.474 . . . . 73.239999999999995 110.86 179.978 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.13 -37.82 75.4 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.242 -0.436 . . . . 73.019999999999996 110.905 179.885 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 4.2 mt -63.47 -47.52 91.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.217 -0.447 . . . . 75.140000000000001 111.088 179.888 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 105' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -61.49 -41.09 96.75 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.223 -0.444 . . . . 74.310000000000002 110.879 179.9 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -61.66 -41.05 97.01 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.157 -0.474 . . . . 74.310000000000002 110.877 -179.921 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 8.8 t -81.41 -28.27 34.38 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.15 -0.477 . . . . 55.340000000000003 111.18 -179.986 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 67.1 m -100.47 17.48 21.52 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.178 -0.464 . . . . 74.430000000000007 110.856 -179.897 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.23 90.86 0.15 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.135 -0.484 . . . . 75.239999999999995 110.875 -179.961 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 137.57 -23.39 3.11 Favored Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.737 -0.744 . . . . 75.239999999999995 112.447 -179.997 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 111' ' ' GLN . . . . . . . . . . . . . 4.7 pt20 -119.64 -156.8 0.68 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.721 0.296 . . . . 74.209999999999994 110.962 -179.903 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 46.8 mt-10 -72.62 139.54 47.45 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.208 -0.451 . . . . 74.120000000000005 110.866 -179.918 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 113' ' ' ILE . . . . . 0.454 ' CD1' ' HG3' ' A' ' 79' ' ' PRO . 4.7 pt -123.22 -24.66 2.25 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.196 -0.457 . . . . 73.340000000000003 111.139 179.96 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 36.9 mm -59.26 -45.13 93.27 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 116.189 -0.46 . . . . 71.239999999999995 111.136 179.856 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 115' ' ' PHE . . . . . . . . . . . . . 28.8 t80 -66.95 -35.29 79.65 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.116 -0.493 . . . . 75.510000000000005 110.865 179.967 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 5.2 mm-40 -66.81 -47.91 70.58 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.154 -0.475 . . . . 73.430000000000007 110.89 -179.888 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 117' ' ' ILE . . . . . 0.489 HG12 ' CE1' ' A' ' 101' ' ' PHE . 0.3 OUTLIER -64.42 -41.92 93.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.133 -0.485 . . . . 73.549999999999997 111.151 179.959 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 118' ' ' THR . . . . . 0.482 ' N ' ' CG2' ' A' ' 117' ' ' ILE . 66.1 p -67.84 -42.25 81.71 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.208 -0.451 . . . . 71.450000000000003 111.141 179.979 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 6.1 t -66.55 -44.25 82.87 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.229 -0.442 . . . . 65.439999999999998 110.869 -179.876 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 120' ' ' PHE . . . . . 0.501 ' CD2' ' NZ ' ' A' ' 124' ' ' LYS . 0.2 OUTLIER -64.95 -47.08 78.91 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.132 -0.485 . . . . 73.349999999999994 110.88 -179.948 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 76.3 p -67.68 -38.96 84.45 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.163 -0.472 . . . . 72.319999999999993 111.159 -179.933 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 9.9 tt0 -64.96 -47.99 75.66 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.238 -0.437 . . . . 73.420000000000002 110.884 179.986 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 3.0 pt-20 -63.73 -39.25 93.84 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.262 -0.426 . . . . 72.140000000000001 110.86 -179.897 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 124' ' ' LYS . . . . . 0.501 ' NZ ' ' CD2' ' A' ' 120' ' ' PHE . 0.0 OUTLIER -67.49 -40.95 85.25 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.189 -0.46 . . . . 74.099999999999994 110.896 179.948 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 125' ' ' LEU . . . . . 0.551 ' CD1' ' C ' ' A' ' 125' ' ' LEU . 0.2 OUTLIER -68.95 -36.89 78.46 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.17 -0.468 . . . . 72.219999999999999 110.94 179.944 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 7.9 t0 -64.02 -41.96 97.27 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.166 -0.47 . . . . 74.409999999999997 110.889 179.775 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 127' ' ' GLU . . . . . 0.418 ' CG ' ' O ' ' A' ' 124' ' ' LYS . 8.2 pt-20 -69.91 -37.49 75.98 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.152 -0.476 . . . . 75.519999999999996 110.87 -179.882 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 128' ' ' PHE . . . . . 0.554 ' CZ ' ' HG3' ' A' ' 93' ' ' GLN . 1.1 m-85 . . . . . 0 C--N 1.329 -0.316 0 CA-C-N 116.154 -0.476 . . . . 74.129999999999995 110.9 -179.932 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 47.9 mt . . . . . 0 C--O 1.231 0.111 0 CA-C-O 120.805 0.336 . . . . 73.319999999999993 110.929 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -51.5 -32.11 26.33 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.2 -0.455 . . . . 63.310000000000002 110.885 179.836 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 80.6 mm-40 -68.11 -37.75 81.51 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.149 -0.478 . . . . 74.430000000000007 110.903 -179.917 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 22.0 m-85 -59.74 -27.98 66.97 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.214 -0.448 . . . . 75.349999999999994 110.95 -179.857 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -59.54 -37.04 77.34 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.091 -0.504 . . . . 73.099999999999994 110.911 -179.94 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 1.4 mm-40 -64.13 -45.22 89.5 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.105 -0.498 . . . . 74.5 110.84 -179.944 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 4.2 mp -67.51 -42.64 87.2 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.178 -0.464 . . . . 74.219999999999999 111.184 179.95 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 62.4 mt-30 -65.59 -48.4 72.47 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.168 -0.469 . . . . 75.5 110.925 179.921 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 4.2 t -58.57 -37.22 75.28 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.223 -0.444 . . . . 71.450000000000003 110.903 -179.942 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -57.79 -33.83 68.97 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.143 -0.481 . . . . 73.140000000000001 110.913 -179.91 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 14.8 mt-10 -66.97 -38.15 85.55 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.141 -0.481 . . . . 72.200000000000003 110.9 -179.992 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 8.9 mp -63.42 -51.34 66.16 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.117 -0.492 . . . . 75.109999999999999 110.911 -179.96 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 3.0 pt-20 -68.48 -34.83 76.6 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.147 -0.478 . . . . 75.209999999999994 110.877 179.949 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -66.49 -50.44 63.29 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.163 -0.471 . . . . 74.150000000000006 111.107 179.923 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . 0.458 ' N ' HD13 ' A' ' 22' ' ' ILE . 0.8 OUTLIER -74.21 -34.46 37.71 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.261 -0.427 . . . . 74.299999999999997 111.165 179.968 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 38.1 mtp180 -52.9 -34.8 56.55 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.192 -0.458 . . . . 72.219999999999999 110.873 179.91 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -67.13 -35.26 79.35 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.221 -0.445 . . . . 74.5 110.831 -179.762 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . 0.554 HD12 ' CE1' ' A' ' 115' ' ' PHE . 3.2 mt -80.05 -45.09 22.74 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.155 -0.475 . . . . 75.219999999999999 111.126 179.978 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 25.2 m-85 -107.02 45.14 1.0 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.176 -0.465 . . . . 73.430000000000007 110.907 -179.97 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 2.2 mtm -43.08 -54.07 4.56 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.191 -0.459 . . . . 73.430000000000007 110.861 179.911 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -92.99 -24.42 18.37 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.236 -0.438 . . . . 73.230000000000004 110.865 179.987 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 9.1 m-20 -86.99 28.76 0.87 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.182 -0.463 . . . . 71.519999999999996 110.861 179.968 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 30' ' ' PHE . . . . . 0.611 ' C ' ' CD1' ' A' ' 30' ' ' PHE . 0.4 OUTLIER -113.5 144.34 43.01 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.222 -0.445 . . . . 72.129999999999995 110.892 -179.917 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 31' ' ' THR . . . . . 0.4 ' N ' ' CD1' ' A' ' 30' ' ' PHE . 52.6 m -123.9 130.07 52.0 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.126 -0.488 . . . . 75.400000000000006 111.092 -179.902 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -96.92 114.14 25.74 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.204 -0.453 . . . . 53.329999999999998 110.844 179.88 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . 0.596 ' CD2' ' N ' ' A' ' 34' ' ' THR . 0.1 OUTLIER -117.17 -18.35 10.01 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.217 -0.447 . . . . 74.140000000000001 110.894 -179.961 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 34' ' ' THR . . . . . 0.596 ' N ' ' CD2' ' A' ' 33' ' ' LEU . 4.9 m . . . . . 0 C--N 1.329 -0.298 0 CA-C-N 116.199 -0.455 . . . . 70.439999999999998 111.122 -179.981 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 45' ' ' GLN . . . . . 0.515 ' O ' ' CB ' ' A' ' 46' ' ' ILE . 24.5 pt20 . . . . . 0 C--O 1.232 0.172 0 CA-C-O 120.746 0.307 . . . . 70.349999999999994 110.875 . . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 46' ' ' ILE . . . . . 0.515 ' CB ' ' O ' ' A' ' 45' ' ' GLN . 0.1 OUTLIER 86.68 2.52 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.244 -0.435 . . . . 71.310000000000002 111.182 -179.992 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . 0.459 ' CG2' ' HG2' ' A' ' 45' ' ' GLN . 0.2 OUTLIER -66.39 147.68 12.48 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.167 -0.47 . . . . 71.329999999999998 111.113 179.864 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 48' ' ' PHE . . . . . 0.437 ' HA ' ' CD2' ' A' ' 33' ' ' LEU . 6.6 p90 -160.94 163.41 31.86 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.189 -0.46 . . . . 75.140000000000001 110.885 179.977 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 19.1 mt-10 -110.73 157.39 19.8 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.128 -0.487 . . . . 75.209999999999994 110.878 -179.929 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 9.5 mm -134.27 135.24 54.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.177 -0.465 . . . . 60.210000000000001 111.136 -179.986 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 99.7 m -85.08 135.08 34.15 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.156 -0.474 . . . . 65.129999999999995 111.131 -179.996 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 9.1 mt -133.98 156.01 48.95 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.203 -0.453 . . . . 74.299999999999997 110.936 179.978 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 53' ' ' ARG . . . . . 0.431 ' CG ' ' HB2' ' A' ' 63' ' ' SER . 0.0 OUTLIER -155.92 163.43 39.77 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.174 -0.466 . . . . 74.420000000000002 110.858 179.956 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -58.72 -169.0 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.174 -0.466 . . . . 62.210000000000001 110.85 -179.753 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -82.51 -37.65 14.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.128 -0.487 . . . . 72.540000000000006 111.131 179.973 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 5.4 t0 -130.43 -153.55 0.57 Allowed 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.157 -0.474 . . . . 65.120000000000005 110.873 179.91 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . 0.42 ' HD2' ' CD ' ' A' ' 61' ' ' GLU . 0.5 OUTLIER -116.94 -11.09 10.85 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.213 -0.449 . . . . 73.319999999999993 110.891 -179.983 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . 0.536 ' HA ' ' C ' ' A' ' 59' ' ' PRO . 1.8 pt-20 -126.6 147.07 59.15 Favored Pre-proline 0 C--N 1.329 -0.3 0 CA-C-O 121.664 0.745 . . . . 70.340000000000003 110.888 179.982 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 59' ' ' PRO . . . . . 0.536 ' C ' ' HA ' ' A' ' 58' ' ' GLU . 53.6 Cg_endo -69.75 -8.38 10.45 Favored 'Cis proline' 0 C--N 1.342 0.217 0 C-N-CA 122.679 -1.8 . . . . 75.530000000000001 112.353 0.011 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 60' ' ' VAL . . . . . 0.429 HG22 ' CG ' ' A' ' 88' ' ' ASN . 14.1 m -149.11 164.77 4.04 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.198 -0.455 . . . . 74.25 111.143 179.924 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . 0.42 ' CD ' ' HD2' ' A' ' 57' ' ' LYS . 1.9 tp10 -93.95 -28.2 15.93 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.226 -0.443 . . . . 74.519999999999996 110.872 -179.919 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 62' ' ' SER . . . . . 0.426 ' HB3' ' CD1' ' A' ' 125' ' ' LEU . 5.1 t 40.42 93.82 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.146 -0.479 . . . . 62.399999999999999 110.885 -179.796 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 63' ' ' SER . . . . . 0.431 ' HB2' ' CG ' ' A' ' 53' ' ' ARG . 1.3 t -115.17 123.76 49.73 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.142 -0.481 . . . . 73.409999999999997 110.845 -179.801 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 64' ' ' ILE . . . . . 0.469 ' CG2' ' HB3' ' A' ' 83' ' ' PHE . 38.0 mt -134.8 137.49 50.83 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 116.165 -0.471 . . . . 75.010000000000005 111.134 179.934 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 51.6 m -100.16 114.6 28.11 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.159 -0.473 . . . . 73.409999999999997 111.156 179.956 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . 0.526 ' HB3' ' CE2' ' A' ' 68' ' ' PHE . 1.5 mp -94.04 111.46 23.18 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.22 -0.445 . . . . 73.120000000000005 110.887 179.966 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 1.5 t60 -102.77 111.4 23.7 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.184 -0.462 . . . . 71.430000000000007 110.844 179.831 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 68' ' ' PHE . . . . . 0.57 ' CE1' HG23 ' A' ' 114' ' ' ILE . 0.0 OUTLIER -103.83 142.38 34.48 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.199 -0.455 . . . . 75.200000000000003 110.904 -179.944 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -124.8 121.94 36.0 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.121 -0.491 . . . . 65.239999999999995 111.116 179.93 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -86.61 91.41 8.57 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.205 -0.452 . . . . 75.439999999999998 110.869 179.987 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -43.87 157.24 0.28 Allowed Pre-proline 0 C--N 1.33 -0.256 0 CA-C-O 121.589 0.709 . . . . 72.530000000000001 111.118 -179.932 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.7 2.21 3.71 Favored 'Trans proline' 0 C--N 1.341 0.169 0 C-N-CA 122.671 2.247 . . . . 64.140000000000001 112.364 179.93 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 73' ' ' MET . . . . . 0.492 ' O ' ' CB ' ' A' ' 76' ' ' TYR . 0.1 OUTLIER -118.57 -25.84 6.33 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.208 -0.451 . . . . 75.099999999999994 110.884 179.943 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 74' ' ' TYR . . . . . 0.658 ' CD1' ' C ' ' A' ' 74' ' ' TYR . 0.0 OUTLIER -47.66 150.45 1.8 Allowed Pre-proline 0 C--N 1.329 -0.316 0 CA-C-O 121.697 0.76 . . . . 75.120000000000005 110.915 -179.875 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 75' ' ' PRO . . . . . 0.557 ' HA ' ' CD2' ' A' ' 74' ' ' TYR . 53.4 Cg_endo -69.76 -10.97 11.76 Favored 'Cis proline' 0 C--N 1.341 0.182 0 C-N-CA 122.68 -1.8 . . . . 72.420000000000002 112.348 -0.038 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 76' ' ' TYR . . . . . 0.492 ' CB ' ' O ' ' A' ' 73' ' ' MET . 25.0 t80 -34.03 -52.21 0.44 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.189 -0.459 . . . . 73.040000000000006 110.934 -179.879 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 31.0 p -106.46 -175.74 2.88 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.075 -0.511 . . . . 75.120000000000005 111.066 -179.938 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -100.96 132.37 22.13 Favored Pre-proline 0 C--N 1.329 -0.306 0 CA-C-O 121.552 0.691 . . . . 61.229999999999997 111.08 179.89 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.71 -167.52 0.23 Allowed 'Trans proline' 0 C--N 1.341 0.155 0 C-N-CA 122.672 2.248 . . . . 71.430000000000007 112.339 179.969 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . 0.414 ' HG3' ' N ' ' A' ' 81' ' ' ILE . 1.7 tt0 -130.0 142.63 50.61 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.164 -0.471 . . . . 61.229999999999997 110.905 -179.983 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 81' ' ' ILE . . . . . 0.414 ' N ' ' HG3' ' A' ' 80' ' ' GLU . 6.1 mm -133.94 141.68 43.31 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.18 -0.464 . . . . 71.129999999999995 111.135 -179.996 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . 0.459 ' HG3' ' CD ' ' A' ' 84' ' ' LYS . 3.5 pt-20 -147.44 140.3 24.94 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.211 -0.45 . . . . 75.430000000000007 110.878 179.995 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 83' ' ' PHE . . . . . 0.501 ' CE2' ' HD3' ' A' ' 98' ' ' LYS . 11.8 m-85 -95.71 140.98 29.74 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.114 -0.493 . . . . 73.120000000000005 110.847 -179.899 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 84' ' ' LYS . . . . . 0.459 ' CD ' ' HG3' ' A' ' 82' ' ' GLU . 9.8 mmmt -124.53 171.01 10.34 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.149 -0.478 . . . . 73.439999999999998 110.895 179.965 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 85' ' ' ASN . . . . . 0.557 ' N ' HD21 ' A' ' 85' ' ' ASN . 1.1 m-80 63.35 -73.17 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.241 -0.436 . . . . 74.150000000000006 110.891 179.899 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 86' ' ' VAL . . . . . 0.461 ' CG1' HD22 ' A' ' 94' ' ' LEU . 2.7 m 40.96 94.5 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.142 -0.481 . . . . 71.040000000000006 111.125 179.893 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -97.13 -83.29 0.39 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.136 -0.484 . . . . 74.400000000000006 110.946 179.98 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 88' ' ' ASN . . . . . 0.429 ' CG ' HG22 ' A' ' 60' ' ' VAL . 13.2 t30 -59.99 -40.46 89.26 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.209 -0.45 . . . . 73.430000000000007 110.879 -179.984 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 89' ' ' VAL . . . . . 0.462 HG23 ' N ' ' A' ' 90' ' ' MET . 0.9 OUTLIER -62.58 141.03 18.5 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.157 -0.474 . . . . 74.319999999999993 111.109 179.953 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 90' ' ' MET . . . . . 0.462 ' N ' HG23 ' A' ' 89' ' ' VAL . 6.8 mtm -97.22 -67.25 0.86 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.149 -0.478 . . . . 71.329999999999998 110.848 179.935 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 6.8 p-10 178.77 -32.4 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.249 -0.432 . . . . 74.409999999999997 110.889 179.997 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -54.55 -46.45 73.64 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.175 -0.466 . . . . 71.409999999999997 110.882 -179.757 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 93' ' ' GLN . . . . . 0.601 ' OE1' ' CE2' ' A' ' 128' ' ' PHE . 1.5 pt20 -70.87 -36.84 72.97 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.136 -0.484 . . . . 72.310000000000002 110.943 -179.98 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . 0.49 ' HG ' ' CD2' ' A' ' 83' ' ' PHE . 0.6 OUTLIER -57.66 -47.42 82.31 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.185 -0.461 . . . . 72.510000000000005 110.967 179.991 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 3.5 mm-40 -62.93 -34.09 76.73 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.193 -0.458 . . . . 73.409999999999997 110.913 179.89 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 96' ' ' MET . . . . . . . . . . . . . 19.1 ttp -59.95 -40.04 87.61 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.173 -0.467 . . . . 74.140000000000001 110.912 179.943 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 97' ' ' LEU . . . . . 0.599 ' O ' ' CD1' ' A' ' 101' ' ' PHE . 27.0 mt -68.02 -40.78 82.87 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.204 -0.453 . . . . 71.329999999999998 110.914 179.98 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 98' ' ' LYS . . . . . 0.501 ' HD3' ' CE2' ' A' ' 83' ' ' PHE . 3.7 mmtp -57.26 -36.52 71.08 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.178 -0.465 . . . . 71.319999999999993 110.899 179.857 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -68.93 -43.73 74.51 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.209 -0.45 . . . . 74.209999999999994 110.847 -179.897 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 37.3 mm-40 -66.82 -24.0 66.11 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.173 -0.467 . . . . 75.200000000000003 110.905 -179.959 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 101' ' ' PHE . . . . . 0.599 ' CD1' ' O ' ' A' ' 97' ' ' LEU . 11.1 m-30 -60.53 -37.08 80.03 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.148 -0.478 . . . . 74.340000000000003 110.917 -179.972 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 1.7 tmpt? -63.96 -40.22 95.93 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.112 -0.495 . . . . 75.319999999999993 110.878 -180.0 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 2.3 mppt? -69.48 -40.35 77.12 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.226 -0.443 . . . . 71.209999999999994 110.89 179.868 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 104' ' ' ILE . . . . . 0.455 ' O ' ' CG2' ' A' ' 107' ' ' THR . 4.3 mt -64.12 -47.62 89.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.218 -0.446 . . . . 72.409999999999997 111.08 179.913 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 105' ' ' HIS . . . . . 0.474 ' O ' ' N ' ' A' ' 109' ' ' ARG . 3.4 t60 -62.56 -41.28 98.81 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.207 -0.451 . . . . 72.109999999999999 110.854 179.898 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 1.3 t-20 -57.66 -36.95 72.58 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.244 -0.435 . . . . 75.040000000000006 110.905 -179.946 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 107' ' ' THR . . . . . 0.455 ' CG2' ' O ' ' A' ' 104' ' ' ILE . 5.1 t -84.93 -26.1 27.45 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.149 -0.478 . . . . 74.420000000000002 111.141 179.995 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 108' ' ' SER . . . . . 0.427 ' O ' ' N ' ' A' ' 110' ' ' GLY . 27.5 p -109.05 20.87 17.9 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.251 -0.431 . . . . 72.319999999999993 110.885 -179.893 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 109' ' ' ARG . . . . . 0.474 ' N ' ' O ' ' A' ' 105' ' ' HIS . 11.6 ttt180 -62.83 77.48 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.104 -0.498 . . . . 75.040000000000006 110.875 -179.926 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 110' ' ' GLY . . . . . 0.427 ' N ' ' O ' ' A' ' 108' ' ' SER . . . 136.67 33.55 0.23 Allowed Glycine 0 N--CA 1.451 -0.365 0 C-N-CA 120.745 -0.741 . . . . 73.439999999999998 112.488 -179.977 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 111' ' ' GLN . . . . . . . . . . . . . 3.9 pt20 -170.12 -166.27 0.53 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.735 0.302 . . . . 73.319999999999993 110.897 -179.898 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 15.2 mt-10 -68.98 129.98 41.46 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.218 -0.446 . . . . 74.030000000000001 110.914 -179.926 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 113' ' ' ILE . . . . . . . . . . . . . 22.4 pt -126.69 -8.15 4.83 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.202 -0.453 . . . . 74.209999999999994 111.139 179.947 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 114' ' ' ILE . . . . . 0.57 HG23 ' CE1' ' A' ' 68' ' ' PHE . 42.3 mm -64.88 -44.17 96.25 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-N 116.189 -0.46 . . . . 74.299999999999997 111.127 179.8 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 115' ' ' PHE . . . . . 0.554 ' CE1' HD12 ' A' ' 25' ' ' ILE . 19.2 t80 -68.85 -35.24 76.69 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.208 -0.451 . . . . 73.420000000000002 110.884 179.966 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 35.5 mm-40 -66.48 -46.03 77.69 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.127 -0.488 . . . . 73.219999999999999 110.877 -179.943 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 117' ' ' ILE . . . . . 0.515 HD12 ' CG ' ' A' ' 101' ' ' PHE . 0.4 OUTLIER -64.03 -40.81 90.38 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.149 -0.478 . . . . 74.209999999999994 111.168 179.983 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 118' ' ' THR . . . . . 0.474 ' N ' ' CG2' ' A' ' 117' ' ' ILE . 67.7 p -68.25 -41.56 80.98 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.129 -0.487 . . . . 71.329999999999998 111.136 179.974 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 1.2 t -67.98 -43.5 78.82 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.215 -0.448 . . . . 74.430000000000007 110.871 -179.852 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -66.64 -41.56 88.07 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.174 -0.466 . . . . 74.519999999999996 110.87 -179.971 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 11.9 p -67.66 -39.18 84.56 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.119 -0.491 . . . . 74.329999999999998 111.133 -179.926 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 59.1 tt0 -64.99 -50.64 65.53 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.245 -0.434 . . . . 74.349999999999994 110.899 -179.981 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 123' ' ' GLU . . . . . 0.437 ' HG3' ' N ' ' A' ' 124' ' ' LYS . 12.3 pt-20 -60.16 -36.38 77.43 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.173 -0.467 . . . . 62.299999999999997 110.882 -179.921 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 124' ' ' LYS . . . . . 0.478 ' HA ' ' CG ' ' A' ' 127' ' ' GLU . 0.0 OUTLIER -78.52 -32.36 47.99 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.144 -0.48 . . . . 71.430000000000007 110.91 179.942 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 125' ' ' LEU . . . . . 0.426 ' CD1' ' HB3' ' A' ' 62' ' ' SER . 0.5 OUTLIER -72.25 -41.48 66.74 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.217 -0.447 . . . . 74.340000000000003 110.952 179.903 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -70.37 -46.28 64.4 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.151 -0.477 . . . . 71.219999999999999 110.896 179.835 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 127' ' ' GLU . . . . . 0.571 ' CD ' ' N ' ' A' ' 128' ' ' PHE . 3.1 pp20? -59.15 -50.82 72.56 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.153 -0.476 . . . . 71.340000000000003 110.859 -179.91 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 128' ' ' PHE . . . . . 0.601 ' CE2' ' OE1' ' A' ' 93' ' ' GLN . 0.0 OUTLIER . . . . . 0 C--N 1.329 -0.317 0 CA-C-N 116.145 -0.479 . . . . 75.219999999999999 110.873 -179.881 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.23 0.07 0 CA-C-O 120.789 0.328 . . . . 72.150000000000006 110.883 . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 40.5 m -136.96 94.01 2.91 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.23 -0.441 . . . . 70.310000000000002 110.897 -179.869 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -127.46 100.11 5.89 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.085 -0.507 . . . . 74.340000000000003 110.933 179.999 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 57.5 p -163.67 -55.95 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.219 -0.446 . . . . 74.230000000000004 110.806 -179.925 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -41.9 -65.4 0.46 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.145 -0.479 . . . . 75.299999999999997 110.835 179.992 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 6.2 mp -104.74 114.23 28.32 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.205 -0.452 . . . . 74.239999999999995 110.913 -179.94 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 3.0 t -81.86 169.72 16.52 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.181 -0.463 . . . . 74.140000000000001 111.17 179.933 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 11.0 mt -55.06 -30.53 59.81 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.249 -0.432 . . . . 72.540000000000006 110.954 179.96 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 -53.02 -32.18 45.26 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.156 -0.475 . . . . 75.140000000000001 110.834 179.868 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 62.8 mm-40 -64.84 -38.42 90.92 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.193 -0.458 . . . . 63.100000000000001 110.893 -179.84 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 20.7 m-85 -64.16 -25.18 67.97 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.183 -0.462 . . . . 74.120000000000005 110.946 -179.887 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -58.98 -37.4 76.72 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.142 -0.481 . . . . 75.430000000000007 110.926 -179.957 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 1.6 mm-40 -65.91 -43.35 88.44 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.125 -0.489 . . . . 74.129999999999995 110.909 179.978 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 4.3 mp -67.22 -43.24 88.44 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 116.135 -0.484 . . . . 71.310000000000002 111.152 179.968 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 81.7 mt-30 -64.69 -46.28 83.03 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.152 -0.476 . . . . 73.209999999999994 110.911 179.965 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 38.9 t -60.96 -38.84 87.33 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.182 -0.463 . . . . 72.219999999999999 110.847 -179.931 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 1.5 m-20 -58.79 -33.87 70.83 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.172 -0.467 . . . . 74.030000000000001 110.899 -179.878 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 15.6 mt-10 -67.71 -38.59 83.81 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.16 -0.473 . . . . 73.329999999999998 110.865 -179.954 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . 0.471 HD12 ' N ' ' A' ' 19' ' ' LEU . 9.8 mp -61.48 -51.68 67.67 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.176 -0.466 . . . . 75.030000000000001 110.932 179.989 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 2.5 pt-20 -68.86 -34.6 75.73 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.192 -0.458 . . . . 75.310000000000002 110.895 179.958 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -65.35 -45.79 82.77 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.142 -0.481 . . . . 72.530000000000001 111.114 179.948 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . 0.478 ' N ' HD13 ' A' ' 22' ' ' ILE . 0.5 OUTLIER -77.2 -34.59 21.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.186 -0.461 . . . . 73.340000000000003 111.14 179.944 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -53.39 -35.59 60.53 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.177 -0.465 . . . . 75.400000000000006 110.841 179.98 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -66.79 -31.43 72.06 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.167 -0.47 . . . . 72.150000000000006 110.863 -179.77 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 5.0 mt -79.72 -45.09 23.3 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.163 -0.472 . . . . 75.430000000000007 111.112 179.943 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 38.4 m-85 -111.51 45.73 1.18 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.187 -0.46 . . . . 74.310000000000002 110.928 -179.988 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -40.85 -40.56 1.39 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.131 -0.486 . . . . 73.319999999999993 110.884 179.909 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 11.4 m-20 -106.07 -27.2 11.27 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.204 -0.453 . . . . 75.120000000000005 110.887 179.942 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 10.7 m-20 -85.05 29.57 0.64 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.196 -0.456 . . . . 73.040000000000006 110.853 179.998 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' PHE . . . . . 0.545 ' C ' ' CD1' ' A' ' 30' ' ' PHE . 0.3 OUTLIER -113.21 146.04 39.98 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.229 -0.442 . . . . 74.230000000000004 110.853 -179.929 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 42.5 m -122.89 132.9 54.38 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.117 -0.492 . . . . 72.049999999999997 111.17 -179.928 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -98.33 114.72 27.12 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.257 -0.428 . . . . 75.200000000000003 110.852 179.923 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . 0.461 ' CD2' ' HA ' ' A' ' 48' ' ' PHE . 0.3 OUTLIER -120.53 -16.47 8.31 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.147 -0.479 . . . . 74.040000000000006 110.951 -179.982 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -49.22 160.18 0.24 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.154 -0.476 . . . . 74.540000000000006 111.14 179.918 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -75.54 50.32 0.53 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.176 -0.465 . . . . 65.430000000000007 110.887 179.897 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . 0.442 ' O ' ' C ' ' A' ' 37' ' ' LYS . 22.3 mtp180 -114.84 -41.05 3.42 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.217 -0.447 . . . . 74.340000000000003 110.877 179.962 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . 0.442 ' C ' ' O ' ' A' ' 36' ' ' ARG . 1.0 OUTLIER -34.01 134.44 0.18 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.213 -0.448 . . . . 75.409999999999997 110.95 179.928 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER 71.03 -78.24 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.213 -0.449 . . . . 72.209999999999994 110.839 -179.85 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' SER . . . . . 0.405 ' O ' ' O ' ' A' ' 36' ' ' ARG . 6.2 m -64.62 -175.68 0.2 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.156 -0.474 . . . . 74.340000000000003 110.884 -179.806 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' TRP . . . . . . . . . . . . . 34.7 t-105 -95.51 -44.9 7.31 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.167 -0.469 . . . . 75.430000000000007 110.956 179.979 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -179.34 131.81 0.11 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.21 -0.45 . . . . 74.239999999999995 110.859 179.919 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . 0.431 ' C ' ' CD ' ' A' ' 44' ' ' PRO . 0.1 OUTLIER -129.23 -89.6 0.5 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.21 -0.45 . . . . 75.319999999999993 110.876 -179.968 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . 0.487 ' N ' ' CD ' ' A' ' 44' ' ' PRO . 2.9 mt-30 -119.28 50.81 1.49 Allowed Pre-proline 0 C--N 1.329 -0.293 0 CA-C-O 121.616 0.722 . . . . 73.219999999999999 110.908 179.981 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' PRO . . . . . 0.487 ' CD ' ' N ' ' A' ' 43' ' ' GLN . 53.4 Cg_endo -69.74 144.96 55.82 Favored 'Trans proline' 0 C--N 1.342 0.22 0 C-N-CA 122.675 2.25 . . . . 71.140000000000001 112.319 -179.985 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' GLN . . . . . 0.482 ' O ' ' CB ' ' A' ' 46' ' ' ILE . 32.0 tt0 -121.99 6.3 9.82 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.185 -0.461 . . . . 74.319999999999993 110.957 179.951 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . 0.482 ' CB ' ' O ' ' A' ' 45' ' ' GLN . 0.0 OUTLIER 84.1 -28.26 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.147 -0.479 . . . . 72.430000000000007 111.134 179.958 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . 0.494 ' N ' HD12 ' A' ' 47' ' ' ILE . 0.2 OUTLIER -43.32 148.3 0.21 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.157 -0.474 . . . . 74.209999999999994 111.12 179.866 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' PHE . . . . . 0.461 ' HA ' ' CD2' ' A' ' 33' ' ' LEU . 5.8 p90 -156.53 158.05 36.48 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.197 -0.456 . . . . 70.019999999999996 110.909 179.933 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . 0.402 ' HG2' ' CG ' ' A' ' 67' ' ' HIS . 40.1 mt-10 -108.99 152.0 25.56 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.128 -0.487 . . . . 73.230000000000004 110.846 -179.891 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 23.2 mm -131.46 137.03 56.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.157 -0.474 . . . . 71.420000000000002 111.101 179.963 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 75.9 m -84.67 124.3 31.33 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.164 -0.471 . . . . 74.420000000000002 111.104 179.974 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 20.7 mt -126.8 159.55 33.49 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.222 -0.445 . . . . 75.450000000000003 110.886 179.95 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' ARG . . . . . 0.414 ' C ' HD21 ' A' ' 125' ' ' LEU . 0.1 OUTLIER -179.88 168.23 1.31 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.166 -0.47 . . . . 74.450000000000003 110.931 179.944 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' SER . . . . . 0.463 ' N ' HD21 ' A' ' 125' ' ' LEU . 16.3 p -56.14 -173.26 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.22 -0.445 . . . . 75.340000000000003 110.869 -179.808 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 18.1 m -94.21 -28.1 4.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.135 -0.484 . . . . 74.200000000000003 111.105 179.94 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 1.6 t0 -121.55 -164.07 1.11 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.224 -0.444 . . . . 71.530000000000001 110.862 179.966 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 3.1 mmmm -118.39 -12.88 9.82 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.196 -0.456 . . . . 74.420000000000002 110.89 179.987 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . 0.552 ' HA ' ' C ' ' A' ' 59' ' ' PRO . 68.1 mt-10 -121.38 145.51 42.61 Favored Pre-proline 0 C--N 1.329 -0.287 0 CA-C-O 121.636 0.732 . . . . 73.040000000000006 110.895 179.972 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' PRO . . . . . 0.552 ' C ' ' HA ' ' A' ' 58' ' ' GLU . 53.7 Cg_endo -69.75 -9.42 10.98 Favored 'Cis proline' 0 C--O 1.231 0.172 0 C-N-CA 122.701 -1.791 . . . . 73.099999999999994 112.326 0.035 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 60' ' ' VAL . . . . . 0.484 ' CG2' ' CG ' ' A' ' 129' ' ' GLN . 21.7 m -146.31 178.96 1.06 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.241 -0.436 . . . . 75.329999999999998 111.134 179.91 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . 0.458 ' O ' ' C ' ' A' ' 62' ' ' SER . 15.2 tt0 -108.04 -18.43 13.79 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.169 -0.469 . . . . 65.150000000000006 110.886 -179.933 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 62' ' ' SER . . . . . 0.458 ' C ' ' O ' ' A' ' 61' ' ' GLU . 0.9 OUTLIER 33.8 77.56 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.167 -0.47 . . . . 72.209999999999994 110.87 -179.794 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -102.87 126.76 50.15 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.143 -0.48 . . . . 73.129999999999995 110.849 -179.804 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 64' ' ' ILE . . . . . . . . . . . . . 21.1 mt -140.24 143.29 29.88 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 116.175 -0.466 . . . . 73.450000000000003 111.102 179.947 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 92.1 m -106.98 118.94 38.02 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.169 -0.469 . . . . 63.240000000000002 111.083 179.99 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 1.7 mp -100.09 114.0 27.03 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.198 -0.456 . . . . 71.430000000000007 110.924 179.913 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 67' ' ' HIS . . . . . 0.439 ' CE1' HD11 ' A' ' 33' ' ' LEU . 7.5 t60 -108.4 113.28 26.22 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.233 -0.44 . . . . 75.430000000000007 110.798 179.888 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 68' ' ' PHE . . . . . 0.554 ' CE1' HG22 ' A' ' 114' ' ' ILE . 0.0 OUTLIER -103.98 139.96 38.38 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.197 -0.456 . . . . 74.409999999999997 110.866 -179.937 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -119.66 119.46 33.79 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.135 -0.484 . . . . 75.230000000000004 111.108 179.94 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 70' ' ' MET . . . . . 0.423 ' HE3' ' CG1' ' A' ' 114' ' ' ILE . 2.5 mmt -84.25 89.41 7.33 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.223 -0.444 . . . . 74.409999999999997 110.919 179.946 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -45.02 157.76 0.32 Allowed Pre-proline 0 C--N 1.33 -0.274 0 CA-C-O 121.583 0.706 . . . . 71.129999999999995 111.124 -179.903 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.77 2.87 3.15 Favored 'Trans proline' 0 C--N 1.341 0.173 0 C-N-CA 122.643 2.229 . . . . 73.209999999999994 112.368 179.899 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 73' ' ' MET . . . . . 0.486 ' O ' ' CB ' ' A' ' 76' ' ' TYR . 0.0 OUTLIER -117.7 -26.38 6.58 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.23 -0.441 . . . . 74.030000000000001 110.879 179.918 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 74' ' ' TYR . . . . . 0.637 ' CD1' ' C ' ' A' ' 74' ' ' TYR . 0.0 OUTLIER -47.14 148.71 1.95 Allowed Pre-proline 0 C--N 1.328 -0.327 0 CA-C-O 121.712 0.768 . . . . 65.219999999999999 110.915 -179.862 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 75' ' ' PRO . . . . . 0.55 ' C ' ' HA ' ' A' ' 74' ' ' TYR . 54.1 Cg_endo -69.78 -13.46 12.44 Favored 'Cis proline' 0 C--N 1.342 0.185 0 C-N-CA 122.67 -1.804 . . . . 75.239999999999995 112.361 -0.009 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 76' ' ' TYR . . . . . 0.486 ' CB ' ' O ' ' A' ' 73' ' ' MET . 9.4 t80 -34.95 -46.3 0.3 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.207 -0.452 . . . . 71.010000000000005 110.867 -179.866 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 66.7 p -111.58 177.7 4.57 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.14 -0.482 . . . . 75.450000000000003 111.16 -179.953 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -98.33 135.03 21.39 Favored Pre-proline 0 C--N 1.328 -0.327 0 CA-C-O 121.578 0.704 . . . . 72.239999999999995 111.058 179.893 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 79' ' ' PRO . . . . . 0.426 ' HG3' ' CD1' ' A' ' 113' ' ' ILE . 53.5 Cg_endo -69.74 -167.27 0.22 Allowed 'Trans proline' 0 C--N 1.341 0.159 0 C-N-CA 122.667 2.245 . . . . 61.5 112.374 179.97 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -131.09 127.23 37.72 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.259 -0.428 . . . . 73.329999999999998 110.853 -179.97 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 10.0 mm -119.54 140.59 43.03 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.144 -0.48 . . . . 74.329999999999998 111.202 179.9 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . 0.454 ' HG3' ' CD ' ' A' ' 84' ' ' LYS . 1.0 OUTLIER -146.27 137.92 24.79 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.229 -0.441 . . . . 71.540000000000006 110.908 179.969 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 83' ' ' PHE . . . . . 0.421 ' C ' ' HD2' ' A' ' 84' ' ' LYS . 9.9 m-85 -93.48 140.0 30.08 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.158 -0.474 . . . . 71.340000000000003 110.871 -179.919 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 84' ' ' LYS . . . . . 0.463 ' O ' ' N ' ' A' ' 86' ' ' VAL . 10.6 mmmt -123.78 172.0 9.2 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.14 -0.482 . . . . 74.129999999999995 110.914 179.956 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . 0.482 ' N ' HD21 ' A' ' 85' ' ' ASN . 1.5 m-80 62.8 -74.19 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.23 -0.441 . . . . 74.109999999999999 110.947 179.971 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 86' ' ' VAL . . . . . 0.463 ' N ' ' O ' ' A' ' 84' ' ' LYS . 3.5 m 41.54 91.15 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.158 -0.473 . . . . 75.219999999999999 111.078 179.859 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -97.19 -85.72 0.35 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.179 -0.464 . . . . 72.540000000000006 110.893 179.979 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -52.58 -46.38 66.87 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.222 -0.444 . . . . 74.299999999999997 110.865 -179.943 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 89' ' ' VAL . . . . . 0.458 HG21 ' N ' ' A' ' 90' ' ' MET . 0.7 OUTLIER -60.45 141.38 17.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.221 -0.445 . . . . 73.329999999999998 111.154 179.926 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 90' ' ' MET . . . . . 0.458 ' N ' HG21 ' A' ' 89' ' ' VAL . 7.6 mtm -95.71 -54.76 3.24 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.181 -0.463 . . . . 75.140000000000001 110.895 179.979 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 91' ' ' ASP . . . . . 0.432 ' OD1' ' C ' ' A' ' 90' ' ' MET . 1.3 p-10 175.36 -34.58 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.184 -0.462 . . . . 63.5 110.874 179.911 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -54.55 -40.27 68.53 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.238 -0.437 . . . . 74.219999999999999 110.826 -179.77 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 93' ' ' GLN . . . . . 0.566 ' HG3' ' CZ ' ' A' ' 128' ' ' PHE . 1.5 mp0 -70.98 -37.46 72.74 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.134 -0.484 . . . . 70.430000000000007 110.95 -179.979 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . 0.435 ' CD2' HG13 ' A' ' 86' ' ' VAL . 39.5 mt -65.58 -49.21 69.68 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.187 -0.461 . . . . 75.120000000000005 110.941 179.95 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 41.2 mt-30 -65.91 -34.02 77.17 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.141 -0.481 . . . . 75.219999999999999 110.904 179.937 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 96' ' ' MET . . . . . . . . . . . . . 2.3 ttp -60.08 -41.15 91.83 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.194 -0.457 . . . . 75.230000000000004 110.839 -179.971 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 97' ' ' LEU . . . . . 0.448 ' O ' ' CD1' ' A' ' 101' ' ' PHE . 34.3 mt -65.99 -39.69 90.52 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.201 -0.454 . . . . 74.109999999999999 110.871 -179.941 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 98' ' ' LYS . . . . . 0.413 ' HD3' ' CZ ' ' A' ' 83' ' ' PHE . 3.2 mmtp -55.31 -39.33 69.8 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.19 -0.459 . . . . 74.430000000000007 110.892 179.846 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -66.24 -37.84 86.46 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.239 -0.437 . . . . 73.140000000000001 110.89 -179.917 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 2.4 mm-40 -74.14 -24.57 59.44 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.113 -0.494 . . . . 64.239999999999995 110.818 -179.924 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 101' ' ' PHE . . . . . 0.557 ' CD2' HD13 ' A' ' 117' ' ' ILE . 10.8 m-30 -59.38 -26.88 65.48 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.222 -0.444 . . . . 74.049999999999997 110.935 -179.929 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.27 -42.98 64.97 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.107 -0.497 . . . . 73.540000000000006 110.899 179.968 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.76 -40.87 84.0 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.213 -0.449 . . . . 64.340000000000003 110.917 179.862 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 104' ' ' ILE . . . . . 0.409 HD13 ' CG ' ' A' ' 120' ' ' PHE . 2.6 mt -63.55 -47.6 90.74 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.225 -0.443 . . . . 74.439999999999998 111.111 179.863 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 105' ' ' HIS . . . . . 0.478 ' O ' ' N ' ' A' ' 109' ' ' ARG . 28.2 t-80 -62.89 -42.51 99.8 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.148 -0.478 . . . . 71.510000000000005 110.888 179.912 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -56.52 -40.9 75.81 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.164 -0.471 . . . . 74.019999999999996 110.865 -179.924 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 107' ' ' THR . . . . . 0.402 ' CG2' ' O ' ' A' ' 104' ' ' ILE . 8.0 t -80.47 -31.18 37.42 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.222 -0.444 . . . . 71.109999999999999 111.146 -179.97 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -103.9 21.91 15.48 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.201 -0.454 . . . . 73.420000000000002 110.877 -179.901 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 109' ' ' ARG . . . . . 0.478 ' N ' ' O ' ' A' ' 105' ' ' HIS . 0.0 OUTLIER -62.0 84.9 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.125 -0.488 . . . . 72.150000000000006 110.846 -179.93 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 110' ' ' GLY . . . . . 0.446 ' HA2' ' CB ' ' A' ' 75' ' ' PRO . . . 134.19 -23.15 3.7 Favored Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.705 -0.759 . . . . 65.219999999999999 112.452 179.988 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 111' ' ' GLN . . . . . . . . . . . . . 2.6 pt20 -109.06 -171.81 1.92 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.757 0.313 . . . . 75.519999999999996 110.894 -179.858 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 20.1 mt-10 -66.03 134.55 53.13 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.181 -0.463 . . . . 75.540000000000006 110.905 -179.987 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 113' ' ' ILE . . . . . 0.426 ' CD1' ' HG3' ' A' ' 79' ' ' PRO . 24.8 pt -123.23 -7.8 7.88 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.172 -0.467 . . . . 75.230000000000004 111.154 179.915 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 114' ' ' ILE . . . . . 0.554 HG22 ' CE1' ' A' ' 68' ' ' PHE . 28.6 mm -64.18 -44.19 97.46 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.161 -0.472 . . . . 73.409999999999997 111.101 179.865 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 115' ' ' PHE . . . . . . . . . . . . . 28.2 t80 -72.08 -36.9 69.65 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.194 -0.457 . . . . 75.120000000000005 110.864 179.99 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 50.2 mm-40 -65.93 -47.63 74.08 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.165 -0.47 . . . . 72.129999999999995 110.868 -179.927 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 117' ' ' ILE . . . . . 0.557 HD13 ' CD2' ' A' ' 101' ' ' PHE . 0.9 OUTLIER -64.26 -41.55 92.74 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.19 -0.459 . . . . 73.239999999999995 111.127 179.965 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 118' ' ' THR . . . . . 0.475 ' N ' ' CG2' ' A' ' 117' ' ' ILE . 71.1 p -68.03 -42.55 80.44 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.192 -0.458 . . . . 74.329999999999998 111.14 179.975 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 2.8 m -66.88 -43.48 83.4 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.249 -0.432 . . . . 54.25 110.861 -179.859 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 120' ' ' PHE . . . . . 0.409 ' CG ' HD13 ' A' ' 104' ' ' ILE . 0.3 OUTLIER -61.78 -47.65 84.23 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.115 -0.493 . . . . 73.219999999999999 110.871 -179.941 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 73.4 p -67.81 -40.76 83.83 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.13 -0.486 . . . . 61.140000000000001 111.116 -179.893 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 47.6 tt0 -64.3 -48.8 74.26 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.203 -0.453 . . . . 72.150000000000006 110.896 -179.94 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 123' ' ' GLU . . . . . 0.54 ' CG ' ' N ' ' A' ' 124' ' ' LYS . 3.5 pt-20 -61.84 -50.54 71.85 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.194 -0.457 . . . . 75.099999999999994 110.855 -179.929 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 124' ' ' LYS . . . . . 0.54 ' N ' ' CG ' ' A' ' 123' ' ' GLU . 0.0 OUTLIER -65.6 -37.18 85.88 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.159 -0.473 . . . . 72.239999999999995 110.871 -179.991 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 125' ' ' LEU . . . . . 0.463 HD21 ' N ' ' A' ' 54' ' ' SER . 1.1 tp -64.34 -51.5 63.09 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.249 -0.432 . . . . 71.540000000000006 110.912 179.901 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -57.2 -45.4 83.82 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.212 -0.449 . . . . 62.409999999999997 110.878 179.86 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 127' ' ' GLU . . . . . 0.46 ' HG3' ' N ' ' A' ' 128' ' ' PHE . 0.4 OUTLIER -61.27 -29.39 69.82 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.218 -0.446 . . . . 74.219999999999999 110.851 -179.885 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 128' ' ' PHE . . . . . 0.566 ' CZ ' ' HG3' ' A' ' 93' ' ' GLN . 0.3 OUTLIER -61.05 -69.04 0.25 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.18 -0.463 . . . . 74.140000000000001 110.863 -179.942 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 129' ' ' GLN . . . . . 0.484 ' CG ' ' CG2' ' A' ' 60' ' ' VAL . 0.9 OUTLIER -34.38 -37.01 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.155 -0.475 . . . . 74.140000000000001 110.902 -179.906 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 130' ' ' ASN . . . . . 0.42 ' N ' ' O ' ' A' ' 128' ' ' PHE . 2.5 t-20 -69.17 -48.47 62.11 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.247 -0.433 . . . . 74.140000000000001 110.859 -179.967 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 131' ' ' VAL . . . . . 0.489 ' N ' ' O ' ' A' ' 128' ' ' PHE . 4.4 m -126.45 80.23 0.67 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.144 -0.48 . . . . 75.450000000000003 111.109 179.97 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 132' ' ' VAL . . . . . 0.408 HG21 ' N ' ' A' ' 133' ' ' ASN . 7.9 p -115.82 141.83 31.55 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.177 -0.465 . . . . 75.019999999999996 111.161 179.911 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 133' ' ' ASN . . . . . 0.408 ' N ' HG21 ' A' ' 132' ' ' VAL . 34.1 t30 -69.78 82.06 0.45 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.214 -0.448 . . . . 65.140000000000001 110.841 -179.963 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 134' ' ' THR . . . . . . . . . . . . . 14.8 t -64.52 152.34 42.09 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.211 -0.45 . . . . 73.25 111.107 -179.97 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 27.9 tt0 -154.55 -39.44 0.09 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.24 -0.436 . . . . 72.400000000000006 110.883 -179.999 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 55.1 m 60.97 149.97 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.215 -0.448 . . . . 74.219999999999999 110.841 -179.803 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 137' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER 43.4 87.86 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.142 -0.481 . . . . 75.150000000000006 110.874 179.985 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--N 1.33 -0.264 0 CA-C-N 116.188 -0.46 . . . . 63.240000000000002 110.898 179.905 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.231 0.079 0 CA-C-O 120.753 0.311 . . . . 71.329999999999998 110.922 . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 19.4 t -105.78 86.95 2.48 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.208 -0.451 . . . . 73.439999999999998 110.867 -179.764 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -120.17 -175.95 3.1 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.135 -0.484 . . . . 73.450000000000003 110.932 -179.985 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 3.6 m -111.44 120.88 43.64 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.242 -0.436 . . . . 73.439999999999998 110.874 -179.946 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' HIS . . . . . 0.552 ' NE2' ' CE1' ' A' ' 11' ' ' TYR . 23.6 t-80 -80.29 109.1 14.45 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.112 -0.495 . . . . 74.420000000000002 110.862 179.987 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -155.73 -48.95 0.08 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.225 -0.443 . . . . 71.530000000000001 110.935 -179.97 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' THR . . . . . 0.408 ' CG2' ' HB3' ' A' ' 9' ' ' ASP . 12.2 t -86.56 162.65 17.9 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.228 -0.442 . . . . 74.120000000000005 111.173 179.89 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 24.4 mt -68.73 -26.19 65.12 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.193 -0.458 . . . . 73.510000000000005 110.93 179.964 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . 0.408 ' HB3' ' CG2' ' A' ' 7' ' ' THR . 0.1 OUTLIER -49.93 -34.08 19.47 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.195 -0.457 . . . . 73.120000000000005 110.868 179.794 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 7.0 mm100 -68.11 -39.26 82.84 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.181 -0.463 . . . . 75.019999999999996 110.847 -179.863 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' TYR . . . . . 0.552 ' CE1' ' NE2' ' A' ' 5' ' ' HIS . 18.2 m-85 -58.9 -27.41 65.2 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.229 -0.441 . . . . 70.409999999999997 110.927 -179.858 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -60.72 -37.12 80.66 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.146 -0.479 . . . . 74.120000000000005 110.907 -179.906 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 3.1 mm-40 -58.58 -43.35 89.44 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.142 -0.481 . . . . 72.120000000000005 110.901 179.974 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 3.1 mp -66.06 -43.02 92.56 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.123 -0.489 . . . . 75.109999999999999 111.157 179.963 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 73.0 mt-30 -62.62 -42.2 99.45 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.165 -0.47 . . . . 73.150000000000006 110.907 179.943 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -61.1 -42.02 97.76 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.187 -0.46 . . . . 73.230000000000004 110.89 -179.948 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 1.5 m-20 -59.04 -33.72 71.08 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.165 -0.47 . . . . 61.100000000000001 110.9 -179.889 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 1.7 mt-10 -64.74 -37.89 89.15 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.18 -0.464 . . . . 73.239999999999995 110.866 -179.966 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . 0.56 HD11 ' CE1' ' A' ' 48' ' ' PHE . 7.2 mp -66.15 -51.61 56.27 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.159 -0.473 . . . . 73.329999999999998 110.93 -179.989 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -68.74 -33.35 73.76 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.171 -0.468 . . . . 74.439999999999998 110.925 179.923 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -66.44 -50.57 62.92 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.109 -0.496 . . . . 74.150000000000006 111.121 179.919 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . 0.482 ' N ' HD12 ' A' ' 22' ' ' ILE . 0.5 OUTLIER -73.37 -37.15 50.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.201 -0.454 . . . . 73.239999999999995 111.176 179.968 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 30.8 mtp180 -52.79 -34.5 53.72 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.131 -0.486 . . . . 71.400000000000006 110.918 179.937 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -66.75 -31.2 71.69 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.187 -0.461 . . . . 61.200000000000003 110.844 -179.799 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 3.5 mt -85.08 -44.5 17.33 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.142 -0.481 . . . . 65.230000000000004 111.123 179.926 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 27.7 m-85 -107.06 42.76 1.25 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.202 -0.453 . . . . 74.340000000000003 110.888 -179.925 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 1.9 mtm -41.29 -45.82 3.06 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.096 -0.502 . . . . 75.140000000000001 110.902 179.891 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -101.68 -14.23 17.46 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.202 -0.453 . . . . 70.200000000000003 110.878 179.928 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 3.1 m-20 -97.66 21.03 10.92 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.182 -0.463 . . . . 72.519999999999996 110.873 179.984 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' PHE . . . . . 0.491 ' CE2' ' CD2' ' A' ' 48' ' ' PHE . 5.4 t80 -109.87 137.23 47.95 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.204 -0.453 . . . . 73.310000000000002 110.878 -179.916 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 59.3 m -116.51 134.8 54.43 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.134 -0.485 . . . . 73.109999999999999 111.156 -179.914 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . 0.456 ' O ' ' CG ' ' A' ' 32' ' ' ASP . 0.0 OUTLIER -99.22 117.34 33.47 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.225 -0.443 . . . . 74.420000000000002 110.867 179.89 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . 0.451 ' CD2' ' HA ' ' A' ' 48' ' ' PHE . 0.2 OUTLIER -121.19 -21.4 6.42 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.194 -0.457 . . . . 73.299999999999997 110.918 -179.972 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' THR . . . . . 0.422 ' N ' ' CD2' ' A' ' 33' ' ' LEU . 0.6 OUTLIER -45.76 153.02 0.3 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.204 -0.453 . . . . 74.430000000000007 111.108 179.918 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -91.48 67.41 5.6 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.175 -0.466 . . . . 73.510000000000005 110.943 179.835 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . 0.4 ' CG ' ' HB ' ' A' ' 34' ' ' THR . 0.0 OUTLIER -116.71 152.52 34.14 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.233 -0.439 . . . . 75.120000000000005 110.854 -179.975 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . 0.402 ' O ' ' O ' ' A' ' 38' ' ' SER . 2.0 mmpt? 54.85 -92.57 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.19 -0.459 . . . . 73.450000000000003 110.947 179.977 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' SER . . . . . 0.402 ' O ' ' O ' ' A' ' 37' ' ' LYS . 0.2 OUTLIER -52.29 -172.86 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.192 -0.458 . . . . 72.209999999999994 110.859 -179.936 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 3.1 m 75.64 -173.76 0.11 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.133 -0.485 . . . . 71.409999999999997 110.86 -179.811 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' TRP . . . . . . . . . . . . . 34.1 p90 -114.71 -4.04 12.78 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.143 -0.48 . . . . 70.010000000000005 110.911 -179.981 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -132.79 157.37 45.15 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.222 -0.444 . . . . 63.420000000000002 110.872 179.924 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . 0.431 ' C ' ' CD ' ' A' ' 44' ' ' PRO . 0.0 OUTLIER -121.28 72.88 1.01 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.191 -0.458 . . . . 74.519999999999996 110.877 179.993 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . 0.552 ' N ' ' CD ' ' A' ' 44' ' ' PRO . 0.8 OUTLIER -120.51 47.96 1.22 Allowed Pre-proline 0 C--N 1.329 -0.313 0 CA-C-O 121.577 0.703 . . . . 75.129999999999995 110.95 179.935 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' PRO . . . . . 0.552 ' CD ' ' N ' ' A' ' 43' ' ' GLN . 54.0 Cg_endo -69.74 128.32 15.87 Favored 'Trans proline' 0 C--N 1.341 0.171 0 C-N-CA 122.656 2.237 . . . . 74.239999999999995 112.34 -179.998 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' GLN . . . . . 0.494 ' O ' ' CG ' ' A' ' 45' ' ' GLN . 15.7 tt0 -107.79 11.46 28.2 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.24 -0.436 . . . . 72.209999999999994 110.908 179.999 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . 0.477 ' CB ' ' O ' ' A' ' 45' ' ' GLN . 0.2 OUTLIER 83.57 -29.55 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.21 -0.45 . . . . 74.420000000000002 111.163 -179.991 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . 0.505 ' N ' HD12 ' A' ' 47' ' ' ILE . 0.2 OUTLIER -45.1 146.14 0.44 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.151 -0.477 . . . . 73.140000000000001 111.145 179.827 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' PHE . . . . . 0.56 ' CE1' HD11 ' A' ' 19' ' ' LEU . 5.3 p90 -150.82 163.09 39.47 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.157 -0.474 . . . . 74.409999999999997 110.881 179.964 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 33.5 mt-10 -108.87 149.57 28.93 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.147 -0.478 . . . . 61.009999999999998 110.863 -179.9 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 6.2 mm -131.74 136.27 57.35 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.138 -0.483 . . . . 73.150000000000006 111.098 179.982 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 50.7 m -83.75 130.96 34.95 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.172 -0.467 . . . . 72.209999999999994 111.157 179.947 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 12.6 mt -133.46 156.44 47.73 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.221 -0.445 . . . . 74.200000000000003 110.898 179.962 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -175.09 168.06 3.45 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.207 -0.451 . . . . 74.120000000000005 110.916 179.977 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 1.7 m -60.88 168.21 2.47 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.207 -0.452 . . . . 74.530000000000001 110.859 -179.837 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 35.0 m -80.54 -29.58 12.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.137 -0.483 . . . . 74.310000000000002 111.089 179.943 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -114.56 -169.69 1.59 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.214 -0.448 . . . . 72.329999999999998 110.873 179.944 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 5.1 mmmt -115.64 -21.93 9.45 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.2 -0.455 . . . . 73.530000000000001 110.92 179.998 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . 0.536 ' HA ' ' C ' ' A' ' 59' ' ' PRO . 8.3 pt-20 -113.6 144.49 31.47 Favored Pre-proline 0 C--N 1.33 -0.258 0 CA-C-O 121.65 0.738 . . . . 75.299999999999997 110.913 179.932 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 59' ' ' PRO . . . . . 0.536 ' C ' ' HA ' ' A' ' 58' ' ' GLU . 53.6 Cg_endo -69.77 -7.39 9.97 Favored 'Cis proline' 0 C--N 1.341 0.144 0 C-N-CA 122.646 -1.814 . . . . 75.310000000000002 112.348 -0.036 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 60' ' ' VAL . . . . . 0.47 ' HB ' ' ND2' ' A' ' 88' ' ' ASN . 13.2 m -154.37 -179.92 0.3 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.176 -0.465 . . . . 74.310000000000002 111.122 179.877 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . 0.464 ' O ' ' C ' ' A' ' 62' ' ' SER . 1.2 pt-20 -112.83 -16.25 12.77 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.171 -0.468 . . . . 62.32 110.909 -179.953 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 62' ' ' SER . . . . . 0.464 ' C ' ' O ' ' A' ' 61' ' ' GLU . 0.3 OUTLIER 33.14 91.54 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.126 -0.488 . . . . 71.049999999999997 110.867 -179.825 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 3.9 m -102.93 123.13 45.97 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.106 -0.497 . . . . 62.329999999999998 110.88 -179.832 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 64' ' ' ILE . . . . . . . . . . . . . 13.9 mt -138.15 150.94 24.74 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.142 -0.481 . . . . 74.049999999999997 111.156 179.944 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 39.1 m -120.89 115.17 22.71 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.18 -0.464 . . . . 71.409999999999997 111.124 179.942 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . 0.569 HD23 ' CD1' ' A' ' 83' ' ' PHE . 19.2 mt -90.95 110.77 22.02 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.192 -0.458 . . . . 74.430000000000007 110.944 179.96 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 9.1 t60 -100.92 114.52 28.46 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.21 -0.45 . . . . 74.329999999999998 110.855 179.892 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 68' ' ' PHE . . . . . 0.513 ' CE1' HG23 ' A' ' 114' ' ' ILE . 0.0 OUTLIER -105.17 141.13 37.26 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.195 -0.457 . . . . 73.400000000000006 110.885 -179.953 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -120.5 117.14 26.89 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.133 -0.485 . . . . 64.310000000000002 111.066 179.94 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 70' ' ' MET . . . . . 0.413 ' HE2' ' CG1' ' A' ' 114' ' ' ILE . 1.4 mmt -84.11 93.72 8.19 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.192 -0.458 . . . . 75.129999999999995 110.881 179.986 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -51.13 159.2 1.08 Allowed Pre-proline 0 C--N 1.329 -0.283 0 CA-C-O 121.582 0.706 . . . . 73.010000000000005 111.154 -179.922 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.72 -4.5 14.12 Favored 'Trans proline' 0 C--O 1.231 0.174 0 C-N-CA 122.711 2.274 . . . . 74.209999999999994 112.339 179.973 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 73' ' ' MET . . . . . 0.476 ' O ' ' CB ' ' A' ' 76' ' ' TYR . 0.0 OUTLIER -109.28 -24.21 11.2 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.203 -0.453 . . . . 72.299999999999997 110.852 179.942 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 74' ' ' TYR . . . . . 0.651 ' CD1' ' C ' ' A' ' 74' ' ' TYR . 0.0 OUTLIER -48.29 150.75 2.1 Favored Pre-proline 0 C--N 1.328 -0.342 0 CA-C-O 121.688 0.756 . . . . 74.430000000000007 110.931 -179.859 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 75' ' ' PRO . . . . . 0.562 ' HA ' ' CD2' ' A' ' 74' ' ' TYR . 54.2 Cg_endo -69.72 -11.69 11.89 Favored 'Cis proline' 0 C--N 1.341 0.171 0 C-N-CA 122.698 -1.792 . . . . 73.439999999999998 112.367 -0.124 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 76' ' ' TYR . . . . . 0.476 ' CB ' ' O ' ' A' ' 73' ' ' MET . 10.4 t80 -35.27 -52.88 0.62 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.221 -0.445 . . . . 64.010000000000005 110.969 -179.943 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 53.2 p -101.39 175.3 5.62 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.087 -0.506 . . . . 75.510000000000005 111.139 -179.961 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -98.86 131.36 25.74 Favored Pre-proline 0 C--N 1.329 -0.288 0 CA-C-O 121.554 0.692 . . . . 75.310000000000002 111.079 179.884 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.77 176.84 6.23 Favored 'Trans proline' 0 C--N 1.341 0.171 0 C-N-CA 122.668 2.246 . . . . 74.109999999999999 112.369 179.957 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 2.0 tt0 -111.66 133.44 53.91 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.234 -0.439 . . . . 70.310000000000002 110.951 179.996 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 81' ' ' ILE . . . . . 0.443 ' CG2' HD21 ' A' ' 66' ' ' LEU . 10.0 mm -124.08 127.25 73.37 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.157 -0.474 . . . . 74.340000000000003 111.182 179.988 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . 0.467 ' HG3' ' CD ' ' A' ' 84' ' ' LYS . 7.3 pt-20 -135.07 142.13 46.24 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.22 -0.445 . . . . 74.140000000000001 110.902 179.975 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 83' ' ' PHE . . . . . 0.569 ' CD1' HD23 ' A' ' 66' ' ' LEU . 31.1 m-85 -93.23 140.88 29.04 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.165 -0.471 . . . . 72.400000000000006 110.839 -179.884 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 84' ' ' LYS . . . . . 0.472 ' O ' ' N ' ' A' ' 86' ' ' VAL . 9.7 mmmt -123.66 170.36 10.55 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.137 -0.483 . . . . 74.400000000000006 110.936 179.964 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . 0.452 ' C ' HG22 ' A' ' 86' ' ' VAL . 2.7 m-80 62.92 -73.38 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.22 -0.446 . . . . 73.310000000000002 110.891 179.946 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 86' ' ' VAL . . . . . 0.472 ' N ' ' O ' ' A' ' 84' ' ' LYS . 6.4 m 34.94 90.67 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.131 -0.486 . . . . 75.099999999999994 111.166 179.942 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -101.92 -84.74 0.44 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.17 -0.468 . . . . 72.400000000000006 110.911 -179.954 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 88' ' ' ASN . . . . . 0.47 ' ND2' ' HB ' ' A' ' 60' ' ' VAL . 27.8 m120 -49.5 -40.21 36.72 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.185 -0.461 . . . . 74.349999999999994 110.856 -179.913 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 2.4 p -68.17 139.08 21.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.167 -0.47 . . . . 71.420000000000002 111.119 179.909 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 90' ' ' MET . . . . . . . . . . . . . 5.4 mtm -87.22 -67.43 0.82 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.155 -0.475 . . . . 74.019999999999996 110.892 179.91 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -178.77 -30.44 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.21 -0.45 . . . . 73.329999999999998 110.832 179.954 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -53.79 -42.72 68.63 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.198 -0.456 . . . . 74.510000000000005 110.861 -179.775 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -69.92 -40.11 75.73 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.136 -0.484 . . . . 73.450000000000003 110.94 -179.985 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . 0.466 ' CD2' HG12 ' A' ' 86' ' ' VAL . 0.1 OUTLIER -59.52 -46.3 89.26 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.208 -0.451 . . . . 64.329999999999998 110.95 179.997 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 9.9 mm-40 -64.89 -38.88 92.45 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.129 -0.487 . . . . 75.140000000000001 110.951 179.907 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 96' ' ' MET . . . . . 0.561 ' SD ' ' CE1' ' A' ' 128' ' ' PHE . 19.8 ttp -61.06 -36.96 80.99 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.178 -0.465 . . . . 72.420000000000002 110.856 179.965 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 97' ' ' LEU . . . . . 0.591 ' O ' ' CD1' ' A' ' 101' ' ' PHE . 90.3 mt -62.2 -42.45 99.3 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.221 -0.445 . . . . 75.439999999999998 110.902 -179.942 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 98' ' ' LYS . . . . . 0.567 ' HA ' ' CD2' ' A' ' 101' ' ' PHE . 13.2 mmtm -54.86 -44.56 74.11 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.181 -0.463 . . . . 72.319999999999993 110.872 179.845 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 66.3 m -57.63 -39.23 76.5 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.253 -0.43 . . . . 60.130000000000003 110.836 -179.897 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 3.6 mm-40 -71.36 -26.67 62.9 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.177 -0.465 . . . . 72.400000000000006 110.879 -179.928 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 101' ' ' PHE . . . . . 0.591 ' CD1' ' O ' ' A' ' 97' ' ' LEU . 8.7 m-30 -59.38 -30.36 68.37 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.147 -0.479 . . . . 74.140000000000001 110.937 -179.963 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 1.4 tmpt? -71.56 -40.76 69.77 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.113 -0.494 . . . . 75.530000000000001 110.882 179.98 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 3.2 tmmm? -70.35 -43.25 70.57 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.227 -0.442 . . . . 70.329999999999998 110.88 179.913 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 3.0 mt -62.36 -47.5 92.74 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.202 -0.454 . . . . 74.150000000000006 111.159 179.861 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 105' ' ' HIS . . . . . 0.409 ' O ' ' N ' ' A' ' 109' ' ' ARG . 14.4 t-80 -62.53 -41.78 99.09 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.151 -0.477 . . . . 74.319999999999993 110.874 179.851 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 1.1 t-20 -58.03 -42.35 85.13 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.218 -0.446 . . . . 73.340000000000003 110.902 -179.978 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 8.0 t -77.95 -35.55 50.24 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.157 -0.474 . . . . 71.319999999999993 111.159 -179.996 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 19.8 m -103.97 29.96 5.51 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.21 -0.45 . . . . 73.329999999999998 110.865 -179.871 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 109' ' ' ARG . . . . . 0.409 ' N ' ' O ' ' A' ' 105' ' ' HIS . 26.1 ttt180 -72.13 80.64 0.96 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.133 -0.485 . . . . 75.549999999999997 110.872 -179.956 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 141.15 -9.23 2.72 Favored Glycine 0 N--CA 1.452 -0.254 0 C-N-CA 120.699 -0.763 . . . . 73.400000000000006 112.477 -179.971 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 111' ' ' GLN . . . . . . . . . . . . . 9.2 pt20 -126.44 -161.68 1.08 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.761 0.315 . . . . 52.219999999999999 110.921 -179.873 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 33.7 mt-10 -70.86 134.22 47.12 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.219 -0.446 . . . . 72.530000000000001 110.862 -179.95 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 113' ' ' ILE . . . . . . . . . . . . . 31.1 pt -126.65 -11.31 4.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.149 -0.478 . . . . 73.299999999999997 111.161 179.972 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 114' ' ' ILE . . . . . 0.513 HG23 ' CE1' ' A' ' 68' ' ' PHE . 33.7 mm -61.87 -45.72 98.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.156 -0.475 . . . . 75.519999999999996 111.136 179.855 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 115' ' ' PHE . . . . . . . . . . . . . 13.1 t80 -72.51 -32.65 66.32 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.171 -0.468 . . . . 74.439999999999998 110.932 179.9 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 42.9 mm-40 -67.45 -47.65 69.53 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.105 -0.498 . . . . 74.450000000000003 110.901 -179.971 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 117' ' ' ILE . . . . . 0.523 HD11 ' CG ' ' A' ' 101' ' ' PHE . 0.8 OUTLIER -64.15 -41.92 93.95 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.142 -0.481 . . . . 71.430000000000007 111.111 179.979 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 118' ' ' THR . . . . . 0.478 ' N ' ' CG2' ' A' ' 117' ' ' ILE . 46.7 p -67.85 -42.43 81.37 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.201 -0.454 . . . . 72.319999999999993 111.158 179.958 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 6.8 m -66.14 -43.96 85.54 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.245 -0.434 . . . . 75.25 110.838 -179.842 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -62.11 -49.97 73.8 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.161 -0.472 . . . . 73.329999999999998 110.883 -179.979 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 53.5 p -63.28 -39.3 94.21 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.141 -0.481 . . . . 65.150000000000006 111.169 -179.96 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -64.49 -46.33 83.49 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.201 -0.454 . . . . 73.25 110.945 179.999 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 4.8 pt-20 -70.99 -38.19 72.71 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.219 -0.446 . . . . 73.450000000000003 110.842 -179.968 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 124' ' ' LYS . . . . . 0.439 ' CE ' ' HA ' ' A' ' 124' ' ' LYS . 0.2 OUTLIER -74.51 -29.93 61.59 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.218 -0.446 . . . . 74.530000000000001 110.902 -179.999 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -68.34 -46.36 70.38 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.221 -0.445 . . . . 74.340000000000003 110.92 179.945 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 6.4 m-20 -59.84 -37.43 79.23 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.214 -0.448 . . . . 70.239999999999995 110.85 179.819 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 3.0 mm-40 -60.41 -49.74 76.36 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.198 -0.455 . . . . 74.519999999999996 110.947 -179.931 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 128' ' ' PHE . . . . . 0.561 ' CE1' ' SD ' ' A' ' 96' ' ' MET . 11.3 m-85 -65.85 -58.39 5.71 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.124 -0.489 . . . . 73.099999999999994 110.856 -179.949 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 129' ' ' GLN . . . . . 0.453 ' C ' ' OE1' ' A' ' 129' ' ' GLN . 1.3 tm0? -45.43 -30.91 1.49 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.119 -0.491 . . . . 72.049999999999997 110.922 -179.911 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 130' ' ' ASN . . . . . . . . . . . . . 2.0 t-20 -66.6 -70.67 0.23 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.179 -0.464 . . . . 72.310000000000002 110.846 -179.958 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 4.5 p 177.15 -37.43 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.173 -0.467 . . . . 73.049999999999997 111.127 179.947 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 132' ' ' VAL . . . . . . . . . . . . . 54.5 t 63.31 93.73 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.141 -0.482 . . . . 75.340000000000003 111.123 179.946 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 133' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -157.42 158.89 36.7 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.183 -0.462 . . . . 74.349999999999994 110.881 179.981 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 134' ' ' THR . . . . . . . . . . . . . 75.6 p -76.36 87.23 3.14 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.178 -0.464 . . . . 61.43 111.125 -179.947 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 30.0 tt0 -156.8 -57.67 0.09 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.237 -0.438 . . . . 74.409999999999997 110.924 179.982 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 46.8 t -129.51 131.82 46.73 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.21 -0.45 . . . . 73.109999999999999 110.898 -179.818 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 137' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -165.11 160.28 18.59 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.162 -0.472 . . . . 74.540000000000006 110.87 179.985 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 24.7 tt0 . . . . . 0 C--N 1.33 -0.259 0 CA-C-N 116.145 -0.479 . . . . 75.109999999999999 110.933 179.913 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.231 0.11 0 CA-C-O 120.779 0.323 . . . . 63.439999999999998 110.854 . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -139.73 70.33 1.36 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.26 -0.427 . . . . 74.450000000000003 110.9 -179.787 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 2.0 mm? 61.04 83.14 0.15 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.141 -0.481 . . . . 74.319999999999993 110.949 -179.964 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 25.2 t -151.65 92.3 1.74 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.188 -0.46 . . . . 72.299999999999997 110.864 -179.892 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' HIS . . . . . 0.502 ' CD2' ' O ' ' A' ' 5' ' ' HIS . 0.3 OUTLIER -109.37 125.29 52.22 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.189 -0.46 . . . . 71.099999999999994 110.826 179.967 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -142.19 -48.61 0.36 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.171 -0.468 . . . . 72.400000000000006 110.976 179.981 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 5.5 t -104.55 160.01 15.28 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.158 -0.473 . . . . 64.439999999999998 111.116 179.922 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 44.2 mt -66.13 -23.98 66.59 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.186 -0.461 . . . . 74.510000000000005 110.93 179.921 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -49.96 -30.6 10.72 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.217 -0.447 . . . . 73.140000000000001 110.847 179.863 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 5.1 mm100 -68.09 -40.01 82.72 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.213 -0.449 . . . . 73.049999999999997 110.884 -179.902 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 22.8 m-85 -61.9 -26.95 68.47 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.197 -0.456 . . . . 74.430000000000007 110.88 -179.805 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -58.96 -37.66 77.28 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.158 -0.474 . . . . 72.109999999999999 110.937 -179.958 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 2.2 mm-40 -63.07 -42.9 99.78 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.167 -0.47 . . . . 71.310000000000002 110.877 -179.97 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 3.8 mp -65.92 -41.99 91.03 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.163 -0.471 . . . . 75.230000000000004 111.126 179.989 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 47.5 mt-30 -65.42 -44.02 88.68 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.199 -0.455 . . . . 75.109999999999999 110.897 179.944 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 1.7 t -62.35 -38.29 88.93 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.203 -0.453 . . . . 75.150000000000006 110.924 -179.952 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 1.6 m-20 -58.08 -33.9 69.56 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.126 -0.488 . . . . 75.299999999999997 110.896 -179.921 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 4.1 mt-10 -67.14 -39.1 86.51 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.165 -0.471 . . . . 75.140000000000001 110.859 -179.946 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . 0.415 ' CD2' HG13 ' A' ' 46' ' ' ILE . 8.7 mp -63.87 -51.25 65.48 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.203 -0.453 . . . . 63.229999999999997 110.869 -179.941 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -68.51 -35.84 78.04 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.184 -0.462 . . . . 73.329999999999998 110.886 179.938 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -66.64 -50.36 63.21 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.133 -0.485 . . . . 74.430000000000007 111.137 179.907 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . 0.467 ' N ' HD13 ' A' ' 22' ' ' ILE . 0.8 OUTLIER -73.12 -34.67 45.73 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.235 -0.439 . . . . 75.310000000000002 111.132 179.927 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -52.8 -35.46 56.91 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.17 -0.468 . . . . 64.109999999999999 110.891 179.977 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 53.3 p -67.18 -31.44 71.84 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.155 -0.475 . . . . 72.219999999999999 110.855 -179.782 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . 0.559 HD11 ' CE1' ' A' ' 115' ' ' PHE . 3.5 mt -83.84 -44.16 18.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.134 -0.484 . . . . 75.439999999999998 111.119 179.954 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' TYR . . . . . 0.437 ' CE2' HG21 ' A' ' 50' ' ' ILE . 19.8 m-85 -106.7 45.68 0.97 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.174 -0.466 . . . . 72.319999999999993 110.941 -179.982 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER -46.7 -54.88 8.73 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.117 -0.492 . . . . 74.519999999999996 110.9 179.919 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -96.49 -11.79 25.06 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.198 -0.456 . . . . 75.430000000000007 110.882 179.975 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -101.86 25.79 8.23 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.2 -0.454 . . . . 75.510000000000005 110.875 179.99 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 3.9 t80 -111.41 134.65 52.84 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.205 -0.452 . . . . 74.129999999999995 110.865 -179.9 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 24.2 m -110.7 132.46 54.18 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.138 -0.483 . . . . 70.299999999999997 111.175 -179.947 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -95.73 114.28 26.0 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.228 -0.442 . . . . 75.019999999999996 110.89 179.936 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . 0.546 ' CD1' ' C ' ' A' ' 33' ' ' LEU . 0.2 OUTLIER -124.95 -0.13 7.92 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.174 -0.467 . . . . 62.200000000000003 110.88 -179.891 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' THR . . . . . 0.439 ' N ' HD13 ' A' ' 33' ' ' LEU . 1.4 m -59.9 162.46 5.48 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.187 -0.461 . . . . 71.400000000000006 111.151 179.915 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 42.9 mttt -80.29 45.96 0.79 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.177 -0.465 . . . . 75.120000000000005 110.879 179.948 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 2.9 mmt85 -78.63 -62.05 1.81 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.257 -0.428 . . . . 70.200000000000003 110.904 179.937 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -105.02 31.15 5.02 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.175 -0.466 . . . . 64.340000000000003 110.894 179.967 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -86.17 -173.97 4.83 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.25 -0.432 . . . . 54.109999999999999 110.883 -179.906 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 8.8 m -125.5 95.14 4.35 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.148 -0.478 . . . . 53.100000000000001 110.868 -179.853 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' TRP . . . . . . . . . . . . . 0.1 OUTLIER -168.94 -66.91 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.11 -0.496 . . . . 72.329999999999998 110.883 179.986 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . 0.581 ' O ' ' C ' ' A' ' 42' ' ' LYS . 0.5 OUTLIER 176.18 57.5 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.221 -0.445 . . . . 72.430000000000007 110.857 179.91 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . 0.581 ' C ' ' O ' ' A' ' 41' ' ' ASP . 0.0 OUTLIER 22.07 68.5 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.181 -0.463 . . . . 74.140000000000001 110.927 180.0 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 1.5 tt0 -113.9 62.04 1.03 Allowed Pre-proline 0 C--N 1.329 -0.295 0 CA-C-O 121.571 0.701 . . . . 62.439999999999998 110.875 -179.998 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' PRO . . . . . 0.424 ' HD3' ' C ' ' A' ' 42' ' ' LYS . 54.2 Cg_endo -69.77 130.89 20.13 Favored 'Trans proline' 0 C--N 1.34 0.126 0 C-N-CA 122.718 2.279 . . . . 73.319999999999993 112.342 179.962 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' GLN . . . . . 0.458 ' O ' ' CB ' ' A' ' 46' ' ' ILE . 24.3 tt0 -107.31 11.03 29.56 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.206 -0.452 . . . . 74.140000000000001 110.937 179.989 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . 0.476 HG22 ' N ' ' A' ' 47' ' ' ILE . 0.0 OUTLIER 82.43 -34.19 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.179 -0.464 . . . . 74.310000000000002 111.166 179.978 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . 0.496 HD11 ' N ' ' A' ' 47' ' ' ILE . 0.2 OUTLIER -34.94 148.66 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.181 -0.463 . . . . 61.240000000000002 111.101 179.843 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' PHE . . . . . 0.456 ' HA ' ' CD1' ' A' ' 33' ' ' LEU . 14.3 p90 -159.43 158.0 31.25 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.165 -0.47 . . . . 63.399999999999999 110.909 179.889 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . 0.473 ' CG ' ' HB2' ' A' ' 67' ' ' HIS . 5.7 mt-10 -109.61 160.74 16.01 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.157 -0.474 . . . . 75.040000000000006 110.94 -179.949 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . 0.437 HG21 ' CE2' ' A' ' 26' ' ' TYR . 19.0 mm -137.61 139.04 43.93 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 116.148 -0.478 . . . . 75.310000000000002 111.161 179.987 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 24.1 m -85.26 117.07 23.98 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.186 -0.461 . . . . 75.099999999999994 111.134 179.979 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 17.1 mt -121.59 161.08 23.03 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.234 -0.439 . . . . 75.129999999999995 110.939 179.932 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -177.51 178.79 1.0 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.23 -0.441 . . . . 70.349999999999994 110.915 179.906 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -64.89 175.48 1.5 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.201 -0.454 . . . . 74.209999999999994 110.85 -179.75 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 16.4 m -80.69 -29.45 11.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.155 -0.475 . . . . 70.200000000000003 111.081 179.962 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 1.7 t0 -117.02 -169.13 1.59 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.201 -0.454 . . . . 43.530000000000001 110.901 179.954 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . 0.472 ' CD ' ' N ' ' A' ' 57' ' ' LYS . 0.0 OUTLIER -117.55 -12.62 10.34 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.257 -0.429 . . . . 73.140000000000001 110.88 -179.985 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . 0.531 ' HA ' ' C ' ' A' ' 59' ' ' PRO . 9.8 pt-20 -126.06 150.98 71.0 Favored Pre-proline 0 C--N 1.329 -0.294 0 CA-C-O 121.639 0.733 . . . . 73.420000000000002 110.924 179.895 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 59' ' ' PRO . . . . . 0.531 ' C ' ' HA ' ' A' ' 58' ' ' GLU . 53.7 Cg_endo -69.77 -5.94 9.17 Favored 'Cis proline' 0 C--N 1.342 0.191 0 C-N-CA 122.686 -1.798 . . . . 75.230000000000004 112.349 0.041 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 60' ' ' VAL . . . . . 0.549 ' CG2' ' CG ' ' A' ' 129' ' ' GLN . 33.4 m -140.75 172.32 11.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.25 -0.432 . . . . 74.200000000000003 111.165 179.93 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . 0.447 ' O ' ' C ' ' A' ' 62' ' ' SER . 5.4 tt0 -102.45 -21.97 14.14 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.163 -0.471 . . . . 74.430000000000007 110.86 -179.979 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 62' ' ' SER . . . . . 0.447 ' C ' ' O ' ' A' ' 61' ' ' GLU . 41.7 m 34.0 90.78 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.181 -0.463 . . . . 55.009999999999998 110.889 -179.784 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 10.4 p -118.61 123.05 44.04 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.124 -0.489 . . . . 64.209999999999994 110.869 -179.836 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 64' ' ' ILE . . . . . 0.457 HD13 ' CG2' ' A' ' 89' ' ' VAL . 30.1 mt -133.05 139.31 49.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.093 -0.503 . . . . 75.319999999999993 111.125 179.976 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 65' ' ' THR . . . . . 0.45 ' N ' HG22 ' A' ' 64' ' ' ILE . 20.4 m -104.53 116.87 32.85 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.176 -0.465 . . . . 74.150000000000006 111.157 179.959 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . 0.556 ' HB3' ' CE2' ' A' ' 68' ' ' PHE . 1.4 mp -94.48 109.97 21.81 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.247 -0.433 . . . . 75.409999999999997 110.915 179.977 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 67' ' ' HIS . . . . . 0.485 ' CE1' HD21 ' A' ' 33' ' ' LEU . 1.9 t60 -97.4 109.96 22.61 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.18 -0.464 . . . . 73.140000000000001 110.833 179.875 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 68' ' ' PHE . . . . . 0.556 ' CE2' ' HB3' ' A' ' 66' ' ' LEU . 0.0 OUTLIER -105.11 139.97 38.98 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.206 -0.452 . . . . 73.5 110.839 -179.896 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -123.87 128.39 49.42 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.148 -0.478 . . . . 64.519999999999996 111.07 179.943 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 70' ' ' MET . . . . . 0.425 ' CE ' ' CD1' ' A' ' 114' ' ' ILE . 0.0 OUTLIER -96.32 103.42 15.32 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.23 -0.441 . . . . 65.329999999999998 110.882 179.953 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -57.33 161.17 5.82 Favored Pre-proline 0 C--N 1.33 -0.272 0 CA-C-O 121.564 0.697 . . . . 72.519999999999996 111.134 -179.935 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.8 -4.19 13.55 Favored 'Trans proline' 0 C--N 1.342 0.195 0 C-N-CA 122.692 2.261 . . . . 75.140000000000001 112.346 179.93 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 73' ' ' MET . . . . . 0.5 ' O ' ' CB ' ' A' ' 76' ' ' TYR . 0.0 OUTLIER -111.85 -24.26 10.09 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.199 -0.455 . . . . 74.319999999999993 110.891 179.92 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 74' ' ' TYR . . . . . 0.635 ' CD1' ' C ' ' A' ' 74' ' ' TYR . 0.0 OUTLIER -47.98 149.9 2.25 Favored Pre-proline 0 C--N 1.329 -0.319 0 CA-C-O 121.638 0.732 . . . . 75.439999999999998 110.924 -179.865 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 75' ' ' PRO . . . . . 0.559 ' HA ' ' CD2' ' A' ' 74' ' ' TYR . 53.7 Cg_endo -69.79 -12.34 12.22 Favored 'Cis proline' 0 C--N 1.341 0.165 0 C-N-CA 122.696 -1.793 . . . . 75.120000000000005 112.302 -0.041 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 76' ' ' TYR . . . . . 0.5 ' CB ' ' O ' ' A' ' 73' ' ' MET . 9.4 t80 -33.95 -47.31 0.26 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.264 -0.425 . . . . 72.040000000000006 110.934 -179.925 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 72.0 p -105.8 179.68 4.2 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.121 -0.491 . . . . 70.319999999999993 111.105 -179.964 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -100.74 129.95 26.44 Favored Pre-proline 0 C--N 1.329 -0.309 0 CA-C-O 121.638 0.733 . . . . 75.030000000000001 111.108 179.84 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 79' ' ' PRO . . . . . 0.417 ' HG3' ' CD1' ' A' ' 113' ' ' ILE . 53.9 Cg_endo -69.75 -175.18 1.07 Allowed 'Trans proline' 0 C--N 1.342 0.203 0 C-N-CA 122.685 2.256 . . . . 72.310000000000002 112.353 179.992 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . 0.411 ' HG3' ' N ' ' A' ' 81' ' ' ILE . 0.4 OUTLIER -124.18 141.2 52.26 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.26 -0.427 . . . . 73.230000000000004 110.871 -179.981 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 81' ' ' ILE . . . . . 0.411 ' N ' ' HG3' ' A' ' 80' ' ' GLU . 8.0 mm -133.02 143.89 38.12 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.141 -0.481 . . . . 74.409999999999997 111.096 179.983 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . 0.497 ' HG3' ' CD ' ' A' ' 84' ' ' LYS . 4.4 pt-20 -149.02 143.65 26.22 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.156 -0.475 . . . . 70.430000000000007 110.916 179.906 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 83' ' ' PHE . . . . . 0.564 ' CE1' HD13 ' A' ' 97' ' ' LEU . 10.3 m-85 -96.21 136.85 36.13 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.167 -0.469 . . . . 74.310000000000002 110.898 -179.904 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 84' ' ' LYS . . . . . 0.497 ' CD ' ' HG3' ' A' ' 82' ' ' GLU . 12.8 mmmt -123.99 169.02 12.05 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.201 -0.454 . . . . 73.329999999999998 110.941 179.964 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . 0.56 ' N ' HD21 ' A' ' 85' ' ' ASN . 1.0 OUTLIER 64.26 -72.46 0.06 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.249 -0.432 . . . . 74.540000000000006 110.888 179.942 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 86' ' ' VAL . . . . . 0.455 ' C ' ' O ' ' A' ' 85' ' ' ASN . 6.8 m 33.76 90.84 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.18 -0.464 . . . . 74.140000000000001 111.101 179.904 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -99.95 -53.65 3.1 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.173 -0.467 . . . . 71.209999999999994 110.934 179.995 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 20.9 t30 -85.4 20.88 1.89 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.206 -0.452 . . . . 63.340000000000003 110.866 -179.954 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 89' ' ' VAL . . . . . 0.457 ' CG2' HD13 ' A' ' 64' ' ' ILE . 2.8 t -130.81 154.62 40.96 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.175 -0.466 . . . . 74.319999999999993 111.133 179.918 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 90' ' ' MET . . . . . . . . . . . . . 3.0 mtm -108.31 -69.44 0.85 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.19 -0.459 . . . . 73.310000000000002 110.933 179.874 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 9.8 p-10 -170.82 -33.41 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.183 -0.462 . . . . 72.310000000000002 110.88 179.959 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 4.1 m -54.34 -46.47 72.93 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.197 -0.456 . . . . 74.230000000000004 110.869 -179.788 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 93' ' ' GLN . . . . . 0.424 ' HB2' ' CG1' ' A' ' 89' ' ' VAL . 4.1 mp0 -68.74 -38.78 80.39 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.131 -0.486 . . . . 74.349999999999994 110.897 -179.942 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 8.2 mp -57.86 -49.16 77.63 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.185 -0.461 . . . . 74.439999999999998 110.931 179.977 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 74.2 mt-30 -66.08 -37.33 85.53 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.144 -0.48 . . . . 74.140000000000001 110.9 179.956 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 96' ' ' MET . . . . . . . . . . . . . 32.8 ttp -59.76 -41.27 90.66 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.205 -0.452 . . . . 74.209999999999994 110.884 179.958 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 97' ' ' LEU . . . . . 0.564 HD13 ' CE1' ' A' ' 83' ' ' PHE . 87.6 mt -61.76 -44.8 96.18 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.21 -0.45 . . . . 75.129999999999995 110.945 -179.982 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 98' ' ' LYS . . . . . 0.472 ' HA ' ' CD2' ' A' ' 101' ' ' PHE . 5.5 mmtp -58.47 -34.98 71.48 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.169 -0.469 . . . . 74.239999999999995 110.893 179.81 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -63.89 -42.76 97.4 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.183 -0.462 . . . . 74.219999999999999 110.86 -179.847 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 69.5 mm-40 -71.0 -24.56 62.41 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.114 -0.494 . . . . 73.540000000000006 110.837 -179.948 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 101' ' ' PHE . . . . . 0.564 ' CD1' ' O ' ' A' ' 97' ' ' LEU . 10.5 m-30 -59.57 -38.23 80.61 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.146 -0.479 . . . . 75.519999999999996 110.864 -179.905 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.28 -44.0 95.72 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.166 -0.47 . . . . 75.019999999999996 110.867 -179.988 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -67.36 -42.88 82.73 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.247 -0.433 . . . . 74.439999999999998 110.888 179.881 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 104' ' ' ILE . . . . . 0.479 HD11 ' CG ' ' A' ' 120' ' ' PHE . 3.4 mt -61.82 -47.68 92.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.245 -0.434 . . . . 73.120000000000005 111.158 179.855 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 105' ' ' HIS . . . . . 0.454 ' O ' ' N ' ' A' ' 109' ' ' ARG . 64.6 t-80 -62.97 -41.2 99.47 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.135 -0.484 . . . . 65.150000000000006 110.888 179.864 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 1.4 m-80 -56.82 -40.47 76.06 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.199 -0.455 . . . . 73.530000000000001 110.87 -179.941 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 107' ' ' THR . . . . . 0.413 ' CG2' ' O ' ' A' ' 104' ' ' ILE . 5.2 t -81.26 -26.31 35.88 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.212 -0.449 . . . . 74.409999999999997 111.112 -179.971 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 39.3 p -111.31 26.84 10.26 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.251 -0.431 . . . . 64.219999999999999 110.848 -179.813 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 109' ' ' ARG . . . . . 0.454 ' N ' ' O ' ' A' ' 105' ' ' HIS . 13.4 ttt-85 -68.34 76.55 0.26 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.154 -0.476 . . . . 75.310000000000002 110.868 -179.928 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 145.09 -20.22 1.94 Allowed Glycine 0 N--CA 1.451 -0.343 0 C-N-CA 120.78 -0.724 . . . . 72.019999999999996 112.501 -179.986 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 111' ' ' GLN . . . . . . . . . . . . . 7.3 pt20 -114.54 -170.2 1.69 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.749 0.309 . . . . 74.420000000000002 110.91 -179.877 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 32.8 mt-10 -62.3 128.92 38.34 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.204 -0.453 . . . . 75.420000000000002 110.874 -179.962 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 113' ' ' ILE . . . . . 0.417 ' CD1' ' HG3' ' A' ' 79' ' ' PRO . 21.2 pt -120.67 -15.08 7.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.133 -0.485 . . . . 73.439999999999998 111.098 179.999 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 114' ' ' ILE . . . . . 0.494 ' O ' ' CG2' ' A' ' 118' ' ' THR . 35.0 mm -60.11 -43.64 93.33 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.175 -0.466 . . . . 74.310000000000002 111.166 179.816 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 115' ' ' PHE . . . . . 0.559 ' CE1' HD11 ' A' ' 25' ' ' ILE . 22.0 t80 -72.31 -35.35 68.61 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.176 -0.465 . . . . 65.340000000000003 110.925 179.929 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 56.6 mm-40 -67.89 -47.62 68.3 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.096 -0.502 . . . . 74.430000000000007 110.929 -179.97 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 117' ' ' ILE . . . . . 0.562 HD12 ' CD2' ' A' ' 101' ' ' PHE . 1.1 tt -64.27 -40.45 89.11 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.133 -0.485 . . . . 74.299999999999997 111.15 179.947 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 118' ' ' THR . . . . . 0.494 ' CG2' ' O ' ' A' ' 114' ' ' ILE . 62.5 p -67.43 -43.38 81.32 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.181 -0.463 . . . . 74.019999999999996 111.149 179.978 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 1.7 t -67.83 -32.02 72.27 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.189 -0.459 . . . . 70.010000000000005 110.841 -179.867 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 120' ' ' PHE . . . . . 0.479 ' CG ' HD11 ' A' ' 104' ' ' ILE . 0.4 OUTLIER -76.01 -39.64 55.32 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.155 -0.475 . . . . 75.5 110.893 -179.932 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 121' ' ' THR . . . . . 0.437 ' CG2' HD23 ' A' ' 66' ' ' LEU . 14.8 p -69.36 -41.65 76.29 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.14 -0.482 . . . . 75.510000000000005 111.134 -179.933 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 122' ' ' GLN . . . . . 0.442 ' CG ' ' N ' ' A' ' 123' ' ' GLU . 9.0 pt20 -68.25 -46.97 69.01 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.227 -0.442 . . . . 75.510000000000005 110.904 -179.976 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 123' ' ' GLU . . . . . 0.442 ' N ' ' CG ' ' A' ' 122' ' ' GLN . 5.7 pt-20 -60.36 -36.61 78.41 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.197 -0.456 . . . . 73.25 110.869 -179.916 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 124' ' ' LYS . . . . . 0.457 ' CE ' ' HA ' ' A' ' 124' ' ' LYS . 0.0 OUTLIER -77.03 -38.54 52.62 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.146 -0.479 . . . . 74.420000000000002 110.921 179.969 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 125' ' ' LEU . . . . . 0.412 ' CD1' ' HB3' ' A' ' 62' ' ' SER . 2.3 tp -67.69 -43.2 80.69 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.203 -0.453 . . . . 74.420000000000002 110.938 179.927 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -63.19 -43.13 99.08 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.157 -0.474 . . . . 75.120000000000005 110.836 179.875 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 127' ' ' GLU . . . . . 0.457 ' HG3' ' N ' ' A' ' 128' ' ' PHE . 0.0 OUTLIER -67.22 -29.25 68.86 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.208 -0.451 . . . . 73.530000000000001 110.915 -179.912 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 128' ' ' PHE . . . . . 0.457 ' N ' ' HG3' ' A' ' 127' ' ' GLU . 0.2 OUTLIER -73.77 -59.72 2.59 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.117 -0.492 . . . . 73.439999999999998 110.916 -179.966 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 129' ' ' GLN . . . . . 0.549 ' CG ' ' CG2' ' A' ' 60' ' ' VAL . 1.5 tm0? -39.54 -41.25 0.98 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.13 -0.487 . . . . 74.409999999999997 110.921 -179.97 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 130' ' ' ASN . . . . . . . . . . . . . 1.4 t-20 -60.85 -41.71 96.41 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.183 -0.462 . . . . 54.439999999999998 110.896 -179.95 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 131' ' ' VAL . . . . . 0.437 ' N ' ' O ' ' A' ' 128' ' ' PHE . 10.0 m -128.53 83.31 0.77 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.166 -0.47 . . . . 73.109999999999999 111.15 179.903 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 132' ' ' VAL . . . . . 0.402 ' CG2' ' O ' ' A' ' 128' ' ' PHE . 41.2 t -116.12 145.81 21.37 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.152 -0.476 . . . . 74.409999999999997 111.14 179.941 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 133' ' ' ASN . . . . . . . . . . . . . 7.5 p-10 -52.81 122.43 9.15 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.197 -0.456 . . . . 73.530000000000001 110.91 179.983 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 134' ' ' THR . . . . . . . . . . . . . 24.9 m 47.56 98.52 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.198 -0.456 . . . . 53.130000000000003 111.098 179.973 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -59.97 163.11 4.92 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.253 -0.431 . . . . 75.200000000000003 110.912 179.975 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -153.87 162.04 41.54 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.212 -0.449 . . . . 75.439999999999998 110.892 -179.851 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 137' ' ' LEU . . . . . . . . . . . . . 3.1 mt -127.32 142.17 51.52 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.165 -0.47 . . . . 74.439999999999998 110.886 -179.956 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 3.8 tt0 . . . . . 0 C--N 1.33 -0.278 0 CA-C-N 116.202 -0.454 . . . . 75.239999999999995 110.899 179.947 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 2.9 mpp? . . . . . 0 C--O 1.231 0.091 0 CA-C-O 120.794 0.33 . . . . 73.049999999999997 110.877 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 32.7 p -160.28 120.63 2.92 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.215 -0.448 . . . . 74.299999999999997 110.887 -179.782 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 10.7 tp 68.44 120.43 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.169 -0.469 . . . . 75.140000000000001 110.884 -179.992 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 16.8 t 178.31 58.03 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.199 -0.455 . . . . 64.540000000000006 110.843 -179.93 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' HIS . . . . . 0.45 ' O ' ' C ' ' A' ' 6' ' ' LEU . 6.7 m170 69.02 92.11 0.09 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.164 -0.471 . . . . 74.019999999999996 110.836 179.975 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . 0.45 ' C ' ' O ' ' A' ' 5' ' ' HIS . 0.5 OUTLIER 34.4 52.08 0.5 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.182 -0.463 . . . . 73.319999999999993 110.947 -179.966 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 10.0 t -79.68 175.83 10.26 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.199 -0.455 . . . . 72.200000000000003 111.131 -180.0 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 36.6 mt -54.39 -22.66 12.96 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.236 -0.438 . . . . 75.430000000000007 110.965 179.947 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 33.6 t70 -54.89 -30.04 57.14 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.191 -0.459 . . . . 72.439999999999998 110.819 179.843 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . 0.406 ' HA ' ' NE2' ' A' ' 10' ' ' GLN . 4.2 mm-40 -66.27 -33.81 76.59 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.207 -0.451 . . . . 73.120000000000005 110.916 -179.915 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' TYR . . . . . 0.543 ' CE1' ' HD2' ' A' ' 75' ' ' PRO . 14.1 m-85 -64.37 -26.93 68.68 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.211 -0.45 . . . . 74.120000000000005 110.904 -179.864 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -59.58 -37.01 77.39 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.15 -0.477 . . . . 75.109999999999999 110.899 -179.854 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 2.9 mm-40 -61.45 -45.94 92.17 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.152 -0.476 . . . . 74.239999999999995 110.92 179.976 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 4.9 mp -67.79 -45.05 85.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.141 -0.481 . . . . 75.209999999999994 111.163 179.945 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . 0.498 ' NE2' ' O ' ' A' ' 71' ' ' THR . 86.8 mt-30 -61.29 -45.36 94.8 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.124 -0.489 . . . . 74.310000000000002 110.907 179.966 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 2.8 t -61.18 -41.92 97.64 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.182 -0.463 . . . . 75.510000000000005 110.891 -179.941 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 2.5 m-20 -57.63 -33.51 68.34 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.196 -0.456 . . . . 74.099999999999994 110.913 -179.919 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . 0.417 ' HG2' ' CD1' ' A' ' 114' ' ' ILE . 2.9 mt-10 -65.51 -41.2 93.45 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.181 -0.463 . . . . 75.409999999999997 110.897 179.987 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . 0.563 HD13 ' CD1' ' A' ' 48' ' ' PHE . 8.9 mp -61.74 -51.84 66.72 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.109 -0.496 . . . . 74.150000000000006 110.921 -179.958 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -68.85 -37.41 79.11 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.192 -0.458 . . . . 74.25 110.901 179.912 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -61.01 -50.58 72.77 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.162 -0.472 . . . . 50.310000000000002 111.109 179.916 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . 0.465 HD11 ' N ' ' A' ' 22' ' ' ILE . 0.6 OUTLIER -75.0 -36.09 37.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.236 -0.438 . . . . 73.299999999999997 111.168 179.968 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 18.7 mtp180 -52.63 -34.22 50.3 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.16 -0.473 . . . . 74.230000000000004 110.858 179.973 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -66.29 -33.55 75.99 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.219 -0.446 . . . . 65.109999999999999 110.847 -179.782 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . 0.565 HD13 ' CE1' ' A' ' 115' ' ' PHE . 3.3 mt -81.71 -44.9 20.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.12 -0.491 . . . . 73.219999999999999 111.139 179.97 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 21.4 m-85 -109.01 46.03 1.0 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.182 -0.463 . . . . 74.120000000000005 110.883 -179.948 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 3.2 mtm -41.7 -59.32 1.69 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.138 -0.483 . . . . 71.549999999999997 110.902 179.895 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 1.5 t70 -84.38 -25.12 29.35 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.197 -0.456 . . . . 73.129999999999995 110.834 179.968 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -85.38 30.75 0.6 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.234 -0.439 . . . . 73.420000000000002 110.851 -179.998 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 6.0 t80 -117.14 139.47 50.7 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.205 -0.452 . . . . 73.430000000000007 110.835 -179.879 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 60.5 m -118.33 135.12 54.5 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.092 -0.504 . . . . 64.200000000000003 111.168 -179.916 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 12.6 t70 -99.92 117.17 33.66 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.256 -0.429 . . . . 75.310000000000002 110.891 179.872 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . 0.492 ' CD2' ' HA ' ' A' ' 48' ' ' PHE . 1.2 pt? -118.58 -28.69 5.61 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.182 -0.463 . . . . 73.409999999999997 110.935 -179.98 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' THR . . . . . 0.418 ' N ' HD22 ' A' ' 33' ' ' LEU . 0.2 OUTLIER -41.39 161.18 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.209 -0.45 . . . . 72.239999999999995 111.128 179.957 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . 0.441 ' O ' ' CD ' ' A' ' 35' ' ' LYS . 0.0 OUTLIER -75.6 50.39 0.54 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.168 -0.469 . . . . 75.409999999999997 110.927 179.877 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 1.8 mmt180 -72.22 -68.92 0.43 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.214 -0.448 . . . . 71.129999999999995 110.93 179.983 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 3.8 mmtp -118.79 39.61 3.47 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.205 -0.452 . . . . 71.140000000000001 110.9 179.917 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -121.51 119.41 31.9 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.216 -0.447 . . . . 73.129999999999995 110.842 -179.903 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 14.6 m -87.53 99.49 12.07 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.132 -0.485 . . . . 73.310000000000002 110.843 -179.823 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' TRP . . . . . . . . . . . . . 57.8 t-105 -172.58 -44.48 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.17 -0.468 . . . . 74.450000000000003 110.911 -179.991 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 26.0 t0 -139.37 146.43 40.2 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.246 -0.433 . . . . 75.120000000000005 110.887 179.928 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 9.6 mttt -123.93 60.21 1.12 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.196 -0.457 . . . . 71.420000000000002 110.888 -179.986 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 29.2 mt-30 -153.31 73.09 6.89 Favored Pre-proline 0 C--N 1.329 -0.306 0 CA-C-O 121.61 0.719 . . . . 75.519999999999996 110.941 179.952 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.78 163.15 39.36 Favored 'Trans proline' 0 C--N 1.341 0.179 0 C-N-CA 122.646 2.23 . . . . 74.430000000000007 112.354 -179.983 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' GLN . . . . . 0.407 ' O ' ' CB ' ' A' ' 46' ' ' ILE . 11.7 tt0 -140.29 10.45 2.32 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.231 -0.44 . . . . 74.230000000000004 110.911 -179.982 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . 0.407 ' CB ' ' O ' ' A' ' 45' ' ' GLN . 0.0 OUTLIER 78.71 -7.87 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.225 -0.443 . . . . 75.129999999999995 111.132 179.976 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . 0.48 HG22 ' CB ' ' A' ' 69' ' ' ALA . 0.2 OUTLIER -53.12 147.1 2.27 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.18 -0.464 . . . . 73.239999999999995 111.119 179.829 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' PHE . . . . . 0.563 ' CD1' HD13 ' A' ' 19' ' ' LEU . 25.6 p90 -153.06 153.03 32.03 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.178 -0.464 . . . . 73.049999999999997 110.878 179.954 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 12.4 mt-10 -108.36 150.83 26.82 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.158 -0.474 . . . . 73.409999999999997 110.904 -179.954 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . 0.429 HG23 ' N ' ' A' ' 51' ' ' THR . 11.5 mm -132.43 138.58 51.89 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.127 -0.488 . . . . 74.129999999999995 111.145 -179.991 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 51' ' ' THR . . . . . 0.429 ' N ' HG23 ' A' ' 50' ' ' ILE . 96.8 m -85.86 127.36 34.56 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.177 -0.465 . . . . 70.239999999999995 111.141 179.984 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 17.7 mt -128.02 164.5 22.22 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.19 -0.459 . . . . 73.099999999999994 110.883 179.965 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -178.62 172.21 1.44 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.134 -0.484 . . . . 71.540000000000006 110.886 179.933 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -66.53 173.71 3.21 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.187 -0.461 . . . . 74.209999999999994 110.836 -179.798 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 29.0 m -85.22 -27.35 6.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.146 -0.479 . . . . 74.340000000000003 111.14 179.92 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -114.72 -172.7 2.17 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.13 -0.486 . . . . 73.420000000000002 110.859 179.938 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 4.1 mmmm -116.24 -22.4 8.88 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.177 -0.465 . . . . 73.140000000000001 110.897 179.979 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . 0.53 ' HA ' ' C ' ' A' ' 59' ' ' PRO . 1.5 pt-20 -113.06 143.05 28.41 Favored Pre-proline 0 C--N 1.329 -0.31 0 CA-C-O 121.701 0.762 . . . . 75.450000000000003 110.899 179.931 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 59' ' ' PRO . . . . . 0.53 ' C ' ' HA ' ' A' ' 58' ' ' GLU . 53.5 Cg_endo -69.79 -13.2 12.43 Favored 'Cis proline' 0 C--N 1.342 0.189 0 C-N-CA 122.624 -1.823 . . . . 72.439999999999998 112.31 0.033 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 60' ' ' VAL . . . . . 0.474 HG22 ' CG ' ' A' ' 129' ' ' GLN . 8.5 m -149.49 176.26 0.92 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.263 -0.426 . . . . 71.230000000000004 111.076 179.939 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . 0.458 ' O ' ' C ' ' A' ' 62' ' ' SER . 0.9 OUTLIER -112.46 -16.24 12.93 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.128 -0.487 . . . . 75.540000000000006 110.882 179.994 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 62' ' ' SER . . . . . 0.461 ' CB ' HD23 ' A' ' 125' ' ' LEU . 0.4 OUTLIER 33.67 91.12 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.174 -0.467 . . . . 72.349999999999994 110.849 -179.806 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 32.8 t -103.31 122.79 45.53 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.143 -0.48 . . . . 75.340000000000003 110.821 -179.803 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 64' ' ' ILE . . . . . . . . . . . . . 17.7 mt -137.19 143.05 35.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.164 -0.471 . . . . 72.439999999999998 111.121 179.937 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 15.4 m -107.84 115.03 29.4 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.207 -0.451 . . . . 75.120000000000005 111.13 179.945 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . 0.567 HD21 ' CE1' ' A' ' 83' ' ' PHE . 12.3 mt -91.02 110.14 21.4 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.218 -0.446 . . . . 75.420000000000002 110.88 179.962 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 8.7 t60 -100.78 114.64 28.6 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.191 -0.459 . . . . 72.150000000000006 110.866 179.849 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 68' ' ' PHE . . . . . 0.452 ' CE1' HG21 ' A' ' 114' ' ' ILE . 0.0 OUTLIER -103.66 139.79 38.46 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.254 -0.43 . . . . 75.219999999999999 110.909 -179.942 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . 0.48 ' CB ' HG22 ' A' ' 47' ' ' ILE . . . -120.04 120.81 37.37 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.182 -0.463 . . . . 73.239999999999995 111.131 179.933 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 70' ' ' MET . . . . . 0.497 ' HE1' ' CD1' ' A' ' 114' ' ' ILE . 12.6 mmt -85.45 104.3 15.12 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.241 -0.436 . . . . 72.150000000000006 110.875 179.995 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 71' ' ' THR . . . . . 0.498 ' O ' ' NE2' ' A' ' 15' ' ' GLN . 0.7 OUTLIER -59.93 158.12 26.83 Favored Pre-proline 0 C--N 1.329 -0.303 0 CA-C-O 121.593 0.711 . . . . 64.019999999999996 111.163 -179.938 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.76 1.05 4.78 Favored 'Trans proline' 0 C--N 1.342 0.213 0 C-N-CA 122.646 2.231 . . . . 55.549999999999997 112.356 179.94 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 73' ' ' MET . . . . . 0.479 ' O ' ' CB ' ' A' ' 76' ' ' TYR . 0.5 OUTLIER -116.67 -25.57 7.32 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.248 -0.433 . . . . 74.430000000000007 110.894 179.934 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 74' ' ' TYR . . . . . 0.62 ' CD1' ' C ' ' A' ' 74' ' ' TYR . 0.1 OUTLIER -46.6 147.61 2.02 Favored Pre-proline 0 C--N 1.329 -0.324 0 CA-C-O 121.664 0.745 . . . . 75.25 110.956 -179.933 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 75' ' ' PRO . . . . . 0.545 ' C ' ' HA ' ' A' ' 74' ' ' TYR . 53.4 Cg_endo -69.77 -14.86 12.55 Favored 'Cis proline' 0 C--N 1.342 0.184 0 C-N-CA 122.636 -1.818 . . . . 75.200000000000003 112.333 -0.049 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 76' ' ' TYR . . . . . 0.479 ' CB ' ' O ' ' A' ' 73' ' ' MET . 9.0 t80 -34.16 -45.33 0.21 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.202 -0.454 . . . . 72.219999999999999 110.938 -179.941 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 51.9 p -114.97 163.45 15.56 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.099 -0.5 . . . . 73.319999999999993 111.163 -179.976 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -85.7 132.64 43.72 Favored Pre-proline 0 C--N 1.329 -0.326 0 CA-C-O 121.585 0.707 . . . . 72.340000000000003 111.09 179.865 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 79' ' ' PRO . . . . . 0.44 ' HG3' ' CD1' ' A' ' 113' ' ' ILE . 54.0 Cg_endo -69.71 -170.72 0.41 Allowed 'Trans proline' 0 C--N 1.341 0.165 0 C-N-CA 122.714 2.276 . . . . 75.129999999999995 112.367 -179.993 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . 0.421 ' HG3' ' N ' ' A' ' 81' ' ' ILE . 0.3 OUTLIER -124.36 140.11 53.26 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.242 -0.435 . . . . 73.319999999999993 110.924 179.955 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 81' ' ' ILE . . . . . 0.421 ' N ' ' HG3' ' A' ' 80' ' ' GLU . 6.4 mm -130.42 137.07 57.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.127 -0.488 . . . . 64.519999999999996 111.152 179.957 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . 0.467 ' HG3' ' CD ' ' A' ' 84' ' ' LYS . 6.0 pt-20 -140.04 144.09 36.71 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.174 -0.466 . . . . 74.150000000000006 110.888 179.942 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 83' ' ' PHE . . . . . 0.567 ' CE1' HD21 ' A' ' 66' ' ' LEU . 58.6 m-85 -94.3 140.63 29.54 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.142 -0.481 . . . . 72.409999999999997 110.892 -179.918 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 84' ' ' LYS . . . . . 0.471 ' O ' ' N ' ' A' ' 86' ' ' VAL . 10.4 mmmt -124.2 169.62 11.55 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.172 -0.467 . . . . 72.120000000000005 110.904 179.932 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . 0.572 ' N ' HD21 ' A' ' 85' ' ' ASN . 1.0 OUTLIER 61.78 -74.69 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.216 -0.447 . . . . 64.450000000000003 110.95 179.982 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 86' ' ' VAL . . . . . 0.471 ' N ' ' O ' ' A' ' 84' ' ' LYS . 3.4 m 41.73 90.87 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.167 -0.469 . . . . 74.430000000000007 111.147 179.896 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 87' ' ' GLN . . . . . 0.472 ' NE2' ' OD1' ' A' ' 88' ' ' ASN . 0.2 OUTLIER -104.06 -95.92 0.32 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.167 -0.47 . . . . 74.540000000000006 110.989 179.957 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 88' ' ' ASN . . . . . 0.472 ' OD1' ' NE2' ' A' ' 87' ' ' GLN . 32.0 m120 -45.76 -36.04 4.79 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.183 -0.462 . . . . 63.450000000000003 110.891 -180.0 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 3.2 p -63.94 149.97 10.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.16 -0.473 . . . . 63.229999999999997 111.106 179.942 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 90' ' ' MET . . . . . . . . . . . . . 29.8 mtm -98.75 -74.29 0.59 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.194 -0.457 . . . . 74.319999999999993 110.887 179.914 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 7.7 p-10 176.4 -32.34 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.276 -0.42 . . . . 71.329999999999998 110.85 179.932 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -54.43 -45.86 73.12 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.213 -0.449 . . . . 73.400000000000006 110.823 -179.759 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -70.84 -38.97 73.22 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.165 -0.47 . . . . 74.439999999999998 110.893 -179.928 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . 0.447 HD21 ' CG ' ' A' ' 83' ' ' PHE . 21.4 mt -58.87 -47.43 84.93 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.208 -0.451 . . . . 73.510000000000005 110.912 -179.979 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 26.4 mt-30 -61.06 -34.56 75.08 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.166 -0.47 . . . . 71.329999999999998 110.91 179.941 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 96' ' ' MET . . . . . 0.498 ' SD ' ' CE1' ' A' ' 128' ' ' PHE . 9.2 ttp -61.25 -37.94 84.89 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.212 -0.449 . . . . 75.239999999999995 110.838 -179.992 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 97' ' ' LEU . . . . . 0.571 ' O ' ' CD1' ' A' ' 101' ' ' PHE . 27.8 mt -64.32 -43.07 95.8 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.224 -0.444 . . . . 74.230000000000004 110.93 179.994 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 5.0 mmtp -55.06 -38.51 68.12 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.227 -0.442 . . . . 73.409999999999997 110.91 179.82 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -70.19 -42.14 72.8 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.196 -0.456 . . . . 73.129999999999995 110.854 -179.903 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 6.0 mt-10 -66.69 -24.3 66.24 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.149 -0.478 . . . . 62.310000000000002 110.899 -179.953 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 101' ' ' PHE . . . . . 0.571 ' CD1' ' O ' ' A' ' 97' ' ' LEU . 9.4 m-30 -60.1 -31.12 69.74 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.138 -0.483 . . . . 75.439999999999998 110.905 -179.95 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.01 -40.76 87.37 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.148 -0.478 . . . . 71.109999999999999 110.877 179.948 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 1.6 mppt? -67.9 -42.95 80.39 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.226 -0.443 . . . . 74.400000000000006 110.92 179.853 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 2.3 mt -62.17 -47.59 92.39 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.218 -0.446 . . . . 73.219999999999999 111.1 179.879 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 105' ' ' HIS . . . . . . . . . . . . . 7.7 t-80 -62.93 -42.83 99.93 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.16 -0.473 . . . . 75.319999999999993 110.815 179.94 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -56.49 -41.76 77.18 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.218 -0.446 . . . . 74.439999999999998 110.927 -179.954 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 9.3 t -81.74 -23.63 36.58 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.147 -0.479 . . . . 74.230000000000004 111.157 -179.999 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 24.2 m -107.93 26.39 10.41 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.236 -0.438 . . . . 74.200000000000003 110.883 -179.89 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -65.73 86.04 0.08 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.113 -0.494 . . . . 74.230000000000004 110.845 -179.907 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 119.75 38.89 0.68 Allowed Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.779 -0.724 . . . . 62.420000000000002 112.464 -179.996 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 111' ' ' GLN . . . . . . . . . . . . . 10.9 pt20 -171.42 -176.43 1.85 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.735 0.302 . . . . 70.450000000000003 110.893 -179.914 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 63.1 mt-10 -60.57 131.59 51.2 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.214 -0.448 . . . . 74.219999999999999 110.911 -179.966 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 113' ' ' ILE . . . . . 0.44 ' CD1' ' HG3' ' A' ' 79' ' ' PRO . 7.6 pt -127.02 -5.53 4.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.187 -0.461 . . . . 75.239999999999995 111.137 179.969 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 114' ' ' ILE . . . . . 0.497 ' CD1' ' HE1' ' A' ' 70' ' ' MET . 3.6 mp -68.3 -46.61 80.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.185 -0.461 . . . . 73.239999999999995 111.134 179.828 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 115' ' ' PHE . . . . . 0.565 ' CE1' HD13 ' A' ' 25' ' ' ILE . 12.5 t80 -69.13 -33.83 74.07 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.187 -0.46 . . . . 73.409999999999997 110.853 179.954 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 51.9 mm-40 -68.06 -44.72 75.72 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.191 -0.459 . . . . 74.25 110.886 -179.949 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 117' ' ' ILE . . . . . 0.496 HD12 ' CG ' ' A' ' 101' ' ' PHE . 0.4 OUTLIER -66.41 -41.2 88.37 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 116.192 -0.458 . . . . 74.340000000000003 111.147 179.982 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 118' ' ' THR . . . . . 0.474 ' N ' ' CG2' ' A' ' 117' ' ' ILE . 69.8 p -67.88 -43.08 80.16 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.162 -0.472 . . . . 73.540000000000006 111.177 179.906 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -66.49 -31.59 72.41 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.209 -0.451 . . . . 71.129999999999995 110.907 -179.878 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -77.73 -44.73 26.86 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.091 -0.504 . . . . 75.120000000000005 110.912 -179.988 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 121' ' ' THR . . . . . 0.43 ' CG2' HD11 ' A' ' 66' ' ' LEU . 18.8 p -66.17 -45.42 80.97 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.167 -0.47 . . . . 55.130000000000003 111.203 -179.979 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 3.6 pp0? -60.91 -38.12 84.64 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.187 -0.46 . . . . 75.129999999999995 110.894 179.978 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 123' ' ' GLU . . . . . 0.497 ' CG ' ' N ' ' A' ' 124' ' ' LYS . 1.6 pt-20 -74.12 -48.26 30.7 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.228 -0.442 . . . . 73.430000000000007 110.894 -179.944 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 124' ' ' LYS . . . . . 0.497 ' N ' ' CG ' ' A' ' 123' ' ' GLU . 0.0 OUTLIER -63.5 -28.51 70.0 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.084 -0.507 . . . . 74.340000000000003 110.865 179.986 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 125' ' ' LEU . . . . . 0.498 ' C ' ' CD2' ' A' ' 125' ' ' LEU . 1.4 tt -68.36 -51.64 42.12 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.208 -0.451 . . . . 71.409999999999997 110.928 179.947 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 26.8 t70 -60.31 -37.19 79.79 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.208 -0.451 . . . . 74.510000000000005 110.882 179.837 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 1.6 mm-40 -60.18 -48.68 80.69 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.185 -0.461 . . . . 75.140000000000001 110.838 -179.895 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 128' ' ' PHE . . . . . 0.498 ' CE1' ' SD ' ' A' ' 96' ' ' MET . 7.4 m-85 -64.19 -61.51 2.2 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.152 -0.477 . . . . 75.439999999999998 110.874 -179.907 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 129' ' ' GLN . . . . . 0.474 ' CG ' HG22 ' A' ' 60' ' ' VAL . 1.4 tm0? -42.86 -35.48 1.2 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.157 -0.474 . . . . 63.310000000000002 110.886 -179.916 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 130' ' ' ASN . . . . . . . . . . . . . 1.9 m-20 -69.57 -38.84 77.55 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.205 -0.452 . . . . 63.520000000000003 110.891 -179.949 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 131' ' ' VAL . . . . . 0.415 ' N ' ' O ' ' A' ' 128' ' ' PHE . 3.2 m -110.81 26.66 2.75 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.166 -0.47 . . . . 64.329999999999998 111.136 179.883 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 132' ' ' VAL . . . . . 0.418 ' N ' ' O ' ' A' ' 128' ' ' PHE . 1.8 p -90.85 158.87 2.86 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.189 -0.459 . . . . 73.120000000000005 111.111 179.936 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 133' ' ' ASN . . . . . . . . . . . . . 1.6 m-20 -115.23 86.67 2.5 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.183 -0.462 . . . . 75.519999999999996 110.853 -179.964 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 134' ' ' THR . . . . . . . . . . . . . 43.1 p -139.38 157.25 46.19 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.144 -0.48 . . . . 74.140000000000001 111.127 -179.982 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -139.63 103.56 4.71 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.198 -0.456 . . . . 71.409999999999997 110.888 179.994 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 42.2 t -43.26 139.46 1.91 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.216 -0.447 . . . . 64.200000000000003 110.878 -179.843 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 137' ' ' LEU . . . . . . . . . . . . . 32.5 tp -170.32 133.75 1.12 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.12 -0.491 . . . . 74.519999999999996 110.958 179.993 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 C--N 1.329 -0.298 0 CA-C-N 116.214 -0.448 . . . . 71.049999999999997 110.885 179.949 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--O 1.231 0.118 0 CA-C-O 120.762 0.315 . . . . 73.049999999999997 110.873 . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 58.3 m -166.38 111.11 0.8 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.257 -0.429 . . . . 63.240000000000002 110.866 -179.761 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -160.77 177.97 9.9 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.13 -0.486 . . . . 74.439999999999998 110.923 179.954 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -111.73 -71.54 0.75 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.174 -0.466 . . . . 73.340000000000003 110.878 -179.954 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 32.4 m-70 -55.09 -179.51 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.101 -0.5 . . . . 75.120000000000005 110.877 179.979 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 3.2 mt -42.84 123.3 2.67 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.251 -0.432 . . . . 72.450000000000003 110.906 -179.953 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 9.7 t -163.8 172.34 14.25 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.158 -0.474 . . . . 74.0 111.156 179.949 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 23.4 mt -52.6 -32.96 44.07 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.247 -0.433 . . . . 74.219999999999999 110.912 179.958 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 6.3 m-20 -50.96 -34.59 29.51 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.251 -0.432 . . . . 73.409999999999997 110.86 179.827 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 36.6 mm-40 -66.33 -36.38 82.76 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.178 -0.465 . . . . 74.540000000000006 110.897 -179.892 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 17.9 m-85 -65.2 -26.05 67.97 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.168 -0.469 . . . . 74.450000000000003 110.919 -179.857 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -58.73 -37.59 76.51 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.106 -0.497 . . . . 75.109999999999999 110.927 -179.871 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 1.1 mm-40 -58.26 -41.68 84.78 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.104 -0.498 . . . . 70.230000000000004 110.898 179.987 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 2.3 mp -68.08 -40.16 82.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.208 -0.451 . . . . 73.310000000000002 111.141 179.939 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . 0.602 ' OE1' ' CE1' ' A' ' 74' ' ' TYR . 12.6 mm-40 -62.76 -45.04 94.55 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.133 -0.485 . . . . 64.120000000000005 110.87 179.989 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 3.2 t -58.52 -44.51 89.57 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.163 -0.471 . . . . 65.409999999999997 110.889 -179.925 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -57.58 -33.51 68.25 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.217 -0.447 . . . . 72.140000000000001 110.911 -179.931 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 2.0 mm-40 -66.05 -37.69 86.47 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.179 -0.464 . . . . 63.299999999999997 110.896 -179.979 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . 0.457 HD21 ' CG1' ' A' ' 46' ' ' ILE . 9.2 mp -65.7 -51.39 59.71 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.128 -0.487 . . . . 63.219999999999999 110.929 -179.995 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 2.0 pt-20 -68.25 -32.58 72.87 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.207 -0.452 . . . . 60.030000000000001 110.902 179.902 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -66.05 -49.92 65.99 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.143 -0.48 . . . . 73.329999999999998 111.103 179.952 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . 0.476 ' N ' HD13 ' A' ' 22' ' ' ILE . 0.7 OUTLIER -77.01 -34.58 22.03 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.226 -0.443 . . . . 74.349999999999994 111.153 179.966 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . 0.403 ' CG ' ' O ' ' A' ' 19' ' ' LEU . 26.6 mtp180 -52.34 -34.45 47.37 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.184 -0.462 . . . . 75.129999999999995 110.913 179.935 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -67.16 -35.02 78.79 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.187 -0.461 . . . . 74.329999999999998 110.86 -179.758 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . 0.555 HD13 ' CD1' ' A' ' 115' ' ' PHE . 3.2 mt -80.61 -44.4 21.65 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.093 -0.503 . . . . 75.120000000000005 111.132 179.895 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 19.9 m-85 -110.73 45.89 1.11 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.208 -0.451 . . . . 64.030000000000001 110.92 -179.941 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 3.1 mtm -43.49 -57.23 3.2 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.127 -0.488 . . . . 74.209999999999994 110.887 179.884 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 5.4 m-20 -81.84 -35.94 28.85 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.203 -0.453 . . . . 71.409999999999997 110.883 179.949 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -80.62 44.03 0.7 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.218 -0.446 . . . . 73.430000000000007 110.827 -179.983 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 10.1 t80 -129.15 123.72 32.85 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.233 -0.44 . . . . 74.549999999999997 110.921 -179.937 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 20.3 m -113.17 135.03 54.26 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.171 -0.468 . . . . 74.430000000000007 111.101 -179.882 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -95.94 113.99 25.67 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.216 -0.447 . . . . 52.109999999999999 110.868 179.924 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . 0.594 ' CD2' ' N ' ' A' ' 34' ' ' THR . 0.1 OUTLIER -113.36 -18.74 11.96 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.162 -0.472 . . . . 73.219999999999999 110.93 -179.935 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' THR . . . . . 0.594 ' N ' ' CD2' ' A' ' 33' ' ' LEU . 2.5 m -37.99 156.66 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.163 -0.471 . . . . 73.329999999999998 111.143 179.94 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -73.89 62.82 0.87 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.198 -0.456 . . . . 75.129999999999995 110.905 179.924 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 2.1 mmm180 -129.06 -32.57 2.04 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.17 -0.468 . . . . 74.239999999999995 110.843 -179.984 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . 0.466 ' O ' ' CB ' ' A' ' 38' ' ' SER . 0.0 OUTLIER -72.05 122.51 21.03 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.216 -0.447 . . . . 75.239999999999995 110.896 179.967 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' SER . . . . . 0.466 ' CB ' ' O ' ' A' ' 37' ' ' LYS . 3.7 t 80.57 -48.54 0.3 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.214 -0.448 . . . . 75.0 110.825 -179.942 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 14.5 m -101.83 172.08 7.15 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.147 -0.479 . . . . 74.109999999999999 110.842 -179.817 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' TRP . . . . . 0.52 ' CG ' ' N ' ' A' ' 41' ' ' ASP . 8.9 p90 -88.29 -48.09 7.93 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.141 -0.481 . . . . 75.530000000000001 110.963 179.988 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . 0.52 ' N ' ' CG ' ' A' ' 40' ' ' TRP . 0.2 OUTLIER 172.97 132.98 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.166 -0.47 . . . . 74.230000000000004 110.846 179.944 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 18.1 mttt -120.24 -90.41 0.58 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.194 -0.457 . . . . 74.150000000000006 110.907 179.959 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . 0.654 ' N ' ' CD ' ' A' ' 44' ' ' PRO . 4.3 mp0 -129.35 41.48 0.74 Allowed Pre-proline 0 C--N 1.328 -0.329 0 CA-C-O 121.598 0.713 . . . . 74.310000000000002 110.941 179.912 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' PRO . . . . . 0.654 ' CD ' ' N ' ' A' ' 43' ' ' GLN . 53.9 Cg_endo -69.77 -172.73 0.61 Allowed 'Trans proline' 0 C--N 1.341 0.178 0 C-N-CA 122.685 2.257 . . . . 74.420000000000002 112.333 179.994 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' GLN . . . . . 0.519 ' O ' ' CB ' ' A' ' 46' ' ' ILE . 0.3 OUTLIER -178.74 29.81 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.208 -0.451 . . . . 74.239999999999995 110.907 -179.973 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . 0.519 ' CB ' ' O ' ' A' ' 45' ' ' GLN . 0.1 OUTLIER 87.52 -18.01 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.214 -0.448 . . . . 75.549999999999997 111.184 -179.971 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . 0.539 ' N ' ' CD1' ' A' ' 47' ' ' ILE . 0.1 OUTLIER -38.28 147.2 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.164 -0.471 . . . . 74.109999999999999 111.139 179.811 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 1.9 p90 -162.02 160.93 28.19 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.149 -0.478 . . . . 74.430000000000007 110.871 179.975 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 18.8 mt-10 -110.61 155.61 22.12 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.153 -0.476 . . . . 72.329999999999998 110.929 -179.948 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 9.2 mm -135.44 142.28 40.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.2 -0.454 . . . . 73.530000000000001 111.142 179.935 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 89.7 m -88.12 139.18 30.77 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.168 -0.469 . . . . 74.219999999999999 111.167 179.938 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 17.4 mt -141.12 162.63 35.04 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.232 -0.44 . . . . 75.25 110.918 179.957 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 53' ' ' ARG . . . . . 0.456 ' C ' ' CD2' ' A' ' 125' ' ' LEU . 0.0 OUTLIER -178.27 173.76 1.38 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.179 -0.464 . . . . 74.420000000000002 110.817 179.969 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 10.9 p -67.46 -173.6 0.32 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.192 -0.458 . . . . 61.439999999999998 110.888 -179.801 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 34.0 m -94.13 -28.94 4.21 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.169 -0.468 . . . . 62.020000000000003 111.148 179.935 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -113.54 -173.8 2.34 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.123 -0.489 . . . . 62.350000000000001 110.861 179.941 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -117.61 -13.56 10.25 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.188 -0.46 . . . . 74.319999999999993 110.878 179.986 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . 0.546 ' HA ' ' C ' ' A' ' 59' ' ' PRO . 5.9 pt-20 -122.67 144.11 41.69 Favored Pre-proline 0 C--N 1.329 -0.296 0 CA-C-O 121.637 0.732 . . . . 75.310000000000002 110.85 -179.975 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 59' ' ' PRO . . . . . 0.546 ' C ' ' HA ' ' A' ' 58' ' ' GLU . 53.9 Cg_endo -69.76 -5.18 8.73 Favored 'Cis proline' 0 C--N 1.342 0.2 0 C-N-CA 122.663 -1.807 . . . . 74.150000000000006 112.316 -0.042 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 60' ' ' VAL . . . . . 0.45 ' O ' ' NE2' ' A' ' 129' ' ' GLN . 14.9 m -154.9 -179.5 0.25 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.256 -0.429 . . . . 72.099999999999994 111.17 179.912 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . 0.429 ' O ' ' C ' ' A' ' 62' ' ' SER . 1.2 pt-20 -118.91 -12.8 9.53 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.193 -0.458 . . . . 71.430000000000007 110.843 179.989 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 62' ' ' SER . . . . . 0.435 ' HB3' ' CD1' ' A' ' 125' ' ' LEU . 7.8 t 35.51 90.78 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.206 -0.452 . . . . 74.310000000000002 110.841 -179.811 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 6.4 t -104.87 123.04 47.02 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.117 -0.492 . . . . 75.010000000000005 110.85 -179.83 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 64' ' ' ILE . . . . . . . . . . . . . 20.7 mt -136.2 132.18 49.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.121 -0.491 . . . . 74.519999999999996 111.088 179.992 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 87.0 m -95.84 113.96 25.65 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.218 -0.446 . . . . 75.439999999999998 111.1 179.95 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 11.8 mt -94.54 112.62 24.39 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.236 -0.438 . . . . 75.439999999999998 110.913 179.906 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 2.6 t60 -108.78 112.0 24.05 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.188 -0.46 . . . . 71.540000000000006 110.811 179.864 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 68' ' ' PHE . . . . . 0.562 ' CE1' HG23 ' A' ' 114' ' ' ILE . 0.0 OUTLIER -102.95 145.11 30.34 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.181 -0.463 . . . . 73.120000000000005 110.878 -179.946 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . 0.477 ' CB ' HG21 ' A' ' 47' ' ' ILE . . . -122.32 110.74 16.05 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.135 -0.484 . . . . 70.239999999999995 111.124 179.911 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 70' ' ' MET . . . . . 0.469 ' CE ' HD12 ' A' ' 114' ' ' ILE . 3.9 mmt -76.04 86.46 2.94 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.222 -0.444 . . . . 65.319999999999993 110.848 -179.998 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -40.34 156.57 0.18 Allowed Pre-proline 0 C--N 1.33 -0.274 0 CA-C-O 121.579 0.704 . . . . 70.140000000000001 111.145 -179.944 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.73 1.47 4.38 Favored 'Trans proline' 0 C--N 1.341 0.161 0 C-N-CA 122.687 2.258 . . . . 62.409999999999997 112.368 179.923 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 73' ' ' MET . . . . . 0.501 ' O ' ' CB ' ' A' ' 76' ' ' TYR . 0.0 OUTLIER -118.25 -26.14 6.4 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.192 -0.458 . . . . 73.310000000000002 110.909 179.908 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 74' ' ' TYR . . . . . 0.656 ' CD1' ' C ' ' A' ' 74' ' ' TYR . 0.0 OUTLIER -48.05 150.65 1.98 Allowed Pre-proline 0 C--N 1.328 -0.346 0 CA-C-O 121.659 0.742 . . . . 75.239999999999995 110.91 -179.864 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 75' ' ' PRO . . . . . 0.568 ' HA ' ' CD2' ' A' ' 74' ' ' TYR . 54.3 Cg_endo -69.76 -11.12 11.79 Favored 'Cis proline' 0 C--N 1.34 0.129 0 C-N-CA 122.684 -1.798 . . . . 75.230000000000004 112.365 -0.09 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 76' ' ' TYR . . . . . 0.501 ' CB ' ' O ' ' A' ' 73' ' ' MET . 16.4 t80 -32.82 -53.9 0.35 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.199 -0.455 . . . . 72.25 110.949 -179.96 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 29.6 p -106.98 171.44 7.37 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.075 -0.511 . . . . 72.439999999999998 111.162 -179.947 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -85.09 130.19 53.09 Favored Pre-proline 0 C--N 1.329 -0.325 0 CA-C-O 121.566 0.698 . . . . 65.219999999999999 111.107 179.881 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 79' ' ' PRO . . . . . 0.465 ' HG3' ' CD1' ' A' ' 113' ' ' ILE . 53.4 Cg_endo -69.8 174.13 9.99 Favored 'Trans proline' 0 C--N 1.341 0.168 0 C-N-CA 122.675 2.25 . . . . 60.32 112.338 -179.965 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -120.45 137.69 54.2 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.223 -0.444 . . . . 62.240000000000002 110.857 -179.962 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 81' ' ' ILE . . . . . 0.478 ' CG1' ' HA ' ' A' ' 68' ' ' PHE . 13.7 mt -143.68 150.13 17.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.136 -0.484 . . . . 75.140000000000001 111.163 179.953 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . 0.479 ' HG3' ' CD ' ' A' ' 84' ' ' LYS . 9.5 pt-20 -149.0 147.48 28.61 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.21 -0.45 . . . . 75.430000000000007 110.915 179.959 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 83' ' ' PHE . . . . . 0.516 ' CE2' ' HD3' ' A' ' 98' ' ' LYS . 15.2 m-85 -90.51 140.96 29.24 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.154 -0.476 . . . . 74.019999999999996 110.851 -179.901 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 84' ' ' LYS . . . . . 0.512 ' O ' ' N ' ' A' ' 86' ' ' VAL . 8.9 mmmt -124.57 174.43 7.83 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.166 -0.47 . . . . 74.530000000000001 110.91 179.919 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . 0.421 ' C ' HG23 ' A' ' 86' ' ' VAL . 2.5 m-80 59.3 -75.75 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.215 -0.448 . . . . 73.140000000000001 110.915 179.998 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 86' ' ' VAL . . . . . 0.512 ' N ' ' O ' ' A' ' 84' ' ' LYS . 3.5 m 41.73 92.65 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.19 -0.459 . . . . 72.5 111.104 179.901 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -96.22 -77.82 0.47 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.189 -0.46 . . . . 74.319999999999993 110.861 -179.958 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 88' ' ' ASN . . . . . 0.415 ' CG ' HG21 ' A' ' 60' ' ' VAL . 0.7 OUTLIER -59.71 -56.82 17.09 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.202 -0.454 . . . . 73.219999999999999 110.881 -179.937 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 89' ' ' VAL . . . . . 0.466 ' CG2' ' HG ' ' A' ' 94' ' ' LEU . 2.1 p -51.07 136.68 9.95 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.19 -0.459 . . . . 74.310000000000002 111.158 179.887 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 90' ' ' MET . . . . . . . . . . . . . 6.8 mtm -88.97 -70.37 0.65 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.121 -0.491 . . . . 72.209999999999994 110.912 179.906 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 10.3 t0 -175.19 -31.62 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.217 -0.447 . . . . 73.310000000000002 110.867 179.957 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -53.98 -46.76 71.78 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.191 -0.459 . . . . 73.129999999999995 110.85 -179.722 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 93' ' ' GLN . . . . . 0.526 ' HG3' ' CE1' ' A' ' 128' ' ' PHE . 0.3 OUTLIER -70.24 -37.69 75.01 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.158 -0.474 . . . . 71.420000000000002 110.908 -179.978 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . 0.509 HD22 ' CG ' ' A' ' 83' ' ' PHE . 48.1 mt -59.2 -47.54 84.94 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.203 -0.453 . . . . 74.329999999999998 110.96 179.995 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 1.7 mt-30 -61.42 -35.74 78.39 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.181 -0.463 . . . . 62.340000000000003 110.857 179.932 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 96' ' ' MET . . . . . . . . . . . . . 31.7 ttp -61.44 -42.25 98.46 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.21 -0.45 . . . . 75.510000000000005 110.827 -179.964 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 97' ' ' LEU . . . . . 0.461 ' O ' ' CD1' ' A' ' 101' ' ' PHE . 79.8 mt -60.02 -43.82 95.02 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.243 -0.435 . . . . 74.319999999999993 110.965 -179.995 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 98' ' ' LYS . . . . . 0.516 ' HD3' ' CE2' ' A' ' 83' ' ' PHE . 6.0 mmtp -55.49 -39.06 69.96 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.18 -0.464 . . . . 73.319999999999993 110.867 179.809 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 57.1 m -64.11 -40.2 95.69 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.25 -0.432 . . . . 61.299999999999997 110.862 -179.888 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 100' ' ' GLU . . . . . 0.575 ' OE1' ' CZ ' ' A' ' 120' ' ' PHE . 19.5 mm-40 -71.44 -27.24 63.14 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.116 -0.493 . . . . 73.310000000000002 110.91 -179.983 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 101' ' ' PHE . . . . . 0.533 ' CD2' HD13 ' A' ' 117' ' ' ILE . 10.5 m-30 -60.19 -31.12 69.84 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.173 -0.467 . . . . 70.120000000000005 110.856 -179.867 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 14.1 ttmt -73.92 -41.54 61.92 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.165 -0.47 . . . . 75.120000000000005 110.898 179.958 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 17.4 ttpp -69.82 -41.25 75.24 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.167 -0.469 . . . . 74.120000000000005 110.905 179.856 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 3.9 mt -64.45 -47.59 88.72 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 116.257 -0.429 . . . . 63.409999999999997 111.131 179.86 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 105' ' ' HIS . . . . . . . . . . . . . 2.1 t60 -62.82 -43.62 98.33 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.197 -0.456 . . . . 74.409999999999997 110.86 179.861 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -56.53 -43.3 79.69 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.196 -0.456 . . . . 74.230000000000004 110.872 -179.913 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 9.9 t -77.87 -30.12 50.7 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.166 -0.47 . . . . 61.130000000000003 111.161 -179.991 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 27.0 m -107.05 33.08 4.15 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.221 -0.445 . . . . 71.530000000000001 110.846 -179.867 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 34.1 ttt180 -76.57 80.65 3.24 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.149 -0.478 . . . . 73.040000000000006 110.859 -179.93 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 151.21 -29.44 0.98 Allowed Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.694 -0.765 . . . . 51.109999999999999 112.484 -179.953 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 111' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -111.41 -164.43 0.92 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.784 0.326 . . . . 72.109999999999999 110.956 -179.909 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 12.2 mt-10 -67.23 133.87 50.56 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.234 -0.439 . . . . 63.219999999999999 110.839 -179.924 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 113' ' ' ILE . . . . . 0.465 ' CD1' ' HG3' ' A' ' 79' ' ' PRO . 2.8 pt -122.95 -16.94 5.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.096 -0.502 . . . . 65.219999999999999 111.121 179.986 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 114' ' ' ILE . . . . . 0.562 HG23 ' CE1' ' A' ' 68' ' ' PHE . 9.5 mm -57.18 -43.12 81.09 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 116.152 -0.476 . . . . 75.150000000000006 111.065 179.879 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 115' ' ' PHE . . . . . 0.555 ' CD1' HD13 ' A' ' 25' ' ' ILE . 20.0 t80 -70.58 -31.94 69.14 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.167 -0.47 . . . . 72.430000000000007 110.89 179.991 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 9.1 mm-40 -68.21 -47.79 66.9 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.144 -0.48 . . . . 72.010000000000005 110.862 -179.892 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 117' ' ' ILE . . . . . 0.533 HD13 ' CD2' ' A' ' 101' ' ' PHE . 0.7 OUTLIER -66.02 -42.34 91.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.134 -0.484 . . . . 71.030000000000001 111.117 -179.999 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 118' ' ' THR . . . . . 0.488 ' N ' ' CG2' ' A' ' 117' ' ' ILE . 70.8 p -68.01 -41.69 81.85 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.192 -0.458 . . . . 74.310000000000002 111.169 179.98 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 29.5 t -67.33 -39.71 85.84 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.199 -0.455 . . . . 71.409999999999997 110.858 -179.873 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 120' ' ' PHE . . . . . 0.575 ' CZ ' ' OE1' ' A' ' 100' ' ' GLU . 1.0 OUTLIER -67.13 -47.75 70.17 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.147 -0.479 . . . . 74.409999999999997 110.894 -179.923 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 34.8 p -65.44 -39.72 92.42 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.141 -0.481 . . . . 74.209999999999994 111.133 -179.955 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 37.6 tt0 -65.03 -47.04 78.85 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.223 -0.444 . . . . 75.400000000000006 110.907 -180.0 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 123' ' ' GLU . . . . . 0.438 ' CG ' ' N ' ' A' ' 124' ' ' LYS . 3.6 pt-20 -67.05 -44.42 80.19 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.231 -0.44 . . . . 65.340000000000003 110.88 -179.949 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 124' ' ' LYS . . . . . 0.59 ' O ' ' CE1' ' A' ' 128' ' ' PHE . 0.0 OUTLIER -70.78 -32.32 69.39 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.141 -0.481 . . . . 74.340000000000003 110.848 -180.0 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 125' ' ' LEU . . . . . 0.54 ' HA ' ' CD2' ' A' ' 128' ' ' PHE . 1.9 tp -63.25 -42.42 99.17 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.221 -0.445 . . . . 75.239999999999995 110.91 179.933 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 9.3 m-20 -59.65 -38.65 81.98 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.186 -0.461 . . . . 62.5 110.855 179.834 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 1.6 mt-10 -62.68 -36.12 81.88 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.142 -0.481 . . . . 74.420000000000002 110.862 -179.858 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 128' ' ' PHE . . . . . 0.59 ' CE1' ' O ' ' A' ' 124' ' ' LYS . 7.0 m-30 -48.58 -64.55 0.77 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.221 -0.445 . . . . 73.439999999999998 110.894 -179.93 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 129' ' ' GLN . . . . . 0.45 ' NE2' ' O ' ' A' ' 60' ' ' VAL . 4.4 mt-30 -48.46 -33.31 9.12 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.115 -0.493 . . . . 74.540000000000006 110.965 -179.972 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 130' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -62.26 -48.4 80.09 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.207 -0.451 . . . . 72.409999999999997 110.892 179.998 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 19.3 m -137.3 92.94 0.93 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.178 -0.464 . . . . 62.140000000000001 111.13 179.937 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 132' ' ' VAL . . . . . 0.402 ' CG2' ' O ' ' A' ' 128' ' ' PHE . 98.8 t -106.64 147.0 12.44 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.159 -0.473 . . . . 71.109999999999999 111.142 179.927 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 133' ' ' ASN . . . . . . . . . . . . . 2.9 t-20 -122.83 97.45 5.45 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.157 -0.474 . . . . 54.420000000000002 110.903 -179.992 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 134' ' ' THR . . . . . 0.438 ' O ' ' C ' ' A' ' 135' ' ' GLN . 71.6 p -124.12 -61.05 1.38 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.181 -0.463 . . . . 74.329999999999998 111.135 -179.968 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 135' ' ' GLN . . . . . 0.438 ' C ' ' O ' ' A' ' 134' ' ' THR . 0.0 OUTLIER 34.79 44.68 0.13 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.222 -0.445 . . . . 75.519999999999996 110.901 -179.948 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -165.11 39.66 0.07 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.229 -0.442 . . . . 72.329999999999998 110.881 -179.831 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 137' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -157.14 -53.33 0.08 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.136 -0.483 . . . . 73.349999999999994 110.931 179.993 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--N 1.329 -0.296 0 CA-C-N 116.187 -0.46 . . . . 65.340000000000003 110.915 179.909 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 14.4 ttm . . . . . 0 C--O 1.231 0.117 0 CA-C-O 120.761 0.315 . . . . 71.299999999999997 110.859 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 54.1 p -146.64 143.36 28.75 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.209 -0.451 . . . . 62.399999999999999 110.826 -179.821 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 28.8 mt 60.94 149.77 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.146 -0.479 . . . . 70.129999999999995 110.9 179.964 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 50.5 m -156.35 109.07 2.6 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.22 -0.446 . . . . 65.040000000000006 110.849 -179.904 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER 177.72 154.53 0.31 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.168 -0.469 . . . . 71.409999999999997 110.855 179.982 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -68.98 90.57 0.45 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.204 -0.453 . . . . 75.430000000000007 110.933 -179.974 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 1.9 t -165.45 171.63 13.09 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.202 -0.454 . . . . 74.299999999999997 111.138 179.945 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 60.5 mt -51.96 -26.15 9.85 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.197 -0.456 . . . . 74.209999999999994 110.924 179.978 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . 0.45 ' N ' ' OD1' ' A' ' 9' ' ' ASP . 0.8 OUTLIER -51.82 -35.23 43.63 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.18 -0.463 . . . . 55.340000000000003 110.844 179.886 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 71.5 mm-40 -65.23 -40.42 94.03 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.238 -0.437 . . . . 75.340000000000003 110.914 -179.952 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 13.6 m-85 -54.69 -23.15 16.21 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.199 -0.455 . . . . 75.140000000000001 110.909 -179.862 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER -57.48 -36.39 71.41 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.124 -0.489 . . . . 75.420000000000002 110.974 -179.938 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . 0.477 ' HG3' ' N ' ' A' ' 14' ' ' ILE . 4.8 pt-20 -62.24 -42.09 99.01 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.084 -0.507 . . . . 75.230000000000004 110.898 179.957 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . 0.477 ' N ' ' HG3' ' A' ' 13' ' ' GLU . 3.9 mp -68.52 -42.75 83.88 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-N 116.147 -0.478 . . . . 75.109999999999999 111.142 179.989 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . 0.585 ' OE1' ' CE1' ' A' ' 74' ' ' TYR . 10.8 mm-40 -66.06 -45.9 79.71 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.184 -0.462 . . . . 70.219999999999999 110.906 179.931 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 43.2 t -59.56 -41.53 90.33 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.185 -0.461 . . . . 72.319999999999993 110.882 -179.929 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -59.71 -33.65 71.89 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.208 -0.451 . . . . 73.129999999999995 110.918 -179.925 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 7.6 mt-10 -62.67 -38.09 89.0 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.162 -0.472 . . . . 74.319999999999993 110.906 -179.997 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . 0.443 ' CD2' HG13 ' A' ' 46' ' ' ILE . 9.9 mp -66.65 -51.64 53.86 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.122 -0.49 . . . . 72.519999999999996 110.887 -179.955 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 3.0 pt-20 -68.74 -32.7 72.67 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.18 -0.464 . . . . 73.209999999999994 110.881 179.94 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -66.66 -48.33 69.72 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.186 -0.461 . . . . 62.329999999999998 111.113 179.923 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . 0.473 ' N ' HD12 ' A' ' 22' ' ' ILE . 0.9 OUTLIER -75.85 -34.68 28.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.22 -0.446 . . . . 74.409999999999997 111.116 179.984 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -55.55 -34.44 64.74 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.169 -0.469 . . . . 74.430000000000007 110.833 -179.993 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -64.96 -35.73 82.12 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.254 -0.43 . . . . 64.349999999999994 110.861 -179.816 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . 0.569 HD13 ' CE1' ' A' ' 115' ' ' PHE . 3.1 mt -82.86 -41.23 17.16 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.125 -0.489 . . . . 63.109999999999999 111.139 179.967 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 23.0 m-85 -109.9 45.36 1.1 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.158 -0.474 . . . . 72.450000000000003 110.899 -179.97 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 1.8 mtm -43.55 -53.64 5.45 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.144 -0.48 . . . . 63.210000000000001 110.891 179.884 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -94.85 -20.86 19.08 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.18 -0.464 . . . . 73.420000000000002 110.836 -179.985 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -88.32 19.76 3.62 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.166 -0.47 . . . . 72.040000000000006 110.887 -179.984 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' PHE . . . . . 0.449 ' CD1' ' C ' ' A' ' 30' ' ' PHE . 1.9 t80 -105.97 145.96 30.66 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.23 -0.441 . . . . 74.530000000000001 110.887 -179.887 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 40.1 m -125.71 133.41 52.13 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.121 -0.491 . . . . 74.219999999999999 111.077 -179.849 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 1.1 t0 -97.94 115.5 28.27 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.188 -0.46 . . . . 73.540000000000006 110.891 179.882 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . 0.577 ' CD2' ' N ' ' A' ' 34' ' ' THR . 0.1 OUTLIER -118.91 -21.21 7.85 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.2 -0.454 . . . . 73.010000000000005 110.908 -179.92 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' THR . . . . . 0.577 ' N ' ' CD2' ' A' ' 33' ' ' LEU . 2.1 m -33.91 108.81 0.06 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.183 -0.462 . . . . 74.25 111.158 179.922 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -39.46 94.74 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.244 -0.435 . . . . 75.099999999999994 110.891 179.923 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . 0.456 ' N ' ' O ' ' A' ' 34' ' ' THR . 83.1 mtt180 -128.8 -77.22 0.56 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.199 -0.455 . . . . 73.329999999999998 110.85 179.996 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . 0.419 ' O ' ' C ' ' A' ' 38' ' ' SER . 0.4 OUTLIER -107.5 151.88 24.98 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.25 -0.432 . . . . 74.420000000000002 110.913 179.948 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' SER . . . . . 0.419 ' C ' ' O ' ' A' ' 37' ' ' LYS . 0.6 OUTLIER 36.74 84.54 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.214 -0.448 . . . . 71.120000000000005 110.848 -179.852 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 49.5 m -147.42 -174.11 4.44 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.125 -0.489 . . . . 73.030000000000001 110.878 -179.842 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' TRP . . . . . . . . . . . . . 54.9 t-105 -108.78 -37.49 5.87 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.124 -0.489 . . . . 74.430000000000007 110.926 179.992 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 41.0 m-20 -124.35 156.92 36.21 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.2 -0.454 . . . . 75.230000000000004 110.892 179.943 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -125.54 73.09 1.3 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.211 -0.45 . . . . 74.310000000000002 110.913 179.984 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -152.51 58.21 2.42 Favored Pre-proline 0 C--N 1.329 -0.321 0 CA-C-O 121.589 0.709 . . . . 75.129999999999995 110.91 179.974 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.75 -166.9 0.2 Allowed 'Trans proline' 0 C--N 1.342 0.196 0 C-N-CA 122.674 2.249 . . . . 73.510000000000005 112.383 179.999 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' GLN . . . . . 0.514 ' O ' ' CB ' ' A' ' 46' ' ' ILE . 0.1 OUTLIER -179.87 33.52 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.262 -0.426 . . . . 74.209999999999994 110.959 -179.963 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . 0.514 ' CB ' ' O ' ' A' ' 45' ' ' GLN . 0.1 OUTLIER 86.75 -12.55 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.199 -0.455 . . . . 75.450000000000003 111.136 179.964 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . 0.495 ' N ' ' CD1' ' A' ' 47' ' ' ILE . 0.1 OUTLIER -52.41 149.18 1.36 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.157 -0.474 . . . . 72.099999999999994 111.143 179.836 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 48' ' ' PHE . . . . . 0.446 ' HA ' ' CD2' ' A' ' 33' ' ' LEU . 30.2 p90 -161.88 162.8 29.41 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.197 -0.456 . . . . 75.519999999999996 110.909 179.945 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 5.8 mt-10 -111.91 159.74 18.09 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.146 -0.479 . . . . 74.319999999999993 110.908 -179.911 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 13.1 mm -135.25 142.7 39.1 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 116.191 -0.459 . . . . 74.129999999999995 111.143 179.961 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 83.9 m -84.88 129.58 34.79 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.185 -0.461 . . . . 63.43 111.116 179.984 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 12.0 mt -135.74 155.58 50.15 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.18 -0.464 . . . . 75.420000000000002 110.916 179.948 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -175.15 165.56 3.4 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.213 -0.449 . . . . 75.099999999999994 110.853 179.93 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -54.93 170.65 0.17 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.191 -0.459 . . . . 74.239999999999995 110.847 -179.785 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 18.7 m -84.43 -22.65 7.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.133 -0.485 . . . . 74.409999999999997 111.105 179.978 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -115.9 -176.99 3.05 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.151 -0.477 . . . . 75.239999999999995 110.846 179.995 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 6.1 mmmm -115.63 -7.28 12.17 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.192 -0.458 . . . . 73.209999999999994 110.927 179.955 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . 0.541 ' HA ' ' C ' ' A' ' 59' ' ' PRO . 44.6 mt-10 -129.01 148.17 67.89 Favored Pre-proline 0 C--N 1.33 -0.269 0 CA-C-O 121.652 0.739 . . . . 74.519999999999996 110.867 179.986 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 59' ' ' PRO . . . . . 0.541 ' C ' ' HA ' ' A' ' 58' ' ' GLU . 54.0 Cg_endo -69.73 -3.51 7.7 Favored 'Cis proline' 0 C--N 1.342 0.185 0 C-N-CA 122.686 -1.798 . . . . 63.439999999999998 112.369 -0.035 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 60' ' ' VAL . . . . . 0.475 ' CG2' ' HG3' ' A' ' 129' ' ' GLN . 18.6 m -148.44 179.06 0.74 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.235 -0.439 . . . . 72.219999999999999 111.132 179.94 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . 0.437 ' O ' ' C ' ' A' ' 62' ' ' SER . 8.7 tt0 -107.28 -17.17 14.21 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.137 -0.483 . . . . 73.239999999999995 110.886 -179.988 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 62' ' ' SER . . . . . 0.437 ' C ' ' O ' ' A' ' 61' ' ' GLU . 1.0 OUTLIER 34.15 91.0 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.137 -0.483 . . . . 73.430000000000007 110.829 -179.807 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 35.1 t -112.71 122.98 49.26 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.127 -0.488 . . . . 74.409999999999997 110.86 -179.856 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 64' ' ' ILE . . . . . . . . . . . . . 17.8 mt -136.53 138.63 46.36 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.121 -0.49 . . . . 73.120000000000005 111.141 179.959 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 90.5 m -104.38 113.89 27.75 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.2 -0.455 . . . . 75.150000000000006 111.112 179.974 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . 0.566 HD22 ' CD1' ' A' ' 83' ' ' PHE . 7.1 mt -93.06 113.26 25.48 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.197 -0.456 . . . . 71.140000000000001 110.883 179.972 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 67' ' ' HIS . . . . . 0.461 ' CE1' HD12 ' A' ' 33' ' ' LEU . 12.6 t60 -105.13 112.56 25.73 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.179 -0.464 . . . . 72.109999999999999 110.859 179.872 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 68' ' ' PHE . . . . . 0.566 ' CE1' HG22 ' A' ' 114' ' ' ILE . 0.0 OUTLIER -103.65 139.88 38.33 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.183 -0.462 . . . . 73.519999999999996 110.889 -179.927 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -114.47 115.67 27.62 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.14 -0.482 . . . . 65.129999999999995 111.081 179.949 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 70' ' ' MET . . . . . 0.456 ' HE1' ' CG1' ' A' ' 114' ' ' ILE . 5.9 mmt -79.11 102.25 8.34 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.229 -0.441 . . . . 74.239999999999995 110.84 179.99 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -60.84 153.95 61.49 Favored Pre-proline 0 C--N 1.33 -0.255 0 CA-C-O 121.632 0.729 . . . . 74.319999999999993 111.123 -179.956 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_endo -69.73 0.47 5.57 Favored 'Trans proline' 0 C--N 1.341 0.18 0 C-N-CA 122.643 2.229 . . . . 64.150000000000006 112.342 179.906 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 73' ' ' MET . . . . . 0.476 ' O ' ' CB ' ' A' ' 76' ' ' TYR . 0.0 OUTLIER -114.38 -26.92 7.77 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.236 -0.438 . . . . 73.239999999999995 110.932 179.858 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 74' ' ' TYR . . . . . 0.639 ' CD1' ' C ' ' A' ' 74' ' ' TYR . 0.0 OUTLIER -47.3 149.38 1.86 Allowed Pre-proline 0 C--N 1.328 -0.349 0 CA-C-O 121.673 0.749 . . . . 74.340000000000003 110.881 -179.853 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 75' ' ' PRO . . . . . 0.551 ' HA ' ' CD2' ' A' ' 74' ' ' TYR . 53.2 Cg_endo -69.78 -13.12 12.39 Favored 'Cis proline' 0 C--N 1.341 0.175 0 C-N-CA 122.709 -1.788 . . . . 75.099999999999994 112.342 -0.031 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 76' ' ' TYR . . . . . 0.476 ' CB ' ' O ' ' A' ' 73' ' ' MET . 3.3 t80 -33.44 -52.4 0.38 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.211 -0.449 . . . . 75.409999999999997 110.934 -179.91 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 43.1 p -106.37 -176.6 3.12 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.099 -0.5 . . . . 72.409999999999997 111.189 179.99 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -105.88 130.39 23.09 Favored Pre-proline 0 C--N 1.328 -0.338 0 CA-C-O 121.597 0.713 . . . . 61.530000000000001 111.113 179.865 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 79' ' ' PRO . . . . . 0.441 ' HG3' ' CD1' ' A' ' 113' ' ' ILE . 53.6 Cg_endo -69.79 -170.88 0.42 Allowed 'Trans proline' 0 C--N 1.342 0.228 0 C-N-CA 122.66 2.24 . . . . 73.519999999999996 112.344 -179.949 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . 0.459 ' HG3' ' N ' ' A' ' 81' ' ' ILE . 0.4 OUTLIER -123.88 142.12 51.41 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.246 -0.434 . . . . 75.120000000000005 110.922 -179.957 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 81' ' ' ILE . . . . . 0.472 ' CG2' HD23 ' A' ' 66' ' ' LEU . 2.3 mm -131.37 143.25 41.15 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.176 -0.465 . . . . 75.230000000000004 111.147 179.972 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . 0.465 ' HG3' ' CD ' ' A' ' 84' ' ' LYS . 4.3 pt-20 -148.58 142.07 25.35 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.182 -0.463 . . . . 75.230000000000004 110.856 179.973 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 83' ' ' PHE . . . . . 0.566 ' CD1' HD22 ' A' ' 66' ' ' LEU . 36.4 m-85 -95.19 141.37 28.88 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.13 -0.487 . . . . 74.109999999999999 110.902 -179.972 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 84' ' ' LYS . . . . . 0.484 ' O ' ' N ' ' A' ' 86' ' ' VAL . 7.7 mmmt -124.17 170.26 10.9 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.116 -0.493 . . . . 73.450000000000003 110.896 179.967 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . 0.547 ' N ' HD21 ' A' ' 85' ' ' ASN . 1.1 m-80 60.55 -75.68 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.209 -0.451 . . . . 73.329999999999998 110.904 179.954 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 86' ' ' VAL . . . . . 0.484 ' N ' ' O ' ' A' ' 84' ' ' LYS . 2.5 m 40.3 93.42 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-N 116.21 -0.45 . . . . 71.319999999999993 111.146 179.91 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -93.72 -93.61 0.17 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.1 -0.5 . . . . 75.319999999999993 110.923 -179.992 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 88' ' ' ASN . . . . . 0.417 ' CG ' HG22 ' A' ' 60' ' ' VAL . 1.3 t30 -44.44 -48.45 9.96 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.197 -0.456 . . . . 75.030000000000001 110.907 -179.931 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 2.0 p -60.1 141.11 17.16 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.171 -0.468 . . . . 74.549999999999997 111.119 179.908 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 90' ' ' MET . . . . . . . . . . . . . 5.5 mtm -92.55 -63.98 1.16 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.182 -0.463 . . . . 72.319999999999993 110.883 179.911 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 1.4 t0 173.88 -27.44 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.231 -0.441 . . . . 74.540000000000006 110.907 -179.997 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -54.38 -47.05 73.12 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.194 -0.457 . . . . 74.109999999999999 110.859 -179.745 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 93' ' ' GLN . . . . . 0.414 ' HB2' ' CD2' ' A' ' 128' ' ' PHE . 0.8 OUTLIER -71.08 -36.94 72.44 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.14 -0.482 . . . . 75.239999999999995 110.934 179.999 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 21.9 mt -57.95 -44.21 86.87 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.198 -0.456 . . . . 74.209999999999994 110.922 -179.983 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 2.9 mm-40 -63.76 -35.26 80.0 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.203 -0.453 . . . . 72.510000000000005 110.873 179.954 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 96' ' ' MET . . . . . . . . . . . . . 23.1 ttp -59.99 -44.35 94.58 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.226 -0.443 . . . . 75.129999999999995 110.918 179.935 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 97' ' ' LEU . . . . . 0.404 ' O ' ' CD1' ' A' ' 101' ' ' PHE . 34.5 mt -57.79 -41.95 83.13 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.246 -0.434 . . . . 73.0 110.903 179.987 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 98' ' ' LYS . . . . . 0.447 ' HD3' ' CE2' ' A' ' 83' ' ' PHE . 12.9 mmtm -54.64 -37.09 65.26 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.151 -0.477 . . . . 64.0 110.927 179.819 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -68.81 -41.97 77.92 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.249 -0.432 . . . . 74.329999999999998 110.877 -179.894 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 100' ' ' GLU . . . . . 0.407 ' OE2' ' NZ ' ' A' ' 103' ' ' LYS . 0.7 OUTLIER -69.17 -26.01 64.64 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.105 -0.498 . . . . 74.019999999999996 110.869 -179.98 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 101' ' ' PHE . . . . . 0.566 ' CD2' HD11 ' A' ' 117' ' ' ILE . 10.6 m-30 -59.7 -33.12 71.19 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.161 -0.472 . . . . 74.439999999999998 110.895 -179.92 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -63.99 -44.13 93.62 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.155 -0.475 . . . . 73.329999999999998 110.899 179.948 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 103' ' ' LYS . . . . . 0.407 ' NZ ' ' OE2' ' A' ' 100' ' ' GLU . 0.0 OUTLIER -68.86 -36.17 77.79 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.238 -0.437 . . . . 73.010000000000005 110.934 179.846 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 5.2 mt -63.22 -47.65 91.25 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.216 -0.447 . . . . 74.409999999999997 111.128 179.865 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 105' ' ' HIS . . . . . . . . . . . . . 5.9 t60 -62.96 -41.8 99.64 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.209 -0.45 . . . . 75.430000000000007 110.872 179.86 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -58.91 -43.6 91.1 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.231 -0.44 . . . . 72.310000000000002 110.896 -179.958 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 10.2 t -76.75 -27.9 55.54 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.144 -0.48 . . . . 74.329999999999998 111.152 -179.973 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 60.2 m -114.37 37.44 3.37 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.188 -0.46 . . . . 72.319999999999993 110.883 -179.83 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 18.7 ttt180 -81.6 77.44 8.45 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.088 -0.506 . . . . 73.310000000000002 110.88 -179.949 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 154.1 -15.12 0.58 Allowed Glycine 0 N--CA 1.451 -0.334 0 C-N-CA 120.757 -0.735 . . . . 53.229999999999997 112.493 -179.97 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 111' ' ' GLN . . . . . . . . . . . . . 14.3 pt20 -130.0 -166.21 1.64 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.754 0.311 . . . . 74.409999999999997 110.901 -179.886 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 66.1 mt-10 -61.4 131.87 51.65 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.158 -0.474 . . . . 65.400000000000006 110.918 -179.921 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 113' ' ' ILE . . . . . 0.441 ' CD1' ' HG3' ' A' ' 79' ' ' PRO . 20.6 pt -121.25 -8.11 9.91 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-N 116.163 -0.472 . . . . 73.150000000000006 111.128 179.966 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 114' ' ' ILE . . . . . 0.566 HG22 ' CE1' ' A' ' 68' ' ' PHE . 27.7 mm -66.52 -44.77 90.05 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-N 116.153 -0.476 . . . . 75.439999999999998 111.175 179.867 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 115' ' ' PHE . . . . . 0.569 ' CE1' HD13 ' A' ' 25' ' ' ILE . 28.8 t80 -68.04 -33.47 74.64 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.195 -0.457 . . . . 73.239999999999995 110.856 179.894 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 -67.79 -47.02 70.32 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.195 -0.457 . . . . 51.140000000000001 110.937 -179.928 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 117' ' ' ILE . . . . . 0.566 HD11 ' CD2' ' A' ' 101' ' ' PHE . 0.4 OUTLIER -64.18 -39.4 85.35 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.103 -0.499 . . . . 74.25 111.151 179.946 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 118' ' ' THR . . . . . 0.453 ' N ' ' CG2' ' A' ' 117' ' ' ILE . 74.2 p -68.19 -43.38 78.23 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.158 -0.474 . . . . 73.200000000000003 111.144 179.956 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -63.0 -44.09 96.99 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.258 -0.428 . . . . 75.109999999999999 110.906 -179.88 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -68.29 -46.62 69.83 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.103 -0.498 . . . . 72.129999999999995 110.883 -179.964 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 121' ' ' THR . . . . . 0.402 ' CG2' HD11 ' A' ' 66' ' ' LEU . 14.7 p -62.97 -39.18 93.91 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.089 -0.505 . . . . 75.409999999999997 111.148 -179.905 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 49.0 tp60 -65.71 -45.14 83.87 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.218 -0.446 . . . . 64.140000000000001 110.958 179.999 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 6.4 pt-20 -74.0 -29.89 62.19 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.148 -0.478 . . . . 73.519999999999996 110.881 -179.952 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 124' ' ' LYS . . . . . 0.494 ' CE ' ' HA ' ' A' ' 124' ' ' LYS . 0.0 OUTLIER -75.51 -45.48 37.95 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.165 -0.47 . . . . 74.530000000000001 110.894 179.971 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 125' ' ' LEU . . . . . 0.572 ' CD1' ' N ' ' A' ' 126' ' ' ASP . 0.0 OUTLIER -69.5 -42.84 74.22 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.205 -0.452 . . . . 73.439999999999998 110.957 179.917 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 126' ' ' ASP . . . . . 0.572 ' N ' ' CD1' ' A' ' 125' ' ' LEU . 14.3 t0 -60.25 -45.69 92.39 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.181 -0.463 . . . . 73.019999999999996 110.893 179.804 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 127' ' ' GLU . . . . . 0.494 ' HG3' ' N ' ' A' ' 128' ' ' PHE . 0.3 OUTLIER -60.94 -27.86 68.53 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.227 -0.442 . . . . 72.530000000000001 110.87 -179.922 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 128' ' ' PHE . . . . . 0.494 ' N ' ' HG3' ' A' ' 127' ' ' GLU . 0.1 OUTLIER -73.96 -50.34 20.42 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.194 -0.457 . . . . 63.310000000000002 110.922 -179.95 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 129' ' ' GLN . . . . . 0.475 ' HG3' ' CG2' ' A' ' 60' ' ' VAL . 1.5 tm0? -58.18 -14.61 7.38 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.181 -0.463 . . . . 71.340000000000003 110.941 -179.967 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 130' ' ' ASN . . . . . . . . . . . . . 13.0 t30 -58.29 -62.52 1.78 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.158 -0.474 . . . . 64.319999999999993 110.892 -179.973 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 131' ' ' VAL . . . . . 0.471 ' O ' ' O ' ' A' ' 132' ' ' VAL . 14.9 m -128.98 -27.35 0.99 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.144 -0.48 . . . . 72.140000000000001 111.13 179.902 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 132' ' ' VAL . . . . . 0.591 ' CG1' ' N ' ' A' ' 133' ' ' ASN . 0.4 OUTLIER 38.2 -162.34 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.19 -0.459 . . . . 75.299999999999997 111.107 179.86 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 133' ' ' ASN . . . . . 0.591 ' N ' ' CG1' ' A' ' 132' ' ' VAL . 0.6 OUTLIER -89.74 -58.02 2.66 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.159 -0.473 . . . . 74.530000000000001 110.868 179.992 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 134' ' ' THR . . . . . . . . . . . . . 58.8 m -133.8 141.56 47.51 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.198 -0.456 . . . . 73.540000000000006 111.122 -179.985 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -178.54 135.85 0.15 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.182 -0.463 . . . . 74.129999999999995 110.961 179.972 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 11.0 t -163.08 173.36 13.63 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.219 -0.446 . . . . 74.209999999999994 110.88 -179.781 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 137' ' ' LEU . . . . . . . . . . . . . 2.0 mp -107.48 142.81 36.77 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.156 -0.475 . . . . 64.349999999999994 110.928 -179.981 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.33 -0.271 0 CA-C-N 116.218 -0.446 . . . . 73.540000000000006 110.866 179.932 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.232 0.134 0 CA-C-O 120.735 0.302 . . . . 73.109999999999999 110.882 . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 24.3 m -41.0 121.15 1.47 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.235 -0.438 . . . . 73.129999999999995 110.87 -179.797 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 3.7 pp -50.48 -18.0 0.58 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.108 -0.496 . . . . 71.549999999999997 110.917 179.995 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 87.4 p -73.27 152.55 40.95 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.199 -0.455 . . . . 70.540000000000006 110.882 -179.963 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' HIS . . . . . 0.422 ' O ' ' C ' ' A' ' 6' ' ' LEU . 1.6 m80 56.07 167.67 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.159 -0.473 . . . . 73.25 110.855 179.995 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . 0.422 ' C ' ' O ' ' A' ' 5' ' ' HIS . 0.3 OUTLIER 36.29 84.72 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.23 -0.441 . . . . 74.439999999999998 110.919 -179.983 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 11.3 t -87.44 158.84 18.88 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.228 -0.442 . . . . 75.299999999999997 111.161 179.953 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 19.3 mt -61.54 -22.53 65.24 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.208 -0.451 . . . . 75.319999999999993 110.917 179.945 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . 0.42 ' OD1' ' N ' ' A' ' 9' ' ' ASP . 0.4 OUTLIER -55.63 -28.0 52.84 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.188 -0.46 . . . . 75.439999999999998 110.903 179.842 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 75.1 mm-40 -68.05 -36.79 80.45 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.227 -0.442 . . . . 71.430000000000007 110.895 -179.931 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 23.8 m-85 -63.94 -25.78 68.29 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.206 -0.452 . . . . 73.129999999999995 110.927 -179.879 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -59.4 -37.55 78.28 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.144 -0.48 . . . . 73.549999999999997 110.913 -179.916 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 2.2 mm-40 -60.23 -45.42 93.28 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.149 -0.478 . . . . 60.020000000000003 110.898 -179.985 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 3.7 mp -68.03 -41.06 84.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.098 -0.501 . . . . 70.219999999999999 111.166 179.954 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . 0.404 ' HG2' ' CB ' ' A' ' 70' ' ' MET . 0.8 OUTLIER -63.16 -47.87 80.84 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.207 -0.451 . . . . 72.409999999999997 110.961 179.895 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 3.8 t -58.83 -43.17 90.62 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.179 -0.464 . . . . 71.430000000000007 110.859 -179.938 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 1.1 t30 -57.79 -33.65 68.77 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.192 -0.458 . . . . 74.310000000000002 110.898 -179.854 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 4.9 mt-10 -66.1 -37.7 86.4 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.155 -0.475 . . . . 75.049999999999997 110.87 179.99 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . 0.447 ' N ' HD13 ' A' ' 19' ' ' LEU . 9.7 mp -64.99 -51.53 61.18 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.199 -0.455 . . . . 75.400000000000006 110.897 -179.939 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 1.5 pt-20 -68.58 -33.49 74.16 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.2 -0.455 . . . . 72.129999999999995 110.837 179.977 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -65.89 -49.63 67.37 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.214 -0.448 . . . . 74.120000000000005 111.116 179.967 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . 0.471 HD11 ' N ' ' A' ' 22' ' ' ILE . 0.6 OUTLIER -74.9 -34.41 32.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.2 -0.455 . . . . 75.319999999999993 111.172 179.928 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 4.1 mtp180 -52.32 -36.61 53.74 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.126 -0.488 . . . . 74.019999999999996 110.88 179.957 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -63.5 -34.14 77.12 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.188 -0.46 . . . . 64.439999999999998 110.837 -179.777 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . 0.558 HD12 ' CD1' ' A' ' 115' ' ' PHE . 3.3 mt -82.73 -43.52 18.8 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.145 -0.48 . . . . 72.329999999999998 111.155 179.922 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' TYR . . . . . 0.479 ' CD2' HG22 ' A' ' 50' ' ' ILE . 26.6 m-85 -108.82 46.62 0.96 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.156 -0.475 . . . . 75.040000000000006 110.929 -179.972 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 1.2 mtm -46.02 -58.35 3.66 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.099 -0.5 . . . . 73.129999999999995 110.846 179.948 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 20.2 m-20 -92.06 -5.65 52.47 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.259 -0.428 . . . . 75.150000000000006 110.881 179.952 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -102.96 30.28 4.9 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.213 -0.449 . . . . 72.329999999999998 110.865 179.991 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' PHE . . . . . 0.546 ' CE2' ' HB2' ' A' ' 48' ' ' PHE . 8.8 t80 -117.72 144.09 45.6 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.216 -0.447 . . . . 65.400000000000006 110.901 -179.93 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 21.9 m -123.52 133.07 54.05 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.152 -0.477 . . . . 75.319999999999993 111.115 -179.905 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -94.36 114.23 26.25 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.197 -0.456 . . . . 73.129999999999995 110.879 179.907 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . 0.497 ' CD2' ' HA ' ' A' ' 48' ' ' PHE . 1.7 pt? -113.52 -14.49 12.69 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.231 -0.44 . . . . 74.430000000000007 110.92 -179.947 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' THR . . . . . 0.407 ' O ' ' O ' ' A' ' 33' ' ' LEU . 0.2 OUTLIER -49.11 -179.35 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.148 -0.478 . . . . 43.130000000000003 111.147 179.966 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . 0.406 ' CD ' ' HB3' ' A' ' 44' ' ' PRO . 0.0 OUTLIER -78.08 10.56 2.83 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.221 -0.445 . . . . 71.430000000000007 110.871 179.932 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 3.8 mtp85 -46.3 -58.93 3.25 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.239 -0.437 . . . . 75.120000000000005 110.843 179.982 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -75.43 152.22 38.0 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.148 -0.478 . . . . 73.310000000000002 110.868 -179.984 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER 58.89 174.69 0.07 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.183 -0.462 . . . . 74.430000000000007 110.869 -179.892 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 14.4 m -138.95 143.75 38.72 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.135 -0.484 . . . . 74.109999999999999 110.88 -179.853 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' TRP . . . . . . . . . . . . . 13.2 t-105 173.9 -39.64 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.141 -0.481 . . . . 74.519999999999996 110.894 179.976 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 25.8 t70 -138.99 143.11 38.36 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.274 -0.421 . . . . 75.409999999999997 110.905 179.919 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 3.9 mttt -121.16 72.16 0.98 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.21 -0.45 . . . . 75.340000000000003 110.872 -179.953 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -152.46 66.39 6.36 Favored Pre-proline 0 C--N 1.328 -0.342 0 CA-C-O 121.59 0.709 . . . . 75.430000000000007 110.93 179.937 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' PRO . . . . . 0.406 ' HB3' ' CD ' ' A' ' 35' ' ' LYS . 54.1 Cg_endo -69.77 151.51 69.05 Favored 'Trans proline' 0 N--CA 1.465 -0.162 0 C-N-CA 122.688 2.259 . . . . 75.409999999999997 112.385 179.981 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' GLN . . . . . 0.488 ' O ' ' CB ' ' A' ' 46' ' ' ILE . 32.6 tt0 -112.23 -3.65 14.56 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.219 -0.446 . . . . 75.450000000000003 110.918 179.998 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . 0.488 ' CB ' ' O ' ' A' ' 45' ' ' GLN . 0.0 OUTLIER 84.63 5.65 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.247 -0.433 . . . . 73.310000000000002 111.125 179.951 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . 0.43 ' O ' ' CD2' ' A' ' 33' ' ' LEU . 0.2 OUTLIER -63.54 141.57 17.97 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.159 -0.473 . . . . 65.25 111.15 179.82 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 48' ' ' PHE . . . . . 0.546 ' HB2' ' CE2' ' A' ' 30' ' ' PHE . 8.5 p90 -147.44 150.53 34.8 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.126 -0.488 . . . . 64.519999999999996 110.882 179.964 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 11.5 mt-10 -108.46 157.15 18.7 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.15 -0.477 . . . . 75.239999999999995 110.866 -179.903 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . 0.479 HG22 ' CD2' ' A' ' 26' ' ' TYR . 26.0 mm -136.15 141.87 40.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.159 -0.473 . . . . 74.430000000000007 111.126 179.969 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 52.8 m -89.39 126.36 35.51 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.197 -0.456 . . . . 71.019999999999996 111.125 179.949 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . 0.429 HD12 ' CD1' ' A' ' 66' ' ' LEU . 23.7 mt -130.34 162.05 29.93 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.212 -0.449 . . . . 75.200000000000003 110.921 179.95 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -179.26 173.88 1.08 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.207 -0.452 . . . . 74.019999999999996 110.859 179.919 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -64.69 166.66 8.42 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.207 -0.451 . . . . 73.319999999999993 110.857 -179.78 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 16.4 m -77.73 -28.56 15.74 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.11 -0.495 . . . . 74.120000000000005 111.099 179.988 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 3.1 t0 -118.78 -168.16 1.5 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.191 -0.459 . . . . 71.510000000000005 110.88 179.878 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 1.3 mmmp? -118.04 -16.81 9.79 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.208 -0.451 . . . . 74.420000000000002 110.877 -179.953 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . 0.552 ' HA ' ' C ' ' A' ' 59' ' ' PRO . 43.0 mt-10 -118.27 143.05 32.26 Favored Pre-proline 0 C--N 1.329 -0.31 0 CA-C-O 121.597 0.713 . . . . 71.129999999999995 110.921 179.969 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 59' ' ' PRO . . . . . 0.552 ' C ' ' HA ' ' A' ' 58' ' ' GLU . 53.6 Cg_endo -69.83 -10.89 11.87 Favored 'Cis proline' 0 C--O 1.232 0.191 0 C-N-CA 122.701 -1.791 . . . . 74.439999999999998 112.324 0.095 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 60' ' ' VAL . . . . . 0.438 HG21 ' CG ' ' A' ' 129' ' ' GLN . 9.4 m -149.41 172.11 1.68 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.236 -0.438 . . . . 74.310000000000002 111.128 179.91 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . 0.447 ' O ' ' C ' ' A' ' 62' ' ' SER . 1.0 OUTLIER -109.23 -16.64 14.02 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.155 -0.475 . . . . 62.439999999999998 110.879 -179.929 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 62' ' ' SER . . . . . 0.447 ' C ' ' O ' ' A' ' 61' ' ' GLU . 0.3 OUTLIER 34.2 88.54 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.137 -0.483 . . . . 64.400000000000006 110.888 -179.802 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 15.6 t -105.93 123.44 47.99 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.131 -0.486 . . . . 70.019999999999996 110.842 -179.799 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 64' ' ' ILE . . . . . . . . . . . . . 50.3 mt -141.01 137.88 34.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.124 -0.489 . . . . 73.510000000000005 111.172 179.937 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 62.5 m -97.68 114.75 26.78 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.173 -0.467 . . . . 71.430000000000007 111.206 179.918 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . 0.429 ' CD1' HD12 ' A' ' 52' ' ' LEU . 11.0 mt -91.46 111.85 23.52 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.221 -0.445 . . . . 62.399999999999999 110.96 179.951 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 1.1 t60 -107.72 112.29 24.9 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.209 -0.451 . . . . 73.319999999999993 110.839 179.899 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 68' ' ' PHE . . . . . 0.569 ' CZ ' HG22 ' A' ' 114' ' ' ILE . 0.0 OUTLIER -103.19 141.06 36.52 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.18 -0.464 . . . . 72.109999999999999 110.857 -179.91 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . 0.408 ' CB ' HG23 ' A' ' 47' ' ' ILE . . . -122.43 128.72 51.26 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.161 -0.472 . . . . 74.329999999999998 111.101 179.893 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 70' ' ' MET . . . . . 0.404 ' CB ' ' HG2' ' A' ' 15' ' ' GLN . 0.1 OUTLIER -94.6 110.08 21.93 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.222 -0.445 . . . . 75.120000000000005 110.905 179.959 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -62.38 157.98 51.37 Favored Pre-proline 0 C--N 1.33 -0.257 0 CA-C-O 121.61 0.719 . . . . 63.439999999999998 111.157 -179.931 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.78 2.52 3.47 Favored 'Trans proline' 0 C--N 1.342 0.2 0 C-N-CA 122.695 2.264 . . . . 71.030000000000001 112.318 179.989 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 73' ' ' MET . . . . . 0.507 ' O ' ' CB ' ' A' ' 76' ' ' TYR . 1.3 mtp -120.01 -25.39 5.8 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.23 -0.441 . . . . 52.229999999999997 110.854 179.952 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 74' ' ' TYR . . . . . 0.648 ' CD1' ' C ' ' A' ' 74' ' ' TYR . 0.1 OUTLIER -47.89 148.65 2.72 Favored Pre-proline 0 C--N 1.329 -0.325 0 CA-C-O 121.699 0.762 . . . . 73.040000000000006 110.885 -179.84 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 75' ' ' PRO . . . . . 0.542 ' C ' ' HA ' ' A' ' 74' ' ' TYR . 53.7 Cg_endo -69.8 -14.41 12.56 Favored 'Cis proline' 0 C--N 1.342 0.207 0 C-N-CA 122.631 -1.82 . . . . 75.319999999999993 112.348 -0.051 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 76' ' ' TYR . . . . . 0.507 ' CB ' ' O ' ' A' ' 73' ' ' MET . 10.3 t80 -33.36 -45.14 0.15 Allowed 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.215 -0.448 . . . . 75.409999999999997 110.928 -179.926 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 77' ' ' THR . . . . . 0.451 ' CG2' ' HB2' ' A' ' 73' ' ' MET . 59.7 p -110.82 178.12 4.46 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.077 -0.51 . . . . 73.019999999999996 111.147 -179.957 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -94.81 133.22 26.9 Favored Pre-proline 0 C--N 1.329 -0.301 0 CA-C-O 121.571 0.7 . . . . 61.149999999999999 111.091 179.856 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 79' ' ' PRO . . . . . 0.465 ' HG3' ' CD1' ' A' ' 113' ' ' ILE . 53.9 Cg_endo -69.74 -163.74 0.11 Allowed 'Trans proline' 0 C--N 1.341 0.138 0 C-N-CA 122.687 2.258 . . . . 71.239999999999995 112.32 -179.985 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 3.3 tt0 -148.52 136.61 21.0 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.192 -0.458 . . . . 53.530000000000001 110.884 -179.996 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 81' ' ' ILE . . . . . 0.48 ' CG1' ' HA ' ' A' ' 68' ' ' PHE . 12.4 mt -143.51 150.53 17.3 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.147 -0.479 . . . . 75.540000000000006 111.101 179.995 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . 0.479 ' HG3' ' CD ' ' A' ' 84' ' ' LYS . 10.1 pt-20 -147.69 148.25 30.83 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.156 -0.474 . . . . 72.530000000000001 110.871 179.956 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 83' ' ' PHE . . . . . 0.516 ' CZ ' ' HD3' ' A' ' 98' ' ' LYS . 8.0 m-85 -88.28 140.84 29.06 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.149 -0.478 . . . . 75.019999999999996 110.871 -179.92 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 84' ' ' LYS . . . . . 0.479 ' CD ' ' HG3' ' A' ' 82' ' ' GLU . 7.8 mmmt -125.68 174.57 8.2 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.179 -0.464 . . . . 74.010000000000005 110.91 179.927 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . 0.44 ' N ' HD21 ' A' ' 85' ' ' ASN . 1.7 m-80 61.99 -74.32 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.214 -0.448 . . . . 64.409999999999997 110.882 179.938 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 86' ' ' VAL . . . . . 0.47 ' N ' ' O ' ' A' ' 84' ' ' LYS . 3.5 m 41.42 90.53 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.227 -0.442 . . . . 63.030000000000001 111.132 179.924 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -102.89 -67.8 0.86 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.141 -0.481 . . . . 73.209999999999994 110.962 -179.992 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 88' ' ' ASN . . . . . 0.435 ' CG ' ' HB ' ' A' ' 60' ' ' VAL . 13.3 m120 -88.24 55.46 3.44 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.212 -0.449 . . . . 74.129999999999995 110.857 -179.958 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 1.6 p -156.21 138.48 6.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.171 -0.468 . . . . 73.340000000000003 111.102 179.891 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 90' ' ' MET . . . . . . . . . . . . . 11.2 mtm -83.95 -71.17 0.52 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.146 -0.479 . . . . 75.209999999999994 110.863 179.949 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 1.1 p30 176.9 -28.67 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.2 -0.454 . . . . 74.219999999999999 110.874 179.923 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -53.85 -44.11 70.07 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.228 -0.442 . . . . 74.140000000000001 110.824 -179.791 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 93' ' ' GLN . . . . . 0.517 ' HG3' ' CE2' ' A' ' 128' ' ' PHE . 0.1 OUTLIER -70.55 -38.55 74.17 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.129 -0.487 . . . . 73.549999999999997 110.892 -179.922 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . 0.421 ' CD2' HG12 ' A' ' 86' ' ' VAL . 0.1 OUTLIER -58.99 -49.2 78.78 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.192 -0.458 . . . . 73.400000000000006 110.891 -179.972 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 43.8 mt-30 -62.84 -34.69 77.86 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.203 -0.453 . . . . 65.25 110.938 179.911 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 96' ' ' MET . . . . . . . . . . . . . 24.2 ttp -61.12 -37.7 83.74 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.2 -0.454 . . . . 75.510000000000005 110.861 179.949 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 97' ' ' LEU . . . . . 0.591 ' O ' ' CD1' ' A' ' 101' ' ' PHE . 83.5 mt -65.33 -43.13 91.93 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.264 -0.425 . . . . 75.109999999999999 110.94 179.992 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 98' ' ' LYS . . . . . 0.516 ' HD3' ' CZ ' ' A' ' 83' ' ' PHE . 6.7 mmtp -58.67 -36.68 74.54 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.164 -0.471 . . . . 73.030000000000001 110.922 179.853 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -64.2 -44.93 90.46 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.187 -0.46 . . . . 75.230000000000004 110.817 -179.899 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 100' ' ' GLU . . . . . 0.525 ' HG2' ' CE1' ' A' ' 120' ' ' PHE . 2.5 mp0 -69.62 -25.39 63.92 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.137 -0.483 . . . . 71.540000000000006 110.868 -179.9 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 101' ' ' PHE . . . . . 0.591 ' CD1' ' O ' ' A' ' 97' ' ' LEU . 11.9 m-30 -60.06 -34.98 74.16 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.185 -0.461 . . . . 74.340000000000003 110.896 -179.927 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 4.2 tppp? -70.79 -38.78 73.39 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.187 -0.461 . . . . 73.510000000000005 110.877 179.954 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 25.2 mtmm -70.39 -42.9 71.11 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.187 -0.461 . . . . 73.140000000000001 110.881 179.92 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 3.9 mt -62.19 -47.38 93.39 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.224 -0.444 . . . . 72.120000000000005 111.133 179.883 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 105' ' ' HIS . . . . . . . . . . . . . 7.7 t60 -62.65 -42.63 99.71 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.17 -0.468 . . . . 74.209999999999994 110.815 179.887 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 1.2 m-20 -59.4 -43.52 92.97 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.195 -0.457 . . . . 75.549999999999997 110.888 -179.875 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 8.9 t -76.84 -27.64 55.18 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.192 -0.458 . . . . 62.219999999999999 111.12 -179.995 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -114.84 36.21 3.95 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.267 -0.424 . . . . 73.519999999999996 110.813 -179.83 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -78.38 75.38 4.9 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.185 -0.461 . . . . 74.430000000000007 110.877 -179.972 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 162.06 -27.34 0.26 Allowed Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.765 -0.731 . . . . 73.310000000000002 112.504 -179.986 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 111' ' ' GLN . . . . . . . . . . . . . 2.6 pt20 -120.06 -168.38 1.6 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.779 0.323 . . . . 75.549999999999997 110.94 -179.917 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 28.4 mt-10 -53.71 135.32 41.33 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.198 -0.456 . . . . 75.219999999999999 110.898 -179.961 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 113' ' ' ILE . . . . . 0.465 ' CD1' ' HG3' ' A' ' 79' ' ' PRO . 1.2 pt -126.5 -25.74 1.48 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 116.125 -0.488 . . . . 75.409999999999997 111.11 179.981 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 114' ' ' ILE . . . . . 0.569 HG22 ' CZ ' ' A' ' 68' ' ' PHE . 1.1 mp -57.07 -44.46 83.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.188 -0.46 . . . . 75.129999999999995 111.129 179.865 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 115' ' ' PHE . . . . . 0.558 ' CD1' HD12 ' A' ' 25' ' ' ILE . 39.8 t80 -64.35 -35.33 80.52 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.155 -0.475 . . . . 73.349999999999994 110.875 179.926 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 37.1 mm-40 -67.89 -44.87 76.0 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.13 -0.486 . . . . 75.519999999999996 110.903 -179.92 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 117' ' ' ILE . . . . . 0.521 HD13 ' CG ' ' A' ' 101' ' ' PHE . 0.3 OUTLIER -65.94 -40.83 88.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.153 -0.476 . . . . 71.319999999999993 111.114 179.987 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 118' ' ' THR . . . . . 0.464 ' N ' ' CG2' ' A' ' 117' ' ' ILE . 66.6 p -67.6 -43.86 79.46 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.177 -0.465 . . . . 73.530000000000001 111.175 179.911 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 45.2 t -68.32 -39.39 81.98 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.218 -0.446 . . . . 72.040000000000006 110.829 -179.814 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 120' ' ' PHE . . . . . 0.525 ' CE1' ' HG2' ' A' ' 100' ' ' GLU . 4.1 t80 -68.98 -48.13 63.9 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.115 -0.493 . . . . 63.229999999999997 110.904 -179.956 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 75.6 p -63.7 -39.98 95.66 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.129 -0.487 . . . . 74.129999999999995 111.108 -179.909 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 122' ' ' GLN . . . . . 0.456 ' NE2' ' O ' ' A' ' 122' ' ' GLN . 0.0 OUTLIER -64.63 -50.66 66.25 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.213 -0.449 . . . . 74.040000000000006 110.895 -179.981 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 123' ' ' GLU . . . . . 0.43 ' CG ' ' N ' ' A' ' 124' ' ' LYS . 5.7 pt-20 -65.87 -43.82 87.22 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.191 -0.459 . . . . 62.240000000000002 110.929 -179.97 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 124' ' ' LYS . . . . . 0.463 ' CE ' ' HA ' ' A' ' 124' ' ' LYS . 0.1 OUTLIER -68.77 -31.74 70.99 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.167 -0.47 . . . . 65.109999999999999 110.917 179.949 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 1.1 tp -71.47 -43.47 66.56 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.194 -0.457 . . . . 74.109999999999999 110.913 179.933 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 6.3 t0 -68.88 -46.6 68.0 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.168 -0.469 . . . . 75.439999999999998 110.881 179.843 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 127' ' ' GLU . . . . . 0.434 ' CG ' ' HA ' ' A' ' 124' ' ' LYS . 1.0 OUTLIER -60.26 -27.85 67.58 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.164 -0.471 . . . . 74.319999999999993 110.886 -179.901 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 128' ' ' PHE . . . . . 0.517 ' CE2' ' HG3' ' A' ' 93' ' ' GLN . 0.2 OUTLIER -78.99 -52.22 8.53 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.132 -0.485 . . . . 75.540000000000006 110.893 -179.909 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 129' ' ' GLN . . . . . 0.438 ' CG ' HG21 ' A' ' 60' ' ' VAL . 1.2 tm0? -54.69 -36.91 65.17 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.152 -0.476 . . . . 73.519999999999996 110.912 -179.946 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 130' ' ' ASN . . . . . . . . . . . . . 1.7 m-20 -79.82 -77.61 0.18 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.18 -0.464 . . . . 75.030000000000001 110.871 -179.958 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 2.7 p 179.4 -39.66 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.155 -0.475 . . . . 74.420000000000002 111.15 179.97 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 132' ' ' VAL . . . . . . . . . . . . . 9.4 p -179.63 42.36 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.185 -0.461 . . . . 72.530000000000001 111.12 179.925 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 133' ' ' ASN . . . . . . . . . . . . . 1.7 m-20 -106.62 98.36 8.04 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.202 -0.454 . . . . 72.200000000000003 110.873 -179.978 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 134' ' ' THR . . . . . . . . . . . . . 32.4 p -98.62 96.68 8.11 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.171 -0.468 . . . . 75.230000000000004 111.178 179.966 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 24.4 pt20 -133.85 167.9 19.72 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.215 -0.448 . . . . 71.549999999999997 110.915 179.991 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 89.9 p -121.12 114.96 22.19 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.217 -0.447 . . . . 75.549999999999997 110.889 -179.856 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 137' ' ' LEU . . . . . . . . . . . . . 2.1 mm? -98.16 173.29 7.09 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.146 -0.479 . . . . 74.549999999999997 110.876 -179.939 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 6.4 mm-40 . . . . . 0 C--N 1.33 -0.277 0 CA-C-N 116.193 -0.458 . . . . 74.209999999999994 110.891 179.947 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.23 0.073 0 CA-C-O 120.815 0.34 . . . . 73.340000000000003 110.838 . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -103.43 155.01 18.82 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.214 -0.448 . . . . 60.039999999999999 110.876 -179.83 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -131.17 -62.05 0.9 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.132 -0.486 . . . . 61.310000000000002 110.925 179.962 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER 175.07 89.11 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.181 -0.463 . . . . 62.32 110.893 -179.968 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 3.0 m170 56.07 164.32 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.182 -0.463 . . . . 72.150000000000006 110.843 -179.966 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER 41.91 86.27 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.179 -0.464 . . . . 50.149999999999999 110.889 -179.936 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' THR . . . . . 0.445 ' OG1' ' N ' ' A' ' 8' ' ' LEU . 0.0 OUTLIER -178.72 171.63 1.46 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.2 -0.454 . . . . 73.230000000000004 111.137 179.964 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . 0.445 ' N ' ' OG1' ' A' ' 7' ' ' THR . 18.3 mt -52.94 -27.45 18.94 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.219 -0.446 . . . . 73.219999999999999 110.905 179.972 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 9.8 t70 -53.59 -28.47 32.43 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.157 -0.474 . . . . 74.019999999999996 110.891 179.823 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . 0.427 ' O ' ' HG2' ' A' ' 13' ' ' GLU . 6.1 mm-40 -68.13 -38.65 82.43 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.208 -0.451 . . . . 71.510000000000005 110.93 -179.944 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 25.9 m-85 -70.37 -21.85 62.83 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.189 -0.46 . . . . 71.439999999999998 110.893 -179.867 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -57.23 -41.17 79.01 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.133 -0.485 . . . . 75.430000000000007 110.939 -179.952 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . 0.468 ' HG3' ' N ' ' A' ' 14' ' ' ILE . 4.1 pt-20 -66.32 -40.23 89.8 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.12 -0.491 . . . . 74.140000000000001 110.908 179.995 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . 0.468 ' N ' ' HG3' ' A' ' 13' ' ' GLU . 3.4 mp -67.76 -39.86 82.76 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-N 116.12 -0.491 . . . . 73.420000000000002 111.136 179.961 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 93.5 mt-30 -64.09 -48.37 76.41 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.206 -0.452 . . . . 73.409999999999997 110.915 179.933 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -63.9 -36.86 85.33 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.144 -0.48 . . . . 65.230000000000004 110.862 -179.918 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -58.05 -33.92 69.53 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.159 -0.473 . . . . 75.310000000000002 110.906 -179.872 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 1.2 mp0 -66.04 -38.17 87.73 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.182 -0.463 . . . . 74.129999999999995 110.891 179.996 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . 0.536 HD12 ' CE1' ' A' ' 48' ' ' PHE . 8.7 mp -65.6 -51.28 60.9 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.117 -0.492 . . . . 72.420000000000002 110.923 -179.954 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -68.64 -35.55 77.42 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.201 -0.454 . . . . 73.140000000000001 110.879 179.944 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -66.57 -50.53 62.79 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.182 -0.463 . . . . 62.310000000000002 111.127 179.884 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . 0.454 ' N ' HD13 ' A' ' 22' ' ' ILE . 0.7 OUTLIER -73.84 -34.19 39.46 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.239 -0.437 . . . . 72.239999999999995 111.117 179.971 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 34.4 mtp180 -52.25 -35.58 50.16 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.178 -0.464 . . . . 75.430000000000007 110.865 179.973 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -67.18 -35.05 78.83 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.173 -0.467 . . . . 73.349999999999994 110.863 -179.78 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 3.9 mt -78.11 -45.23 27.33 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.129 -0.487 . . . . 73.120000000000005 111.165 179.933 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 30.2 m-85 -109.9 43.32 1.36 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.148 -0.478 . . . . 73.230000000000004 110.924 -179.915 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 1.8 mtm -40.72 -55.63 2.35 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.094 -0.503 . . . . 75.439999999999998 110.877 179.926 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -86.85 -25.76 24.35 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.249 -0.432 . . . . 72.230000000000004 110.812 -179.979 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -92.77 31.21 1.42 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.183 -0.462 . . . . 73.510000000000005 110.882 179.989 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 10.1 t80 -115.59 130.55 56.91 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.155 -0.475 . . . . 74.519999999999996 110.882 -179.913 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 53.8 m -117.46 126.39 52.54 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.131 -0.486 . . . . 61.219999999999999 111.133 -179.916 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 4.6 t0 -101.04 114.81 29.09 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.201 -0.454 . . . . 64.239999999999995 110.868 179.913 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . 0.569 ' CD1' ' C ' ' A' ' 33' ' ' LEU . 0.2 OUTLIER -119.24 5.88 11.23 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.209 -0.451 . . . . 75.409999999999997 110.912 -179.943 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' THR . . . . . 0.423 ' N ' HD11 ' A' ' 33' ' ' LEU . 2.1 m -63.88 174.73 1.36 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.18 -0.463 . . . . 71.0 111.14 179.934 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . 0.442 ' CD ' ' HA ' ' A' ' 44' ' ' PRO . 0.0 OUTLIER -75.08 57.22 0.82 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.188 -0.46 . . . . 71.349999999999994 110.894 179.867 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -102.07 142.41 33.38 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.27 -0.423 . . . . 73.530000000000001 110.915 179.932 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . 0.487 ' O ' ' CB ' ' A' ' 38' ' ' SER . 2.8 mmtt 47.39 36.28 4.8 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.181 -0.463 . . . . 75.319999999999993 110.922 179.995 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' SER . . . . . 0.487 ' CB ' ' O ' ' A' ' 37' ' ' LYS . 0.5 OUTLIER 161.07 57.48 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.189 -0.459 . . . . 65.540000000000006 110.827 -179.911 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 4.3 m -82.42 156.56 24.08 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.16 -0.473 . . . . 73.310000000000002 110.877 -179.821 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' TRP . . . . . . . . . . . . . 8.6 t-105 -102.39 -23.96 13.9 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.139 -0.482 . . . . 72.099999999999994 110.924 -179.996 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . 0.591 ' O ' ' C ' ' A' ' 42' ' ' LYS . 33.9 t70 -164.8 54.92 0.13 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.227 -0.442 . . . . 74.329999999999998 110.899 179.952 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . 0.591 ' C ' ' O ' ' A' ' 41' ' ' ASP . 0.0 OUTLIER 21.11 69.0 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.211 -0.45 . . . . 74.030000000000001 110.896 -179.972 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 7.8 mt-30 -159.08 61.78 1.94 Allowed Pre-proline 0 C--N 1.33 -0.282 0 CA-C-O 121.568 0.699 . . . . 74.25 110.878 179.95 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' PRO . . . . . 0.442 ' HA ' ' CD ' ' A' ' 35' ' ' LYS . 53.6 Cg_endo -69.77 111.86 2.92 Favored 'Trans proline' 0 C--N 1.341 0.154 0 C-N-CA 122.686 2.257 . . . . 75.239999999999995 112.332 179.958 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' GLN . . . . . 0.459 ' O ' ' CB ' ' A' ' 46' ' ' ILE . 12.8 tt0 -67.72 -3.15 8.38 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.224 -0.443 . . . . 74.549999999999997 110.911 -179.98 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . 0.464 ' O ' ' C ' ' A' ' 47' ' ' ILE . 0.0 OUTLIER 81.89 -29.76 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.175 -0.466 . . . . 75.239999999999995 111.149 179.966 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . 0.464 ' C ' ' O ' ' A' ' 46' ' ' ILE . 0.2 OUTLIER -31.33 147.05 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 116.158 -0.474 . . . . 75.319999999999993 111.147 179.815 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 48' ' ' PHE . . . . . 0.536 ' CE1' HD12 ' A' ' 19' ' ' LEU . 2.0 p90 -158.9 166.35 32.05 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.207 -0.451 . . . . 74.340000000000003 110.843 179.968 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . 0.471 ' CG ' ' HB2' ' A' ' 67' ' ' HIS . 6.3 mt-10 -108.87 161.08 15.47 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.125 -0.489 . . . . 74.230000000000004 110.856 -179.926 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 8.6 mm -142.92 138.32 27.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-N 116.138 -0.483 . . . . 74.450000000000003 111.103 179.972 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 78.2 m -91.05 128.99 37.08 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.201 -0.454 . . . . 74.329999999999998 111.137 179.963 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 16.9 mt -130.32 166.02 21.27 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.254 -0.43 . . . . 74.349999999999994 110.934 179.946 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 53' ' ' ARG . . . . . 0.436 ' CB ' ' O ' ' A' ' 62' ' ' SER . 5.4 ptt180 -177.48 171.18 1.98 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.2 -0.454 . . . . 72.439999999999998 110.876 179.963 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 54' ' ' SER . . . . . 0.429 ' N ' ' OG ' ' A' ' 62' ' ' SER . 6.4 p -63.23 -175.8 0.12 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.196 -0.456 . . . . 73.0 110.829 -179.822 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 22.0 m -91.51 -22.96 5.96 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.118 -0.492 . . . . 71.209999999999994 111.13 179.936 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 3.2 t0 -118.55 -172.96 2.38 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.164 -0.471 . . . . 72.430000000000007 110.873 179.904 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -118.83 -4.05 10.72 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.166 -0.47 . . . . 73.540000000000006 110.886 -179.999 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . 0.528 ' HA ' ' C ' ' A' ' 59' ' ' PRO . 5.1 mm-40 -136.33 150.29 70.31 Favored Pre-proline 0 C--N 1.329 -0.287 0 CA-C-O 121.649 0.738 . . . . 73.219999999999999 110.911 179.937 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 59' ' ' PRO . . . . . 0.528 ' C ' ' HA ' ' A' ' 58' ' ' GLU . 54.1 Cg_endo -69.73 -1.85 6.81 Favored 'Cis proline' 0 C--N 1.341 0.162 0 C-N-CA 122.707 -1.789 . . . . 74.200000000000003 112.361 -0.038 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 60' ' ' VAL . . . . . 0.476 ' CG2' ' CG ' ' A' ' 129' ' ' GLN . 34.5 m -144.86 168.6 9.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.231 -0.44 . . . . 72.209999999999994 111.162 179.883 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . 0.41 ' O ' ' O ' ' A' ' 62' ' ' SER . 22.3 tt0 -100.03 -29.14 12.7 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.168 -0.469 . . . . 65.420000000000002 110.909 -179.966 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 62' ' ' SER . . . . . 0.436 ' O ' ' CB ' ' A' ' 53' ' ' ARG . 20.1 p 50.69 102.86 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.155 -0.475 . . . . 74.340000000000003 110.852 -179.81 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 63' ' ' SER . . . . . 0.43 ' N ' HE21 ' A' ' 87' ' ' GLN . 49.7 p -129.55 122.93 30.18 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.133 -0.485 . . . . 72.230000000000004 110.831 -179.8 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 64' ' ' ILE . . . . . 0.467 HD13 ' CG2' ' A' ' 89' ' ' VAL . 52.8 mt -143.93 132.03 18.34 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.163 -0.472 . . . . 74.150000000000006 111.179 179.9 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 91.7 m -92.93 119.33 32.11 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.228 -0.442 . . . . 74.540000000000006 111.168 179.954 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . 0.499 ' HB3' ' CE2' ' A' ' 68' ' ' PHE . 1.5 mp -97.39 109.82 22.5 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.188 -0.46 . . . . 65.120000000000005 110.917 179.989 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 67' ' ' HIS . . . . . 0.567 ' CE1' HD22 ' A' ' 33' ' ' LEU . 39.9 t60 -102.05 109.69 21.47 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.152 -0.476 . . . . 73.409999999999997 110.841 179.873 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 68' ' ' PHE . . . . . 0.499 ' CE2' ' HB3' ' A' ' 66' ' ' LEU . 0.0 OUTLIER -104.08 139.91 38.51 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.184 -0.462 . . . . 73.239999999999995 110.873 -179.919 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . 0.443 ' O ' ' CB ' ' A' ' 79' ' ' PRO . . . -121.23 120.6 35.65 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.168 -0.469 . . . . 65.230000000000004 111.116 179.912 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 70' ' ' MET . . . . . 0.47 ' HE3' ' CG1' ' A' ' 114' ' ' ILE . 1.7 mmt -85.34 89.95 7.8 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.241 -0.436 . . . . 64.129999999999995 110.875 179.998 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -41.26 160.33 0.15 Allowed Pre-proline 0 C--N 1.33 -0.277 0 CA-C-O 121.595 0.712 . . . . 73.349999999999994 111.13 -179.913 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.78 2.97 3.06 Favored 'Trans proline' 0 C--N 1.341 0.162 0 C-N-CA 122.704 2.269 . . . . 71.510000000000005 112.34 179.953 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 73' ' ' MET . . . . . 0.501 ' O ' ' CB ' ' A' ' 76' ' ' TYR . 0.1 OUTLIER -121.44 -25.24 5.21 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.216 -0.447 . . . . 74.109999999999999 110.911 179.869 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 74' ' ' TYR . . . . . 0.632 ' CD1' ' C ' ' A' ' 74' ' ' TYR . 0.0 OUTLIER -46.95 149.86 1.47 Allowed Pre-proline 0 C--N 1.329 -0.315 0 CA-C-O 121.684 0.754 . . . . 70.049999999999997 110.945 -179.904 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 75' ' ' PRO . . . . . 0.56 ' HA ' ' CD2' ' A' ' 74' ' ' TYR . 53.7 Cg_endo -69.75 -10.79 11.65 Favored 'Cis proline' 0 C--O 1.232 0.186 0 C-N-CA 122.673 -1.803 . . . . 74.099999999999994 112.338 -0.103 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 76' ' ' TYR . . . . . 0.501 ' CB ' ' O ' ' A' ' 73' ' ' MET . 20.9 t80 -33.81 -45.46 0.19 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.262 -0.427 . . . . 74.219999999999999 110.937 -179.924 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 16.8 p -114.86 -175.03 2.6 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.118 -0.492 . . . . 74.209999999999994 111.152 179.998 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -99.94 132.96 22.01 Favored Pre-proline 0 C--N 1.329 -0.291 0 CA-C-O 121.566 0.698 . . . . 72.310000000000002 111.123 179.863 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 79' ' ' PRO . . . . . 0.443 ' CB ' ' O ' ' A' ' 69' ' ' ALA . 54.0 Cg_endo -69.75 -164.21 0.12 Allowed 'Trans proline' 0 C--N 1.341 0.175 0 C-N-CA 122.71 2.273 . . . . 73.099999999999994 112.336 180.0 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 9.4 tt0 -131.73 129.2 40.33 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.171 -0.468 . . . . 63.350000000000001 110.857 -179.944 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 5.1 mm -120.64 145.58 26.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.157 -0.474 . . . . 74.319999999999993 111.085 179.994 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . 0.494 ' HG3' ' CD ' ' A' ' 84' ' ' LYS . 4.2 pt-20 -149.01 136.44 20.24 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.162 -0.472 . . . . 64.319999999999993 110.898 179.944 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 83' ' ' PHE . . . . . 0.497 ' CG ' HD23 ' A' ' 94' ' ' LEU . 38.5 m-85 -93.08 138.63 31.36 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.156 -0.474 . . . . 75.319999999999993 110.836 -179.888 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 84' ' ' LYS . . . . . 0.494 ' CD ' ' HG3' ' A' ' 82' ' ' GLU . 9.7 mmmt -124.93 171.88 9.84 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.113 -0.494 . . . . 72.109999999999999 110.915 179.942 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . 0.434 ' C ' HG23 ' A' ' 86' ' ' VAL . 7.8 m-80 61.24 -74.47 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.2 -0.455 . . . . 70.409999999999997 110.923 179.978 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 86' ' ' VAL . . . . . 0.487 ' N ' ' O ' ' A' ' 84' ' ' LYS . 2.8 m 41.61 84.59 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.179 -0.464 . . . . 74.430000000000007 111.092 179.864 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 87' ' ' GLN . . . . . 0.43 HE21 ' N ' ' A' ' 63' ' ' SER . 0.4 OUTLIER -93.06 -79.66 0.4 Allowed 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.18 -0.464 . . . . 72.049999999999997 110.923 -179.984 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -54.41 -44.16 72.12 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.194 -0.457 . . . . 73.400000000000006 110.887 -179.988 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 89' ' ' VAL . . . . . 0.467 ' CG2' HD13 ' A' ' 64' ' ' ILE . 1.7 t -62.21 151.74 7.36 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.163 -0.472 . . . . 63.329999999999998 111.136 179.932 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 90' ' ' MET . . . . . . . . . . . . . 14.8 mtm -102.25 -70.35 0.75 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.192 -0.458 . . . . 73.310000000000002 110.864 179.897 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 3.0 p-10 -172.26 -36.95 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.255 -0.429 . . . . 74.019999999999996 110.898 179.989 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -54.28 -41.51 68.95 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.179 -0.464 . . . . 74.109999999999999 110.843 -179.802 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 93' ' ' GLN . . . . . 0.478 ' CD ' ' CD2' ' A' ' 128' ' ' PHE . 0.8 OUTLIER -69.03 -42.03 76.91 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.16 -0.473 . . . . 75.019999999999996 110.95 -179.965 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . 0.497 HD23 ' CG ' ' A' ' 83' ' ' PHE . 50.8 mt -59.36 -49.03 79.38 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.137 -0.483 . . . . 72.25 110.931 -179.993 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 1.8 mm100 -65.98 -36.13 82.48 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.148 -0.478 . . . . 75.140000000000001 110.905 179.921 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 96' ' ' MET . . . . . 0.453 ' SD ' ' CE1' ' A' ' 128' ' ' PHE . 49.8 ttp -60.89 -38.58 86.15 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.168 -0.469 . . . . 72.049999999999997 110.851 179.99 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 97' ' ' LEU . . . . . 0.61 ' O ' ' CD1' ' A' ' 101' ' ' PHE . 98.4 mt -60.62 -46.8 88.92 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.238 -0.437 . . . . 71.420000000000002 110.959 -179.984 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 12.8 mmtm -55.8 -34.66 65.53 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.148 -0.478 . . . . 73.319999999999993 110.878 179.822 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 67.1 m -68.7 -45.74 70.82 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.25 -0.432 . . . . 63.130000000000003 110.861 -179.87 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 8.6 pt-20 -75.16 -23.47 57.77 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.106 -0.497 . . . . 72.150000000000006 110.885 -179.958 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 101' ' ' PHE . . . . . 0.61 ' CD1' ' O ' ' A' ' 97' ' ' LEU . 8.0 m-30 -59.09 -34.37 71.92 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.175 -0.466 . . . . 73.409999999999997 110.877 -179.933 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.34 -42.83 98.97 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.114 -0.494 . . . . 71.219999999999999 110.929 179.989 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 21.0 mtmm -64.91 -37.81 88.89 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.2 -0.455 . . . . 72.120000000000005 110.916 179.818 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 104' ' ' ILE . . . . . 0.517 HD12 ' CD2' ' A' ' 120' ' ' PHE . 3.0 mt -65.01 -47.55 87.58 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 116.236 -0.438 . . . . 72.409999999999997 111.132 179.853 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 105' ' ' HIS . . . . . . . . . . . . . 4.3 t60 -62.97 -41.49 99.55 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.172 -0.467 . . . . 74.329999999999998 110.868 179.901 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -60.63 -43.3 97.67 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.188 -0.46 . . . . 72.409999999999997 110.887 -179.952 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 9.2 t -78.95 -28.74 43.73 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.194 -0.457 . . . . 75.430000000000007 111.172 179.986 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 12.5 m -114.77 40.4 2.61 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.239 -0.437 . . . . 63.450000000000003 110.845 -179.839 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 34.5 ttt180 -84.8 90.32 7.73 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.14 -0.482 . . . . 74.420000000000002 110.837 -179.927 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 110' ' ' GLY . . . . . 0.44 ' HA2' ' CB ' ' A' ' 75' ' ' PRO . . . 110.59 45.33 0.91 Allowed Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.725 -0.75 . . . . 74.5 112.49 -179.973 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 111' ' ' GLN . . . . . 0.422 ' O ' ' CB ' ' A' ' 112' ' ' GLU . 5.1 pt20 -174.33 28.52 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.745 0.307 . . . . 72.420000000000002 110.897 -179.918 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 112' ' ' GLU . . . . . 0.422 ' CB ' ' O ' ' A' ' 111' ' ' GLN . 0.2 OUTLIER 78.07 135.73 0.06 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.207 -0.451 . . . . 62.520000000000003 110.87 -179.989 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 113' ' ' ILE . . . . . . . . . . . . . 31.9 pt -133.46 -0.31 1.43 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.183 -0.462 . . . . 73.109999999999999 111.136 179.968 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 114' ' ' ILE . . . . . 0.47 ' CG1' ' HE3' ' A' ' 70' ' ' MET . 25.6 mm -63.34 -45.43 98.15 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.2 -0.454 . . . . 74.430000000000007 111.132 179.876 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 115' ' ' PHE . . . . . . . . . . . . . 26.6 t80 -72.65 -34.63 67.4 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.188 -0.46 . . . . 75.409999999999997 110.874 179.93 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 4.3 mm-40 -67.8 -47.63 68.57 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.144 -0.48 . . . . 62.229999999999997 110.893 -179.928 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 117' ' ' ILE . . . . . 0.563 HD12 ' CD2' ' A' ' 101' ' ' PHE . 0.9 OUTLIER -63.47 -40.61 89.69 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.14 -0.482 . . . . 74.219999999999999 111.103 179.976 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 118' ' ' THR . . . . . 0.459 ' N ' ' CG2' ' A' ' 117' ' ' ILE . 64.5 p -68.07 -42.77 79.91 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.169 -0.469 . . . . 53.409999999999997 111.108 -179.955 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 67.6 m -67.89 -44.25 77.43 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.225 -0.443 . . . . 71.329999999999998 110.853 -179.843 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 120' ' ' PHE . . . . . 0.517 ' CD2' HD12 ' A' ' 104' ' ' ILE . 0.2 OUTLIER -60.74 -50.27 74.15 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.139 -0.482 . . . . 74.329999999999998 110.888 -179.959 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 121' ' ' THR . . . . . 0.403 ' CG2' ' CE1' ' A' ' 101' ' ' PHE . 81.4 p -65.54 -40.71 93.22 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.171 -0.468 . . . . 70.329999999999998 111.146 -179.95 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 8.4 tm0? -64.23 -38.85 92.52 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.191 -0.459 . . . . 71.329999999999998 110.911 -179.985 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 4.4 pt-20 -77.5 -40.48 42.69 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.216 -0.447 . . . . 72.150000000000006 110.916 -179.976 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 124' ' ' LYS . . . . . 0.466 ' CE ' ' HA ' ' A' ' 124' ' ' LYS . 0.0 OUTLIER -68.57 -41.06 80.27 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.128 -0.487 . . . . 75.310000000000002 110.815 -179.982 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 125' ' ' LEU . . . . . 0.431 ' CD2' ' O ' ' A' ' 125' ' ' LEU . 0.5 OUTLIER -68.39 -38.26 81.15 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.253 -0.43 . . . . 74.209999999999994 110.926 179.945 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 126' ' ' ASP . . . . . 0.433 ' C ' ' OD1' ' A' ' 126' ' ' ASP . 1.2 t0 -61.78 -45.59 93.22 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.202 -0.454 . . . . 54.329999999999998 110.886 179.817 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 127' ' ' GLU . . . . . 0.434 ' HG3' ' N ' ' A' ' 128' ' ' PHE . 7.4 pt-20 -69.68 -31.17 69.06 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.202 -0.454 . . . . 72.450000000000003 110.899 -179.892 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 128' ' ' PHE . . . . . 0.478 ' CD2' ' CD ' ' A' ' 93' ' ' GLN . 0.3 OUTLIER -69.14 -44.23 72.73 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.138 -0.483 . . . . 74.420000000000002 110.836 -179.886 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 129' ' ' GLN . . . . . 0.476 ' CG ' ' CG2' ' A' ' 60' ' ' VAL . 1.4 tm0? -58.32 -44.74 88.77 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.154 -0.475 . . . . 75.519999999999996 110.923 -179.921 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 130' ' ' ASN . . . . . . . . . . . . . 1.8 m-20 -75.48 -80.24 0.09 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.197 -0.456 . . . . 64.319999999999993 110.906 -179.985 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -177.05 -58.93 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.151 -0.477 . . . . 72.140000000000001 111.134 179.908 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 132' ' ' VAL . . . . . . . . . . . . . 72.9 t -143.92 146.57 20.73 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.181 -0.463 . . . . 73.010000000000005 111.124 179.938 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 133' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -179.73 90.13 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.166 -0.47 . . . . 71.0 110.914 -179.955 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 134' ' ' THR . . . . . . . . . . . . . 4.1 m -100.92 147.29 26.31 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.169 -0.468 . . . . 54.240000000000002 111.125 -179.957 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 8.5 tp60 -150.59 129.5 12.51 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.205 -0.452 . . . . 73.230000000000004 110.891 -179.984 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 80.4 p -148.96 90.9 1.8 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.201 -0.454 . . . . 73.239999999999995 110.83 -179.827 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 137' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -70.62 111.62 6.25 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.151 -0.477 . . . . 73.349999999999994 110.922 179.972 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.33 -0.275 0 CA-C-N 116.192 -0.458 . . . . 73.049999999999997 110.893 179.927 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 48.7 mtm . . . . . 0 C--O 1.231 0.087 0 CA-C-O 120.79 0.329 . . . . 72.219999999999999 110.895 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER 49.93 46.59 24.17 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.226 -0.443 . . . . 74.310000000000002 110.88 -179.793 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -45.15 141.23 2.46 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.159 -0.473 . . . . 74.140000000000001 110.923 179.999 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -134.69 27.19 3.67 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.228 -0.442 . . . . 73.209999999999994 110.862 -179.926 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER 66.57 10.14 7.15 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.131 -0.486 . . . . 72.540000000000006 110.834 179.941 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -153.04 111.24 3.65 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.18 -0.464 . . . . 70.540000000000006 110.955 179.995 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 5.3 t -179.88 154.66 0.58 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.217 -0.447 . . . . 74.530000000000001 111.094 179.964 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 76.0 mt -55.09 -23.41 20.48 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.147 -0.478 . . . . 75.200000000000003 110.955 179.938 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -51.62 -34.64 38.43 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.169 -0.469 . . . . 70.310000000000002 110.828 179.883 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 16.1 mm-40 -67.95 -35.11 77.83 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.212 -0.449 . . . . 74.349999999999994 110.883 -179.863 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' TYR . . . . . 0.421 ' CD1' ' HD2' ' A' ' 75' ' ' PRO . 15.1 m-85 -65.77 -25.06 67.09 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.2 -0.455 . . . . 64.150000000000006 110.916 -179.852 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -64.59 -37.85 88.99 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.105 -0.498 . . . . 72.329999999999998 110.911 -179.884 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 2.5 mm-40 -61.56 -44.15 97.56 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.144 -0.48 . . . . 73.120000000000005 110.885 179.985 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 5.2 mp -68.03 -40.12 82.63 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.125 -0.489 . . . . 71.129999999999995 111.135 179.971 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 59.1 mt-30 -65.22 -46.33 81.09 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.159 -0.473 . . . . 63.140000000000001 110.881 179.946 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 7.0 t -63.19 -36.56 84.05 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.254 -0.43 . . . . 73.439999999999998 110.881 -179.946 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . 0.432 ' OD1' ' N ' ' A' ' 18' ' ' GLU . 0.2 OUTLIER -58.36 -33.72 69.89 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.154 -0.476 . . . . 73.239999999999995 110.889 -179.907 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . 0.432 ' N ' ' OD1' ' A' ' 17' ' ' ASN . 1.3 mp0 -66.33 -37.78 86.15 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.18 -0.464 . . . . 75.430000000000007 110.886 -179.985 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . 0.502 ' N ' HD13 ' A' ' 19' ' ' LEU . 8.8 mp -64.44 -51.51 62.75 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.18 -0.464 . . . . 75.049999999999997 110.908 -179.976 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 1.4 pt-20 -68.5 -35.86 78.1 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.202 -0.454 . . . . 73.430000000000007 110.933 179.918 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -66.66 -47.1 73.59 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.124 -0.489 . . . . 74.540000000000006 111.068 179.944 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . 0.468 ' N ' HD13 ' A' ' 22' ' ' ILE . 0.7 OUTLIER -76.21 -34.27 25.66 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-N 116.261 -0.427 . . . . 61.549999999999997 111.167 179.955 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -52.32 -34.18 45.84 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.144 -0.48 . . . . 73.430000000000007 110.87 179.973 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -66.37 -32.15 73.36 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.219 -0.446 . . . . 70.430000000000007 110.879 -179.823 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . 0.486 ' CD1' ' CE1' ' A' ' 115' ' ' PHE . 3.3 mt -84.77 -43.84 17.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.118 -0.492 . . . . 70.420000000000002 111.121 179.95 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' TYR . . . . . 0.439 ' CD2' HG22 ' A' ' 50' ' ' ILE . 19.5 m-85 -107.5 45.36 1.0 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.176 -0.465 . . . . 73.450000000000003 110.903 -179.95 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 4.1 mtm -46.26 -47.82 18.07 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.132 -0.485 . . . . 75.040000000000006 110.869 179.887 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 7.1 m-20 -98.74 -27.2 14.07 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.219 -0.446 . . . . 64.450000000000003 110.859 179.952 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 84.6 m-20 -86.11 34.4 0.62 Allowed 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.214 -0.448 . . . . 73.420000000000002 110.862 -179.995 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' PHE . . . . . 0.612 ' C ' ' CD1' ' A' ' 30' ' ' PHE . 0.1 OUTLIER -117.46 144.12 45.35 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.176 -0.465 . . . . 72.219999999999999 110.923 -179.935 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 24.4 m -127.08 135.07 50.25 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.141 -0.481 . . . . 72.219999999999999 111.18 -179.926 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -97.82 114.81 26.94 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.227 -0.442 . . . . 70.140000000000001 110.83 179.948 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . 0.559 ' C ' ' CD2' ' A' ' 33' ' ' LEU . 0.1 OUTLIER -121.81 -9.65 8.8 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.216 -0.447 . . . . 74.430000000000007 110.95 -179.979 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' THR . . . . . 0.45 ' C ' ' O ' ' A' ' 33' ' ' LEU . 0.2 OUTLIER -33.92 127.29 0.41 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.174 -0.466 . . . . 75.200000000000003 111.163 179.933 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 6.2 mtmm -56.52 84.48 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.207 -0.452 . . . . 74.230000000000004 110.898 179.888 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . 0.439 ' N ' ' O ' ' A' ' 34' ' ' THR . 0.2 OUTLIER -104.83 -69.74 0.8 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.239 -0.437 . . . . 74.329999999999998 110.824 -179.982 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 45.53 -172.03 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.189 -0.459 . . . . 73.129999999999995 110.9 179.982 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 89.5 p -97.91 -173.94 2.74 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.216 -0.447 . . . . 75.010000000000005 110.832 -179.897 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 1.4 m -48.85 99.85 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.085 -0.507 . . . . 72.230000000000004 110.849 -179.833 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' TRP . . . . . . . . . . . . . 1.5 t-105 -175.05 -68.96 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.097 -0.502 . . . . 74.319999999999993 110.904 -179.966 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 1.3 t0 -156.07 128.99 7.94 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.235 -0.439 . . . . 74.109999999999999 110.875 179.947 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . 0.457 ' C ' ' CD ' ' A' ' 44' ' ' PRO . 0.0 OUTLIER -150.79 85.08 1.35 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.224 -0.443 . . . . 74.530000000000001 110.907 179.949 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . 0.467 ' N ' ' CD ' ' A' ' 44' ' ' PRO . 15.6 tt0 -116.58 52.73 1.06 Allowed Pre-proline 0 C--N 1.329 -0.309 0 CA-C-O 121.587 0.708 . . . . 71.120000000000005 110.896 179.985 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' PRO . . . . . 0.467 ' CD ' ' N ' ' A' ' 43' ' ' GLN . 54.3 Cg_endo -69.77 -163.39 0.11 Allowed 'Trans proline' 0 C--N 1.341 0.168 0 C-N-CA 122.652 2.235 . . . . 72.140000000000001 112.39 179.971 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' GLN . . . . . 0.532 ' O ' ' CB ' ' A' ' 46' ' ' ILE . 15.1 pt20 -175.4 34.46 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.281 -0.418 . . . . 74.049999999999997 110.929 -179.96 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . 0.532 ' CB ' ' O ' ' A' ' 45' ' ' GLN . 0.2 OUTLIER 87.16 -21.88 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.174 -0.466 . . . . 65.519999999999996 111.142 -180.0 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . 0.495 ' N ' HD13 ' A' ' 47' ' ' ILE . 0.2 OUTLIER -36.5 144.54 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.205 -0.452 . . . . 74.420000000000002 111.171 179.849 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 48' ' ' PHE . . . . . 0.439 ' CE1' HD11 ' A' ' 19' ' ' LEU . 0.9 OUTLIER -161.59 158.37 26.15 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.183 -0.462 . . . . 74.239999999999995 110.896 -179.994 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . 0.477 ' CG ' ' CD1' ' A' ' 33' ' ' LEU . 20.4 mt-10 -108.76 160.99 15.52 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.137 -0.483 . . . . 72.530000000000001 110.866 -179.922 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . 0.439 HG22 ' CD2' ' A' ' 26' ' ' TYR . 15.4 mm -141.66 135.55 30.44 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.151 -0.477 . . . . 72.530000000000001 111.131 179.975 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 90.2 m -83.73 137.08 33.92 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.136 -0.484 . . . . 72.519999999999996 111.195 179.946 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 14.2 mt -136.69 160.23 39.46 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.216 -0.447 . . . . 74.230000000000004 110.92 179.943 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 7.4 ptt85 -176.14 161.6 2.38 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.18 -0.464 . . . . 73.549999999999997 110.829 179.965 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -53.63 -176.68 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.154 -0.475 . . . . 75.019999999999996 110.886 -179.823 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 15.9 m -94.41 -25.69 4.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.169 -0.469 . . . . 73.319999999999993 111.084 179.984 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -124.47 -165.99 1.45 Allowed 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.179 -0.464 . . . . 74.310000000000002 110.881 179.92 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -114.76 -14.58 11.97 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.191 -0.458 . . . . 75.420000000000002 110.854 -179.954 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . 0.543 ' HA ' ' C ' ' A' ' 59' ' ' PRO . 7.5 pt-20 -119.49 143.22 34.15 Favored Pre-proline 0 C--N 1.329 -0.294 0 CA-C-O 121.644 0.735 . . . . 63.229999999999997 110.859 -179.995 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 59' ' ' PRO . . . . . 0.543 ' C ' ' HA ' ' A' ' 58' ' ' GLU . 54.3 Cg_endo -69.81 -9.2 10.99 Favored 'Cis proline' 0 C--O 1.232 0.188 0 C-N-CA 122.632 -1.82 . . . . 71.439999999999998 112.364 0.025 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 60' ' ' VAL . . . . . 0.449 ' HB ' ' CG ' ' A' ' 88' ' ' ASN . 12.0 m -153.89 176.54 0.48 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.242 -0.436 . . . . 71.140000000000001 111.164 179.903 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . 0.461 ' O ' ' C ' ' A' ' 62' ' ' SER . 6.0 tt0 -107.93 -18.0 13.91 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.203 -0.453 . . . . 74.150000000000006 110.917 179.963 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 62' ' ' SER . . . . . 0.461 ' C ' ' O ' ' A' ' 61' ' ' GLU . 0.1 OUTLIER 33.7 90.05 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.191 -0.459 . . . . 73.519999999999996 110.845 -179.846 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -103.66 122.85 45.87 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.151 -0.477 . . . . 74.209999999999994 110.866 -179.801 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 64' ' ' ILE . . . . . 0.458 HG21 ' N ' ' A' ' 65' ' ' THR . 12.5 mt -141.37 150.42 19.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.156 -0.475 . . . . 75.420000000000002 111.113 179.972 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 65' ' ' THR . . . . . 0.458 ' N ' HG21 ' A' ' 64' ' ' ILE . 84.0 m -118.96 117.34 28.55 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.153 -0.476 . . . . 72.129999999999995 111.135 179.972 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . 0.572 HD23 ' CE1' ' A' ' 83' ' ' PHE . 11.4 mt -95.04 111.9 23.66 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.217 -0.447 . . . . 74.420000000000002 110.912 179.979 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 67' ' ' HIS . . . . . 0.415 ' CG ' ' HG2' ' A' ' 49' ' ' GLU . 0.9 OUTLIER -102.11 111.88 24.33 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.152 -0.476 . . . . 74.510000000000005 110.843 179.855 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 68' ' ' PHE . . . . . 0.467 ' CE1' HG22 ' A' ' 114' ' ' ILE . 0.0 OUTLIER -103.83 139.95 38.33 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.195 -0.457 . . . . 72.040000000000006 110.889 -179.959 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . 0.464 ' CB ' HG21 ' A' ' 47' ' ' ILE . . . -119.67 118.4 30.83 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.123 -0.49 . . . . 65.140000000000001 111.096 179.897 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 70' ' ' MET . . . . . 0.418 ' HE2' ' CG1' ' A' ' 114' ' ' ILE . 2.3 mmt -84.08 99.13 10.27 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.238 -0.437 . . . . 70.209999999999994 110.883 179.942 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -53.25 159.86 1.94 Allowed Pre-proline 0 C--N 1.33 -0.275 0 CA-C-O 121.553 0.692 . . . . 71.040000000000006 111.14 -179.912 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.73 -2.22 9.79 Favored 'Trans proline' 0 C--N 1.341 0.167 0 C-N-CA 122.69 2.26 . . . . 71.219999999999999 112.376 179.887 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 73' ' ' MET . . . . . 0.496 ' O ' ' CB ' ' A' ' 76' ' ' TYR . 0.1 OUTLIER -115.83 -23.33 8.67 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.234 -0.439 . . . . 75.450000000000003 110.914 179.902 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 74' ' ' TYR . . . . . 0.665 ' CD1' ' C ' ' A' ' 74' ' ' TYR . 0.0 OUTLIER -48.49 151.53 1.93 Allowed Pre-proline 0 C--N 1.328 -0.353 0 CA-C-O 121.69 0.757 . . . . 73.129999999999995 110.924 -179.907 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 75' ' ' PRO . . . . . 0.571 ' HA ' ' CD2' ' A' ' 74' ' ' TYR . 53.7 Cg_endo -69.73 -9.99 11.23 Favored 'Cis proline' 0 C--N 1.341 0.184 0 C-N-CA 122.633 -1.819 . . . . 75.510000000000005 112.386 -0.109 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 76' ' ' TYR . . . . . 0.496 ' CB ' ' O ' ' A' ' 73' ' ' MET . 16.3 t80 -34.41 -52.3 0.48 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.172 -0.467 . . . . 74.420000000000002 110.916 -179.911 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 62.1 p -101.41 -171.56 2.01 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.094 -0.503 . . . . 72.150000000000006 111.158 -179.956 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -108.65 131.31 21.85 Favored Pre-proline 0 C--N 1.328 -0.335 0 CA-C-O 121.57 0.7 . . . . 70.439999999999998 111.142 179.842 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 79' ' ' PRO . . . . . 0.464 ' HG3' ' CD1' ' A' ' 113' ' ' ILE . 53.5 Cg_endo -69.82 -170.14 0.38 Allowed 'Trans proline' 0 C--N 1.342 0.192 0 C-N-CA 122.688 2.259 . . . . 72.200000000000003 112.344 -179.964 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -127.37 127.36 44.08 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.242 -0.436 . . . . 74.030000000000001 110.854 -179.963 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 10.2 mm -120.4 139.13 48.65 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.156 -0.475 . . . . 73.329999999999998 111.102 179.956 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . 0.475 ' HG3' ' CD ' ' A' ' 84' ' ' LYS . 7.2 pt-20 -148.34 144.04 27.28 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.144 -0.48 . . . . 63.43 110.866 179.948 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 83' ' ' PHE . . . . . 0.572 ' CE1' HD23 ' A' ' 66' ' ' LEU . 22.5 m-85 -93.76 141.14 28.84 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.132 -0.486 . . . . 74.349999999999994 110.895 -179.963 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 84' ' ' LYS . . . . . 0.475 ' CD ' ' HG3' ' A' ' 82' ' ' GLU . 9.6 mmmt -124.89 171.05 10.49 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.124 -0.489 . . . . 73.200000000000003 110.903 179.968 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . 0.425 ' C ' HG21 ' A' ' 86' ' ' VAL . 1.9 m-80 62.81 -74.22 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.216 -0.447 . . . . 72.0 110.918 179.977 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 86' ' ' VAL . . . . . 0.465 ' N ' ' O ' ' A' ' 84' ' ' LYS . 3.2 m 41.5 92.08 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.144 -0.48 . . . . 73.239999999999995 111.144 179.901 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -102.54 -69.59 0.78 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.21 -0.45 . . . . 73.0 110.868 -179.945 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 88' ' ' ASN . . . . . 0.449 ' CG ' ' HB ' ' A' ' 60' ' ' VAL . 14.6 m-80 -83.31 53.11 2.38 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.191 -0.459 . . . . 73.329999999999998 110.851 -179.909 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 89' ' ' VAL . . . . . 0.525 ' CG2' ' CD2' ' A' ' 94' ' ' LEU . 2.1 p -165.27 133.85 0.63 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.173 -0.467 . . . . 75.129999999999995 111.1 179.904 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 90' ' ' MET . . . . . . . . . . . . . 1.4 mtm -78.36 -70.43 0.49 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.123 -0.49 . . . . 62.210000000000001 110.885 179.888 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 5.1 p-10 -176.34 -30.95 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.195 -0.457 . . . . 55.409999999999997 110.857 179.981 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -53.65 -37.65 63.32 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.185 -0.461 . . . . 74.310000000000002 110.906 -179.792 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 93' ' ' GLN . . . . . 0.512 ' HG2' ' CZ ' ' A' ' 128' ' ' PHE . 1.4 mp0 -71.03 -38.37 72.58 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.108 -0.496 . . . . 73.200000000000003 110.917 -179.945 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . 0.525 ' CD2' ' CG2' ' A' ' 89' ' ' VAL . 1.1 mm? -64.78 -47.21 78.95 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.166 -0.47 . . . . 72.319999999999993 110.907 -179.964 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 44.6 mt-30 -65.17 -34.0 77.35 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.16 -0.473 . . . . 72.340000000000003 110.905 179.952 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 96' ' ' MET . . . . . . . . . . . . . 32.0 ttp -59.85 -37.88 80.52 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.184 -0.462 . . . . 73.209999999999994 110.913 179.951 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 97' ' ' LEU . . . . . 0.477 ' O ' ' CD1' ' A' ' 101' ' ' PHE . 17.1 mt -71.97 -38.9 69.66 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.188 -0.46 . . . . 70.239999999999995 110.902 179.961 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 98' ' ' LYS . . . . . 0.456 ' HD3' ' CZ ' ' A' ' 83' ' ' PHE . 7.0 mmtt -54.64 -37.11 65.28 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.206 -0.452 . . . . 72.510000000000005 110.903 179.847 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -64.45 -38.69 91.9 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.217 -0.447 . . . . 74.239999999999995 110.864 -179.861 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 1.4 mp0 -72.94 -24.1 60.77 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.145 -0.48 . . . . 70.549999999999997 110.905 179.995 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 101' ' ' PHE . . . . . 0.511 ' CG ' HD11 ' A' ' 117' ' ' ILE . 8.9 m-30 -59.75 -35.19 74.1 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.117 -0.492 . . . . 74.099999999999994 110.935 -179.951 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.51 -38.29 84.07 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.143 -0.48 . . . . 75.530000000000001 110.881 179.959 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 21.8 mtmt -70.04 -43.19 71.76 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.264 -0.426 . . . . 73.109999999999999 110.927 179.846 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 3.0 mt -62.16 -47.45 93.06 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.185 -0.461 . . . . 73.400000000000006 111.102 179.901 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 105' ' ' HIS . . . . . 0.465 ' O ' ' N ' ' A' ' 109' ' ' ARG . 1.8 t60 -62.87 -41.09 99.26 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.163 -0.471 . . . . 75.140000000000001 110.832 179.932 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 1.3 m-80 -58.14 -39.25 78.3 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.246 -0.434 . . . . 71.430000000000007 110.834 -179.901 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 9.4 t -90.12 -13.18 36.28 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.195 -0.457 . . . . 75.099999999999994 111.091 -179.921 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 58.8 m -116.78 17.5 15.12 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.241 -0.436 . . . . 72.019999999999996 110.863 -179.845 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 109' ' ' ARG . . . . . 0.465 ' N ' ' O ' ' A' ' 105' ' ' HIS . 21.4 ttp180 -67.17 76.16 0.14 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.098 -0.501 . . . . 71.239999999999995 110.884 -179.98 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 149.05 -21.63 1.25 Allowed Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.77 -0.728 . . . . 73.109999999999999 112.505 -179.954 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 111' ' ' GLN . . . . . . . . . . . . . 10.6 pt20 -116.84 -165.48 1.07 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.765 0.317 . . . . 73.329999999999998 110.894 -179.891 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 23.4 mt-10 -67.05 134.29 51.6 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.189 -0.46 . . . . 63.020000000000003 110.871 -179.943 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 113' ' ' ILE . . . . . 0.464 ' CD1' ' HG3' ' A' ' 79' ' ' PRO . 22.4 pt -124.5 -14.66 5.07 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 116.131 -0.486 . . . . 75.109999999999999 111.117 179.984 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 114' ' ' ILE . . . . . 0.467 HG22 ' CE1' ' A' ' 68' ' ' PHE . 14.5 mm -63.03 -43.83 99.26 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.157 -0.474 . . . . 75.450000000000003 111.15 179.81 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 115' ' ' PHE . . . . . 0.486 ' CE1' ' CD1' ' A' ' 25' ' ' ILE . 16.2 t80 -72.52 -35.97 68.21 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.145 -0.48 . . . . 72.349999999999994 110.91 179.944 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 5.2 mm-40 -66.02 -46.77 76.69 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.189 -0.459 . . . . 62.539999999999999 110.922 -179.954 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 117' ' ' ILE . . . . . 0.511 HD11 ' CG ' ' A' ' 101' ' ' PHE . 0.7 OUTLIER -64.37 -43.06 97.03 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.159 -0.473 . . . . 74.510000000000005 111.137 179.93 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 118' ' ' THR . . . . . 0.49 ' N ' ' CG2' ' A' ' 117' ' ' ILE . 72.7 p -67.83 -43.03 80.49 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.192 -0.458 . . . . 61.030000000000001 111.127 179.972 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 4.0 m -63.86 -44.48 92.99 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.245 -0.434 . . . . 75.129999999999995 110.843 -179.835 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -65.41 -48.74 71.77 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.176 -0.465 . . . . 74.430000000000007 110.906 -179.984 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 25.3 p -63.7 -38.62 91.8 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.154 -0.475 . . . . 74.420000000000002 111.137 -179.912 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 27.7 tt0 -63.23 -41.44 99.11 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.202 -0.453 . . . . 64.439999999999998 110.903 -179.963 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 123' ' ' GLU . . . . . 0.497 ' O ' ' CG ' ' A' ' 127' ' ' GLU . 4.2 pt-20 -75.95 -35.61 59.64 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.245 -0.434 . . . . 74.349999999999994 110.861 -179.946 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 124' ' ' LYS . . . . . 0.48 ' HA ' ' CG ' ' A' ' 127' ' ' GLU . 0.0 OUTLIER -68.61 -35.22 77.03 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.14 -0.482 . . . . 74.420000000000002 110.901 179.966 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 125' ' ' LEU . . . . . 0.537 ' C ' ' CD2' ' A' ' 125' ' ' LEU . 4.0 tt -72.93 -43.67 62.1 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.274 -0.421 . . . . 73.430000000000007 110.925 179.912 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 4.5 t70 -65.7 -46.93 77.14 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.219 -0.446 . . . . 75.109999999999999 110.836 179.843 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 127' ' ' GLU . . . . . 0.497 ' CG ' ' O ' ' A' ' 123' ' ' GLU . 0.0 OUTLIER -59.52 -50.35 74.23 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.248 -0.433 . . . . 73.450000000000003 110.868 -179.908 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 128' ' ' PHE . . . . . 0.667 ' C ' ' CD1' ' A' ' 128' ' ' PHE . 0.0 OUTLIER -66.8 -46.05 76.46 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.161 -0.472 . . . . 74.450000000000003 110.865 -179.906 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 129' ' ' GLN . . . . . 0.456 ' C ' ' OE1' ' A' ' 129' ' ' GLN . 0.9 OUTLIER -54.6 -38.8 67.18 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.19 -0.459 . . . . 73.409999999999997 110.9 -179.941 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 130' ' ' ASN . . . . . 0.511 ' O ' ' CG2' ' A' ' 131' ' ' VAL . 36.6 t-20 -49.16 -72.73 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.164 -0.471 . . . . 72.409999999999997 110.898 -179.971 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 131' ' ' VAL . . . . . 0.511 ' CG2' ' O ' ' A' ' 130' ' ' ASN . 73.6 t -162.15 -50.64 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.189 -0.46 . . . . 71.209999999999994 111.138 179.938 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 132' ' ' VAL . . . . . 0.46 ' O ' ' C ' ' A' ' 133' ' ' ASN . 79.6 t -158.97 86.45 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 116.162 -0.472 . . . . 71.530000000000001 111.104 179.95 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 133' ' ' ASN . . . . . 0.46 ' C ' ' O ' ' A' ' 132' ' ' VAL . 0.4 OUTLIER 33.57 88.39 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.157 -0.474 . . . . 70.140000000000001 110.872 -179.998 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 134' ' ' THR . . . . . . . . . . . . . 99.3 m -128.83 128.49 44.0 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.205 -0.452 . . . . 74.230000000000004 111.157 -179.987 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 2.5 mm100 -93.57 159.53 15.18 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.242 -0.436 . . . . 75.540000000000006 110.939 179.979 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 21.2 t -169.36 134.42 1.49 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.233 -0.439 . . . . 75.140000000000001 110.846 -179.756 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 137' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER 59.42 -177.75 0.09 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.128 -0.487 . . . . 74.230000000000004 110.926 179.993 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 7.3 tm-20 . . . . . 0 C--N 1.33 -0.28 0 CA-C-N 116.171 -0.468 . . . . 62.340000000000003 110.846 179.969 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 87.3 mmm . . . . . 0 C--O 1.23 0.072 0 CA-C-O 120.803 0.335 . . . . 62.450000000000003 110.809 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 72.6 p -121.51 154.07 37.12 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.214 -0.448 . . . . 72.519999999999996 110.835 -179.775 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -117.19 86.7 2.56 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.113 -0.494 . . . . 74.430000000000007 110.937 -179.987 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -174.68 140.46 0.59 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.189 -0.459 . . . . 75.340000000000003 110.851 -179.929 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 89.8 m-70 56.6 102.27 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.112 -0.495 . . . . 73.129999999999995 110.835 179.981 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 5.0 mp 46.8 94.74 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.224 -0.444 . . . . 75.140000000000001 110.953 -179.983 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 14.9 t -88.81 168.95 12.03 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.205 -0.452 . . . . 73.299999999999997 111.148 179.951 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 17.4 mt -66.98 -29.35 69.17 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.202 -0.454 . . . . 73.120000000000005 110.948 179.97 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . 0.411 ' OD1' ' N ' ' A' ' 9' ' ' ASP . 1.2 m-20 -53.38 -32.58 50.03 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.179 -0.464 . . . . 64.319999999999993 110.852 179.863 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 33.0 mm-40 -66.99 -38.93 86.93 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.205 -0.452 . . . . 73.329999999999998 110.922 -179.969 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' TYR . . . . . 0.504 ' CD1' ' HD2' ' A' ' 75' ' ' PRO . 18.9 m-85 -61.65 -25.08 67.15 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.187 -0.46 . . . . 74.209999999999994 110.92 -179.89 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -59.05 -41.69 88.47 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.164 -0.471 . . . . 74.319999999999993 110.962 -179.917 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 1.5 mm-40 -62.43 -45.23 94.04 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.085 -0.507 . . . . 74.430000000000007 110.897 179.952 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 4.4 mp -67.21 -39.89 83.95 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.146 -0.479 . . . . 73.409999999999997 111.148 -179.999 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . 0.466 ' NE2' ' HB3' ' A' ' 70' ' ' MET . 55.9 mt-30 -62.62 -49.43 75.24 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.171 -0.468 . . . . 73.239999999999995 110.889 179.913 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -63.45 -40.67 97.75 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.206 -0.452 . . . . 74.120000000000005 110.878 -179.924 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -57.71 -33.28 68.23 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.197 -0.456 . . . . 73.400000000000006 110.916 -179.91 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . 0.482 ' OE1' ' CE ' ' A' ' 70' ' ' MET . 1.4 tt0 -68.42 -37.82 80.65 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.143 -0.481 . . . . 72.409999999999997 110.895 -179.992 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . 0.468 HD11 ' N ' ' A' ' 19' ' ' LEU . 10.9 mp -56.65 -52.26 65.56 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.189 -0.459 . . . . 72.430000000000007 110.926 -179.98 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 3.6 pt-20 -68.92 -31.97 71.25 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.204 -0.453 . . . . 73.209999999999994 110.901 179.952 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -63.59 -48.66 76.45 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.15 -0.477 . . . . 71.409999999999997 111.086 179.898 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . 0.473 ' N ' HD13 ' A' ' 22' ' ' ILE . 0.5 OUTLIER -77.22 -34.29 21.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.161 -0.472 . . . . 73.25 111.122 -179.995 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 42.5 mtt180 -52.52 -35.44 53.22 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.208 -0.451 . . . . 74.010000000000005 110.874 179.971 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 24.8 p -62.66 -31.19 72.02 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.199 -0.455 . . . . 73.430000000000007 110.9 -179.8 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . 0.506 HD13 ' CD1' ' A' ' 115' ' ' PHE . 3.9 mt -84.76 -45.44 17.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.08 -0.509 . . . . 75.340000000000003 111.154 179.952 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 24.2 m-85 -105.82 44.63 1.03 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.142 -0.481 . . . . 74.409999999999997 110.948 179.991 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 2.2 mtm -43.53 -52.38 6.21 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.104 -0.498 . . . . 74.400000000000006 110.853 179.918 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 -93.68 -27.32 16.62 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.224 -0.443 . . . . 74.310000000000002 110.889 179.93 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 10.5 m-20 -87.62 27.66 1.09 Allowed 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.177 -0.465 . . . . 64.439999999999998 110.884 -179.982 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 5.4 t80 -106.21 138.7 41.93 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.161 -0.472 . . . . 75.150000000000006 110.888 -179.904 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 55.3 m -122.91 133.07 54.42 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.128 -0.487 . . . . 75.099999999999994 111.132 -179.909 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 2.8 t70 -105.04 114.9 29.37 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.21 -0.45 . . . . 75.319999999999993 110.875 179.911 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . 0.518 HD22 ' CE1' ' A' ' 67' ' ' HIS . 0.2 OUTLIER -115.51 -7.15 12.25 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.147 -0.479 . . . . 63.299999999999997 110.935 -179.953 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' THR . . . . . 0.498 ' O ' ' N ' ' A' ' 36' ' ' ARG . 0.2 OUTLIER -44.09 143.6 1.12 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.231 -0.44 . . . . 74.540000000000006 111.164 179.933 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 2.4 mmtm -57.99 79.25 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.245 -0.434 . . . . 75.150000000000006 110.855 179.932 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . 0.498 ' N ' ' O ' ' A' ' 34' ' ' THR . 2.0 mmm180 -87.93 -173.7 4.39 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.206 -0.452 . . . . 71.430000000000007 110.907 179.945 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -73.1 65.1 0.77 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.209 -0.45 . . . . 75.129999999999995 110.889 179.978 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -169.38 -38.18 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.273 -0.421 . . . . 73.450000000000003 110.876 -179.839 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 69.1 m -55.7 -172.0 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.158 -0.473 . . . . 73.510000000000005 110.878 -179.81 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' TRP . . . . . . . . . . . . . 28.2 p90 -111.12 -8.59 14.41 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.158 -0.474 . . . . 74.540000000000006 110.896 -179.966 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . 0.424 ' C ' ' HG2' ' A' ' 42' ' ' LYS . 19.3 t0 -124.88 169.19 12.3 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.212 -0.449 . . . . 74.319999999999993 110.871 179.901 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . 0.424 ' HG2' ' C ' ' A' ' 41' ' ' ASP . 0.1 OUTLIER -139.07 55.63 1.7 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.174 -0.466 . . . . 70.239999999999995 110.866 -179.951 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . 0.459 ' N ' ' CD ' ' A' ' 44' ' ' PRO . 0.8 OUTLIER -139.37 53.14 4.59 Favored Pre-proline 0 C--N 1.329 -0.305 0 CA-C-O 121.584 0.707 . . . . 74.319999999999993 110.914 179.972 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' PRO . . . . . 0.459 ' CD ' ' N ' ' A' ' 43' ' ' GLN . 54.0 Cg_endo -69.73 -166.4 0.18 Allowed 'Trans proline' 0 N--CA 1.465 -0.162 0 C-N-CA 122.703 2.269 . . . . 63.219999999999999 112.38 179.97 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' GLN . . . . . 0.576 ' NE2' ' CG2' ' A' ' 47' ' ' ILE . 0.0 OUTLIER -174.47 28.88 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.25 -0.432 . . . . 74.200000000000003 110.881 -179.988 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . 0.516 ' CB ' ' O ' ' A' ' 45' ' ' GLN . 0.1 OUTLIER 86.87 -21.09 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.217 -0.447 . . . . 75.540000000000006 111.121 179.988 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . 0.576 ' CG2' ' NE2' ' A' ' 45' ' ' GLN . 0.1 OUTLIER -34.99 152.5 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 116.22 -0.445 . . . . 64.420000000000002 111.137 179.841 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 48' ' ' PHE . . . . . 0.469 ' HA ' ' CD1' ' A' ' 33' ' ' LEU . 1.7 p90 -161.68 168.21 23.76 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.174 -0.466 . . . . 73.510000000000005 110.876 179.965 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . 0.47 ' CG ' ' HB2' ' A' ' 67' ' ' HIS . 7.6 mt-10 -121.19 160.98 22.68 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.114 -0.494 . . . . 63.210000000000001 110.809 -179.892 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 11.5 mm -139.2 134.83 41.3 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.144 -0.48 . . . . 65.239999999999995 111.14 179.951 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 93.6 m -88.53 118.33 28.11 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.146 -0.479 . . . . 72.310000000000002 111.14 179.997 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . 0.445 HD13 ' CD1' ' A' ' 66' ' ' LEU . 21.2 mt -119.63 165.3 14.64 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.202 -0.453 . . . . 70.25 110.916 179.958 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -175.96 166.53 3.02 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.182 -0.463 . . . . 75.049999999999997 110.828 179.985 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -59.3 177.25 0.19 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.177 -0.465 . . . . 72.329999999999998 110.859 -179.801 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 16.2 m -90.89 -26.37 5.18 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.147 -0.479 . . . . 74.049999999999997 111.096 179.959 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -115.31 -169.79 1.64 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.205 -0.452 . . . . 71.439999999999998 110.894 179.924 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -116.27 -23.58 8.33 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.2 -0.455 . . . . 72.310000000000002 110.903 -179.996 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . 0.539 ' HA ' ' C ' ' A' ' 59' ' ' PRO . 7.9 pt-20 -114.51 146.32 35.67 Favored Pre-proline 0 C--N 1.329 -0.289 0 CA-C-O 121.574 0.702 . . . . 71.400000000000006 110.939 179.933 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 59' ' ' PRO . . . . . 0.539 ' C ' ' HA ' ' A' ' 58' ' ' GLU . 54.0 Cg_endo -69.75 -12.54 12.21 Favored 'Cis proline' 0 C--O 1.232 0.194 0 C-N-CA 122.69 -1.796 . . . . 73.140000000000001 112.334 -0.025 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 60' ' ' VAL . . . . . 0.6 ' CG2' ' CG ' ' A' ' 129' ' ' GLN . 12.2 m -147.44 167.61 5.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.25 -0.432 . . . . 75.409999999999997 111.138 179.902 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 5.9 tt0 -94.26 -22.64 18.26 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.138 -0.483 . . . . 73.040000000000006 110.873 -179.967 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 1.7 m 42.68 94.66 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.166 -0.47 . . . . 70.329999999999998 110.834 -179.819 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 25.5 t -118.97 123.1 43.75 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.141 -0.481 . . . . 75.530000000000001 110.878 -179.85 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 64' ' ' ILE . . . . . 0.42 HD13 ' CD2' ' A' ' 94' ' ' LEU . 52.9 mt -138.08 147.14 26.05 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.092 -0.503 . . . . 74.25 111.126 179.956 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 29.0 m -111.62 113.79 26.42 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.189 -0.46 . . . . 74.430000000000007 111.124 179.987 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . 0.634 ' CD2' ' CE1' ' A' ' 83' ' ' PHE . 15.9 mt -91.97 109.95 21.3 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.247 -0.433 . . . . 71.109999999999999 110.927 179.928 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 67' ' ' HIS . . . . . 0.518 ' CE1' HD22 ' A' ' 33' ' ' LEU . 1.2 t60 -95.64 109.89 22.08 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.19 -0.459 . . . . 75.219999999999999 110.839 179.884 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 68' ' ' PHE . . . . . 0.449 ' HB3' ' CD1' ' A' ' 81' ' ' ILE . 0.0 OUTLIER -104.02 139.93 38.45 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.219 -0.446 . . . . 75.239999999999995 110.874 -179.917 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . 0.47 ' CB ' HG22 ' A' ' 47' ' ' ILE . . . -124.44 120.07 30.99 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.165 -0.47 . . . . 73.030000000000001 111.087 179.93 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 70' ' ' MET . . . . . 0.482 ' CE ' ' OE1' ' A' ' 18' ' ' GLU . 9.2 mmt -79.63 95.51 5.93 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.199 -0.455 . . . . 75.319999999999993 110.864 179.98 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -49.78 160.16 0.65 Allowed Pre-proline 0 C--N 1.33 -0.263 0 CA-C-O 121.639 0.733 . . . . 74.349999999999994 111.135 -179.923 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.78 3.1 2.98 Favored 'Trans proline' 0 C--N 1.342 0.189 0 C-N-CA 122.691 2.261 . . . . 73.140000000000001 112.349 179.963 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 73' ' ' MET . . . . . 0.502 ' O ' ' CB ' ' A' ' 76' ' ' TYR . 0.0 OUTLIER -120.36 -25.55 5.61 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.194 -0.457 . . . . 74.230000000000004 110.881 179.908 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 74' ' ' TYR . . . . . 0.653 ' CD1' ' C ' ' A' ' 74' ' ' TYR . 0.0 OUTLIER -50.52 150.75 4.51 Favored Pre-proline 0 C--N 1.328 -0.337 0 CA-C-O 121.648 0.737 . . . . 74.549999999999997 110.916 -179.854 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 75' ' ' PRO . . . . . 0.563 ' HA ' ' CD2' ' A' ' 74' ' ' TYR . 53.7 Cg_endo -69.76 -14.12 12.45 Favored 'Cis proline' 0 C--N 1.341 0.183 0 C-N-CA 122.65 -1.813 . . . . 75.430000000000007 112.325 -0.089 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 76' ' ' TYR . . . . . 0.502 ' CB ' ' O ' ' A' ' 73' ' ' MET . 6.2 t80 -33.93 -52.64 0.44 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.236 -0.438 . . . . 74.120000000000005 110.883 -179.912 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 39.0 p -105.86 -178.88 3.78 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.141 -0.481 . . . . 74.329999999999998 111.179 -179.989 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -98.62 129.36 30.32 Favored Pre-proline 0 C--N 1.329 -0.287 0 CA-C-O 121.595 0.712 . . . . 55.25 111.135 179.859 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 79' ' ' PRO . . . . . 0.445 ' CB ' ' O ' ' A' ' 69' ' ' ALA . 53.9 Cg_endo -69.74 -170.89 0.42 Allowed 'Trans proline' 0 C--O 1.231 0.152 0 C-N-CA 122.717 2.278 . . . . 73.439999999999998 112.366 -179.992 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 2.1 tt0 -119.77 125.17 47.94 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.224 -0.443 . . . . 74.239999999999995 110.878 -179.982 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 81' ' ' ILE . . . . . 0.449 ' CD1' ' HB3' ' A' ' 68' ' ' PHE . 13.0 mm -121.37 142.38 37.83 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.107 -0.497 . . . . 71.329999999999998 111.109 -179.985 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . 0.476 ' HG3' ' CD ' ' A' ' 84' ' ' LYS . 11.8 pt-20 -148.61 147.2 28.7 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.162 -0.472 . . . . 64.140000000000001 110.886 179.903 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 83' ' ' PHE . . . . . 0.634 ' CE1' ' CD2' ' A' ' 66' ' ' LEU . 91.2 m-85 -95.79 139.97 31.25 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.12 -0.491 . . . . 73.109999999999999 110.893 -179.934 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 84' ' ' LYS . . . . . 0.476 ' CD ' ' HG3' ' A' ' 82' ' ' GLU . 6.0 mmmt -126.25 170.8 11.49 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.159 -0.473 . . . . 74.319999999999993 110.918 -179.998 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . 0.621 ' N ' HD21 ' A' ' 85' ' ' ASN . 0.8 OUTLIER 63.53 -73.35 0.05 OUTLIER 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.258 -0.428 . . . . 72.530000000000001 110.892 179.946 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 86' ' ' VAL . . . . . 0.446 ' N ' ' O ' ' A' ' 84' ' ' LYS . 4.2 m 36.12 91.0 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 116.162 -0.472 . . . . 63.520000000000003 111.182 179.952 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -94.93 -72.49 0.62 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.18 -0.464 . . . . 75.439999999999998 110.881 -179.94 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 88' ' ' ASN . . . . . 0.417 ' CG ' ' HB ' ' A' ' 60' ' ' VAL . 24.5 m120 -81.28 47.1 0.99 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.184 -0.462 . . . . 75.200000000000003 110.897 -179.954 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 48.1 t -141.71 145.27 24.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.138 -0.483 . . . . 74.230000000000004 111.118 179.897 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 90' ' ' MET . . . . . . . . . . . . . 21.3 mtm -92.04 -71.11 0.66 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.15 -0.477 . . . . 74.219999999999999 110.871 179.941 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER 178.28 -37.21 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.249 -0.432 . . . . 73.519999999999996 110.901 179.951 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -55.97 -45.78 78.82 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.196 -0.456 . . . . 54.109999999999999 110.891 -179.805 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 93' ' ' GLN . . . . . 0.554 ' HG2' ' CD2' ' A' ' 128' ' ' PHE . 2.4 mp0 -61.19 -44.38 97.38 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.152 -0.476 . . . . 75.040000000000006 110.874 -179.969 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . 0.439 HD23 ' CG1' ' A' ' 86' ' ' VAL . 78.6 mt -59.08 -48.85 80.1 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.188 -0.46 . . . . 75.010000000000005 110.92 -179.974 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 2.2 mm-40 -65.1 -33.7 76.64 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.166 -0.47 . . . . 62.420000000000002 110.877 179.959 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 96' ' ' MET . . . . . . . . . . . . . 30.5 ttp -59.9 -38.64 82.86 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.212 -0.449 . . . . 75.450000000000003 110.852 179.997 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 97' ' ' LEU . . . . . 0.563 HD12 ' CZ ' ' A' ' 83' ' ' PHE . 24.9 mt -65.64 -41.09 93.02 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.199 -0.455 . . . . 75.409999999999997 110.922 -179.997 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 98' ' ' LYS . . . . . 0.506 ' HA ' ' CD2' ' A' ' 101' ' ' PHE . 13.2 mmtm -55.47 -43.62 75.67 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.17 -0.468 . . . . 74.140000000000001 110.867 179.871 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 4.2 t -57.28 -38.2 73.56 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.246 -0.433 . . . . 75.549999999999997 110.87 -179.936 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 6.8 mt-10 -74.69 -29.97 61.4 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.12 -0.491 . . . . 74.030000000000001 110.887 -179.965 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 101' ' ' PHE . . . . . 0.579 ' CZ ' HD13 ' A' ' 117' ' ' ILE . 14.0 m-30 -61.74 -27.77 68.95 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.164 -0.471 . . . . 74.519999999999996 110.896 -179.93 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -65.37 -44.92 86.1 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.106 -0.497 . . . . 75.430000000000007 110.927 179.953 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.53 -37.51 74.11 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.199 -0.455 . . . . 74.120000000000005 110.912 179.846 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 104' ' ' ILE . . . . . 0.54 HD11 ' CD2' ' A' ' 120' ' ' PHE . 5.0 mt -61.93 -47.54 92.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.257 -0.429 . . . . 71.319999999999993 111.104 179.886 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 105' ' ' HIS . . . . . . . . . . . . . 1.6 t60 -62.86 -42.15 99.64 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.19 -0.459 . . . . 75.049999999999997 110.844 179.886 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -56.94 -43.37 81.44 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.242 -0.435 . . . . 74.200000000000003 110.924 -179.945 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 6.9 t -77.84 -30.71 51.14 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.127 -0.488 . . . . 75.109999999999999 111.136 -179.986 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 21.0 m -102.96 24.23 11.04 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.229 -0.441 . . . . 74.549999999999997 110.835 -179.866 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 17.9 ttt180 -67.16 77.69 0.14 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.142 -0.481 . . . . 73.239999999999995 110.901 -179.993 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 110' ' ' GLY . . . . . 0.472 ' HA2' ' CG ' ' A' ' 75' ' ' PRO . . . 145.64 -18.46 1.83 Allowed Glycine 0 N--CA 1.452 -0.266 0 C-N-CA 120.71 -0.757 . . . . 73.439999999999998 112.477 -179.949 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 111' ' ' GLN . . . . . . . . . . . . . 10.0 pt20 -117.49 -165.1 1.05 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.735 0.302 . . . . 73.209999999999994 110.928 -179.88 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 53.3 mt-10 -69.08 135.6 51.02 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.215 -0.448 . . . . 74.549999999999997 110.88 -179.944 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 113' ' ' ILE . . . . . 0.424 ' CD1' ' HG3' ' A' ' 79' ' ' PRO . 28.0 pt -123.8 -16.32 4.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.122 -0.49 . . . . 71.420000000000002 111.125 179.993 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 114' ' ' ILE . . . . . 0.508 ' O ' ' CG2' ' A' ' 118' ' ' THR . 29.7 mm -61.19 -38.7 80.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.155 -0.475 . . . . 70.150000000000006 111.115 179.878 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 115' ' ' PHE . . . . . 0.506 ' CD1' HD13 ' A' ' 25' ' ' ILE . 43.0 t80 -72.82 -36.16 67.46 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.183 -0.462 . . . . 75.430000000000007 110.883 179.969 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 8.3 mm-40 -68.3 -46.66 69.72 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.14 -0.482 . . . . 73.409999999999997 110.897 -179.958 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 117' ' ' ILE . . . . . 0.579 HD13 ' CZ ' ' A' ' 101' ' ' PHE . 0.0 OUTLIER -65.79 -41.94 91.29 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 116.161 -0.472 . . . . 75.340000000000003 111.111 179.984 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 118' ' ' THR . . . . . 0.508 ' CG2' ' O ' ' A' ' 114' ' ' ILE . 57.4 p -68.8 -42.95 76.63 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.179 -0.464 . . . . 63.25 111.15 179.943 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 36.6 t -65.13 -44.34 89.0 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.198 -0.455 . . . . 74.420000000000002 110.87 -179.867 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 120' ' ' PHE . . . . . 0.54 ' CD2' HD11 ' A' ' 104' ' ' ILE . 0.7 OUTLIER -60.87 -48.08 83.45 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.161 -0.472 . . . . 73.129999999999995 110.878 -179.963 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 18.9 p -58.77 -38.98 79.68 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.13 -0.486 . . . . 72.120000000000005 111.182 -179.94 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 9.1 tt0 -61.46 -40.89 96.14 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.197 -0.456 . . . . 75.450000000000003 110.929 179.972 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 123' ' ' GLU . . . . . 0.442 ' CG ' ' N ' ' A' ' 124' ' ' LYS . 1.0 OUTLIER -75.46 -45.0 41.21 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.231 -0.441 . . . . 74.430000000000007 110.901 -179.965 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 124' ' ' LYS . . . . . 0.443 ' HE3' ' CD ' ' A' ' 127' ' ' GLU . 8.4 mmmt -64.43 -37.83 88.91 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.167 -0.469 . . . . 71.530000000000001 110.907 179.957 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 125' ' ' LEU . . . . . 0.553 ' C ' ' CD2' ' A' ' 125' ' ' LEU . 3.6 tt -69.65 -44.59 70.23 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.18 -0.464 . . . . 74.129999999999995 110.919 179.909 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 126' ' ' ASP . . . . . 0.424 ' OD1' ' C ' ' A' ' 126' ' ' ASP . 0.0 OUTLIER -68.61 -39.89 80.65 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.183 -0.462 . . . . 73.519999999999996 110.833 179.858 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 127' ' ' GLU . . . . . 0.474 ' HG3' ' N ' ' A' ' 128' ' ' PHE . 3.2 pt-20 -65.62 -42.77 91.17 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.225 -0.443 . . . . 63.399999999999999 110.882 -179.889 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 128' ' ' PHE . . . . . 0.659 ' C ' ' CD1' ' A' ' 128' ' ' PHE . 0.0 OUTLIER -75.16 -58.95 2.97 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.165 -0.47 . . . . 74.299999999999997 110.911 -179.926 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 129' ' ' GLN . . . . . 0.614 ' N ' ' CG ' ' A' ' 128' ' ' PHE . 1.3 tm0? -46.75 -20.31 0.13 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.167 -0.469 . . . . 73.209999999999994 110.926 -179.934 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 130' ' ' ASN . . . . . . . . . . . . . 12.1 t-20 -62.52 -64.58 0.88 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.203 -0.453 . . . . 73.219999999999999 110.872 -179.951 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 18.7 m -147.75 -36.32 0.1 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.178 -0.464 . . . . 74.209999999999994 111.098 179.925 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 132' ' ' VAL . . . . . 0.404 ' O ' ' CG2' ' A' ' 132' ' ' VAL . 2.5 p 39.53 72.52 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.217 -0.447 . . . . 73.230000000000004 111.105 179.958 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 133' ' ' ASN . . . . . . . . . . . . . 4.6 t-20 71.65 -66.95 0.28 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.162 -0.472 . . . . 72.299999999999997 110.883 179.975 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 134' ' ' THR . . . . . . . . . . . . . 80.3 m -135.95 117.24 14.57 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.209 -0.45 . . . . 74.319999999999993 111.164 179.978 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 6.9 pt20 -72.47 126.4 29.76 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.223 -0.444 . . . . 73.230000000000004 110.933 -179.988 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -145.5 168.45 20.55 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.218 -0.446 . . . . 72.519999999999996 110.904 -179.789 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 137' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -126.55 150.36 48.87 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.162 -0.472 . . . . 73.310000000000002 110.914 -179.984 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 2.3 tt0 . . . . . 0 C--N 1.329 -0.29 0 CA-C-N 116.179 -0.464 . . . . 71.319999999999993 110.904 179.934 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 4.8 mmm . . . . . 0 C--O 1.231 0.085 0 CA-C-O 120.74 0.305 . . . . 72.409999999999997 110.916 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -60.18 89.72 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.24 -0.436 . . . . 75.420000000000002 110.807 -179.77 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -63.36 95.11 0.09 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.098 -0.501 . . . . 73.409999999999997 110.9 179.994 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -109.24 156.55 19.78 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.178 -0.464 . . . . 55.030000000000001 110.867 -179.954 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' HIS . . . . . 0.468 ' H ' ' CD2' ' A' ' 5' ' ' HIS . 6.3 p80 -76.52 149.98 36.64 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.118 -0.492 . . . . 75.109999999999999 110.839 179.978 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . 0.442 ' C ' ' O ' ' A' ' 5' ' ' HIS . 0.1 OUTLIER 35.2 81.09 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.202 -0.454 . . . . 75.530000000000001 110.938 -179.982 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 14.9 t -170.45 162.29 8.21 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.15 -0.477 . . . . 75.430000000000007 111.152 179.967 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 20.1 mt -54.61 -27.94 43.01 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.247 -0.433 . . . . 72.109999999999999 110.926 179.939 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -51.52 -31.67 24.87 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.211 -0.45 . . . . 74.129999999999995 110.85 179.856 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 3.9 mm-40 -67.85 -35.49 78.66 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.178 -0.464 . . . . 73.450000000000003 110.88 -179.87 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 13.6 m-85 -67.61 -24.98 65.53 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.208 -0.451 . . . . 74.109999999999999 110.933 -179.893 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -59.26 -38.08 79.18 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.146 -0.479 . . . . 74.140000000000001 110.925 -179.917 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 2.7 mm-40 -58.86 -46.0 88.8 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.126 -0.488 . . . . 73.120000000000005 110.903 179.979 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 4.2 mp -68.05 -46.64 81.27 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.179 -0.464 . . . . 74.230000000000004 111.115 179.961 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 84.5 mt-30 -57.21 -48.22 79.33 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.202 -0.453 . . . . 74.319999999999993 110.89 179.966 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -62.22 -42.27 99.15 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.263 -0.426 . . . . 74.049999999999997 110.886 -179.945 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 2.5 m-20 -58.1 -33.64 69.33 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.168 -0.469 . . . . 74.409999999999997 110.876 -179.879 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 2.4 mp0 -65.44 -38.85 91.1 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.163 -0.471 . . . . 74.230000000000004 110.93 179.986 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . 0.489 HD12 ' N ' ' A' ' 19' ' ' LEU . 8.5 mp -63.7 -51.7 63.84 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.103 -0.499 . . . . 75.340000000000003 110.909 -179.972 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 1.9 pt-20 -68.9 -32.72 72.55 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.163 -0.472 . . . . 73.319999999999993 110.888 179.925 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -62.06 -50.56 71.51 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.175 -0.466 . . . . 75.540000000000006 111.07 179.95 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . 0.468 HD11 ' N ' ' A' ' 22' ' ' ILE . 0.6 OUTLIER -77.23 -34.36 21.2 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 116.249 -0.432 . . . . 74.140000000000001 111.112 179.985 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 44.4 mtp180 -52.54 -35.02 52.6 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.187 -0.46 . . . . 73.129999999999995 110.89 179.973 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -66.98 -31.43 72.0 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.191 -0.459 . . . . 63.25 110.828 -179.812 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 3.9 mt -82.89 -44.41 18.96 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.159 -0.473 . . . . 74.5 111.137 179.967 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 26.6 m-85 -106.6 41.16 1.49 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.193 -0.458 . . . . 74.450000000000003 110.964 -179.994 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER -40.4 -49.38 2.82 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.099 -0.501 . . . . 71.420000000000002 110.895 179.91 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -98.39 -9.02 25.88 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.196 -0.456 . . . . 43.420000000000002 110.872 179.981 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -104.67 32.65 3.98 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.218 -0.446 . . . . 72.239999999999995 110.819 -179.999 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' PHE . . . . . 0.513 ' C ' ' CD1' ' A' ' 30' ' ' PHE . 1.7 t80 -116.55 138.39 51.45 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.234 -0.439 . . . . 74.230000000000004 110.89 -179.95 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 52.3 m -111.71 129.79 55.99 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.147 -0.479 . . . . 74.329999999999998 111.089 -179.857 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . 0.452 ' O ' ' CG ' ' A' ' 32' ' ' ASP . 0.0 OUTLIER -99.36 115.62 29.64 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.215 -0.448 . . . . 53.100000000000001 110.864 179.861 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . 0.458 ' CD2' ' HA ' ' A' ' 48' ' ' PHE . 0.4 OUTLIER -123.48 -17.04 6.62 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.138 -0.483 . . . . 74.109999999999999 110.943 -179.976 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 1.2 m -45.69 135.41 6.77 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.187 -0.46 . . . . 75.329999999999998 111.098 180.0 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -75.38 90.9 2.68 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.209 -0.45 . . . . 74.109999999999999 110.924 179.904 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -123.27 -155.75 0.67 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.242 -0.436 . . . . 74.200000000000003 110.871 -179.976 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . 0.418 ' O ' ' O ' ' A' ' 38' ' ' SER . 3.2 mmpt? 52.32 -172.42 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.188 -0.46 . . . . 72.420000000000002 110.905 179.987 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 38' ' ' SER . . . . . 0.418 ' O ' ' O ' ' A' ' 37' ' ' LYS . 2.2 t -38.02 -93.07 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.175 -0.466 . . . . 71.299999999999997 110.915 -179.932 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 39' ' ' SER . . . . . 0.401 ' N ' ' OG ' ' A' ' 38' ' ' SER . 73.3 m 55.65 -174.17 0.05 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.12 -0.491 . . . . 72.510000000000005 110.87 -179.86 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 40' ' ' TRP . . . . . . . . . . . . . 26.9 p90 -109.06 -25.63 10.58 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.156 -0.474 . . . . 75.439999999999998 110.881 -179.958 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 2.1 p30 -121.91 146.48 47.08 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.232 -0.44 . . . . 63.439999999999998 110.831 179.935 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -133.91 72.07 1.47 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.168 -0.469 . . . . 71.329999999999998 110.906 179.962 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 5.1 tt0 -124.46 63.67 36.17 Favored Pre-proline 0 C--N 1.329 -0.287 0 CA-C-O 121.579 0.704 . . . . 72.420000000000002 110.918 179.942 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.78 129.92 18.41 Favored 'Trans proline' 0 C--N 1.341 0.164 0 C-N-CA 122.671 2.247 . . . . 73.230000000000004 112.358 179.996 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 45' ' ' GLN . . . . . 0.45 ' O ' ' CB ' ' A' ' 46' ' ' ILE . 16.2 tt0 -106.42 8.47 31.58 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.235 -0.439 . . . . 73.439999999999998 110.931 -179.971 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . 0.45 ' CB ' ' O ' ' A' ' 45' ' ' GLN . 0.0 OUTLIER 82.02 -3.99 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.179 -0.464 . . . . 74.540000000000006 111.146 179.979 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . 0.472 HG23 ' CB ' ' A' ' 69' ' ' ALA . 0.2 OUTLIER -59.83 143.37 14.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.162 -0.472 . . . . 75.310000000000002 111.117 179.844 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 48' ' ' PHE . . . . . 0.458 ' HA ' ' CD2' ' A' ' 33' ' ' LEU . 4.2 p90 -155.54 154.73 32.19 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.218 -0.447 . . . . 73.510000000000005 110.884 179.955 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 6.0 mt-10 -108.93 159.17 17.02 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.178 -0.465 . . . . 64.099999999999994 110.928 -179.971 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 7.3 mm -133.95 140.6 46.0 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 116.174 -0.466 . . . . 74.109999999999999 111.179 179.962 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 88.9 m -85.21 118.58 24.84 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.208 -0.451 . . . . 73.109999999999999 111.153 179.99 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 17.0 mt -123.3 163.23 21.13 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.286 -0.415 . . . . 74.230000000000004 110.925 179.962 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -178.43 175.54 1.14 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.211 -0.45 . . . . 73.219999999999999 110.905 179.979 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -70.12 -156.08 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.16 -0.473 . . . . 73.200000000000003 110.873 -179.811 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 18.0 m -117.72 -20.08 5.62 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.138 -0.483 . . . . 73.409999999999997 111.156 179.926 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -112.44 174.73 5.75 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.171 -0.468 . . . . 70.299999999999997 110.89 179.916 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -111.8 -22.38 11.16 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.173 -0.467 . . . . 73.120000000000005 110.895 179.989 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . 0.531 ' HA ' ' C ' ' A' ' 59' ' ' PRO . 3.4 pt-20 -126.32 148.91 65.6 Favored Pre-proline 0 C--N 1.33 -0.26 0 CA-C-O 121.692 0.758 . . . . 74.299999999999997 110.84 179.956 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 59' ' ' PRO . . . . . 0.531 ' C ' ' HA ' ' A' ' 58' ' ' GLU . 54.0 Cg_endo -69.72 -8.58 10.5 Favored 'Cis proline' 0 C--N 1.342 0.186 0 C-N-CA 122.737 -1.776 . . . . 74.340000000000003 112.33 0.012 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 60' ' ' VAL . . . . . 0.538 ' CG2' ' CG ' ' A' ' 129' ' ' GLN . 29.2 m -139.5 172.27 13.08 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.193 -0.458 . . . . 73.530000000000001 111.131 179.923 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 5.1 tt0 -108.35 -17.15 14.07 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.143 -0.48 . . . . 74.319999999999993 110.882 179.99 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 41.4 93.43 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.193 -0.458 . . . . 55.329999999999998 110.86 -179.773 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 16.1 t -124.5 124.02 41.38 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.112 -0.495 . . . . 75.430000000000007 110.835 -179.831 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 64' ' ' ILE . . . . . 0.427 HG21 ' N ' ' A' ' 65' ' ' THR . 14.5 mt -138.34 146.06 27.37 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 116.124 -0.489 . . . . 73.0 111.155 179.889 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 65' ' ' THR . . . . . 0.427 ' N ' HG21 ' A' ' 64' ' ' ILE . 62.1 m -110.32 113.69 26.55 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.162 -0.472 . . . . 73.439999999999998 111.159 179.996 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -91.75 112.24 24.08 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.267 -0.424 . . . . 72.109999999999999 110.92 179.955 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 5.1 t60 -105.27 109.87 22.02 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.203 -0.453 . . . . 74.530000000000001 110.872 179.841 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 68' ' ' PHE . . . . . 0.464 ' CE1' HG22 ' A' ' 114' ' ' ILE . 0.0 OUTLIER -103.75 140.12 38.05 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.208 -0.451 . . . . 74.409999999999997 110.871 -179.916 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . 0.472 ' CB ' HG23 ' A' ' 47' ' ' ILE . . . -119.3 129.36 54.84 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.159 -0.473 . . . . 71.319999999999993 111.093 179.921 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 70' ' ' MET . . . . . 0.501 ' HE3' ' CD1' ' A' ' 114' ' ' ILE . 17.8 mmt -91.35 95.7 10.14 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.22 -0.445 . . . . 64.430000000000007 110.845 -179.993 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -51.61 159.96 1.14 Allowed Pre-proline 0 C--N 1.329 -0.295 0 CA-C-O 121.578 0.704 . . . . 74.239999999999995 111.129 -179.91 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.8 3.29 2.88 Favored 'Trans proline' 0 C--N 1.341 0.163 0 C-N-CA 122.705 2.27 . . . . 75.319999999999993 112.362 179.944 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 73' ' ' MET . . . . . 0.489 ' O ' ' CB ' ' A' ' 76' ' ' TYR . 0.1 OUTLIER -119.73 -25.78 5.83 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.182 -0.463 . . . . 72.439999999999998 110.921 179.911 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 74' ' ' TYR . . . . . 0.651 ' CD1' ' C ' ' A' ' 74' ' ' TYR . 0.0 OUTLIER -48.37 149.59 2.69 Favored Pre-proline 0 C--N 1.329 -0.305 0 CA-C-O 121.692 0.758 . . . . 65.439999999999998 110.987 -179.909 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 75' ' ' PRO . . . . . 0.545 ' HA ' ' CD2' ' A' ' 74' ' ' TYR . 53.6 Cg_endo -69.84 -13.0 12.51 Favored 'Cis proline' 0 C--O 1.232 0.184 0 C-N-CA 122.688 -1.797 . . . . 64.310000000000002 112.341 0.059 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 76' ' ' TYR . . . . . 0.489 ' CB ' ' O ' ' A' ' 73' ' ' MET . 1.5 t80 -34.89 -48.48 0.4 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.232 -0.44 . . . . 73.430000000000007 110.91 -179.917 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 69.6 p -108.2 169.92 8.33 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.119 -0.491 . . . . 75.120000000000005 111.168 -179.985 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -89.59 129.81 45.64 Favored Pre-proline 0 C--N 1.33 -0.282 0 CA-C-O 121.57 0.7 . . . . 61.409999999999997 111.121 179.858 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 79' ' ' PRO . . . . . 0.454 ' HG3' ' CD1' ' A' ' 113' ' ' ILE . 53.6 Cg_endo -69.77 179.38 3.74 Favored 'Trans proline' 0 C--N 1.341 0.163 0 C-N-CA 122.643 2.229 . . . . 71.129999999999995 112.355 -179.989 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -117.1 137.13 52.49 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.219 -0.446 . . . . 73.040000000000006 110.846 -179.921 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 81' ' ' ILE . . . . . 0.414 ' CD1' ' HB3' ' A' ' 68' ' ' PHE . 5.2 mm -125.45 144.21 36.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.164 -0.471 . . . . 74.310000000000002 111.139 179.964 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . 0.456 ' HG3' ' CD ' ' A' ' 84' ' ' LYS . 3.0 pt-20 -145.48 141.25 28.16 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.175 -0.466 . . . . 75.230000000000004 110.901 179.985 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 83' ' ' PHE . . . . . 0.532 ' CZ ' ' HD3' ' A' ' 98' ' ' LYS . 7.5 m-85 -96.97 141.02 30.64 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.196 -0.456 . . . . 70.0 110.886 -179.916 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 84' ' ' LYS . . . . . 0.468 ' O ' ' N ' ' A' ' 86' ' ' VAL . 5.1 mmmt -125.45 172.22 9.84 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.124 -0.489 . . . . 72.109999999999999 110.9 179.952 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . 0.413 ' C ' HG22 ' A' ' 86' ' ' VAL . 2.4 m-80 61.48 -75.24 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.222 -0.445 . . . . 65.319999999999993 110.865 179.939 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 86' ' ' VAL . . . . . 0.468 ' N ' ' O ' ' A' ' 84' ' ' LYS . 2.4 m 39.96 92.63 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.233 -0.44 . . . . 74.409999999999997 111.125 179.916 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -97.06 -87.43 0.31 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.147 -0.478 . . . . 63.039999999999999 110.938 -179.992 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -47.93 -51.25 24.15 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.199 -0.455 . . . . 74.430000000000007 110.897 -179.985 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 89' ' ' VAL . . . . . 0.41 ' CG2' ' HG ' ' A' ' 94' ' ' LEU . 1.2 p -59.53 135.2 24.34 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.187 -0.461 . . . . 75.239999999999995 111.123 179.903 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 90' ' ' MET . . . . . . . . . . . . . 4.7 mtm -86.87 -60.82 1.88 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.168 -0.469 . . . . 74.319999999999993 110.882 179.925 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 3.5 p-10 179.41 -32.1 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.198 -0.455 . . . . 74.140000000000001 110.858 179.961 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 99.8 p -54.6 -45.35 73.63 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.2 -0.455 . . . . 75.329999999999998 110.832 -179.773 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 93' ' ' GLN . . . . . 0.645 ' CD ' ' CD1' ' A' ' 128' ' ' PHE . 1.2 mt-30 -70.2 -38.09 75.25 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.14 -0.482 . . . . 75.219999999999999 110.894 -179.947 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . 0.443 ' CD1' HG11 ' A' ' 86' ' ' VAL . 29.2 mt -58.84 -47.77 83.68 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.217 -0.447 . . . . 74.439999999999998 110.91 -179.986 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 28.4 mt-30 -62.78 -34.1 76.56 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.168 -0.469 . . . . 74.310000000000002 110.952 179.919 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 96' ' ' MET . . . . . 0.464 ' HE3' ' CG ' ' A' ' 124' ' ' LYS . 43.5 ttp -60.47 -37.27 80.48 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.199 -0.455 . . . . 72.150000000000006 110.86 179.941 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 97' ' ' LEU . . . . . 0.611 ' O ' ' CD1' ' A' ' 101' ' ' PHE . 80.4 mt -61.41 -46.57 89.57 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.223 -0.444 . . . . 75.349999999999994 110.891 -179.97 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 98' ' ' LYS . . . . . 0.532 ' HD3' ' CZ ' ' A' ' 83' ' ' PHE . 3.9 mmtp -58.12 -34.16 69.92 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.204 -0.453 . . . . 74.109999999999999 110.87 179.896 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 1.4 t -69.68 -46.29 66.4 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.207 -0.452 . . . . 71.0 110.822 -179.887 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 7.7 pt-20 -72.38 -23.88 61.18 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.145 -0.48 . . . . 71.319999999999993 110.926 -179.973 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 101' ' ' PHE . . . . . 0.611 ' CD1' ' O ' ' A' ' 97' ' ' LEU . 10.1 m-30 -59.42 -22.9 62.14 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.121 -0.49 . . . . 74.129999999999995 110.886 -179.93 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.46 -45.38 59.78 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.155 -0.475 . . . . 74.030000000000001 110.858 -179.999 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 24.6 mtmm -63.24 -38.8 92.57 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.189 -0.46 . . . . 72.540000000000006 110.869 179.922 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 1.6 mp -63.08 -47.63 91.66 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.218 -0.446 . . . . 74.010000000000005 111.108 179.876 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 105' ' ' HIS . . . . . . . . . . . . . 9.3 t-80 -63.12 -41.88 99.43 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.201 -0.454 . . . . 73.439999999999998 110.866 179.867 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -56.73 -43.39 80.6 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.21 -0.45 . . . . 72.209999999999994 110.9 -179.929 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 7.6 t -77.73 -22.39 50.44 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.185 -0.461 . . . . 71.120000000000005 111.162 -179.983 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 1.7 m -118.3 35.46 4.75 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.197 -0.456 . . . . 74.230000000000004 110.862 -179.851 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 14.4 ttt180 -75.87 88.41 2.88 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.163 -0.471 . . . . 70.099999999999994 110.85 -179.919 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 123.33 32.85 0.87 Allowed Glycine 0 N--CA 1.45 -0.369 0 C-N-CA 120.754 -0.736 . . . . 51.409999999999997 112.49 179.987 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 111' ' ' GLN . . . . . . . . . . . . . 3.4 pt20 -169.28 -162.98 0.38 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.794 0.331 . . . . 74.319999999999993 110.878 -179.888 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 35.3 mt-10 -65.9 127.1 30.7 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.162 -0.472 . . . . 74.129999999999995 110.833 -179.896 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 113' ' ' ILE . . . . . 0.454 ' CD1' ' HG3' ' A' ' 79' ' ' PRO . 7.4 pt -126.35 -8.35 5.1 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 116.122 -0.49 . . . . 61.240000000000002 111.13 179.947 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 114' ' ' ILE . . . . . 0.501 ' CD1' ' HE3' ' A' ' 70' ' ' MET . 3.6 mp -67.73 -46.77 81.92 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.174 -0.466 . . . . 73.230000000000004 111.114 179.873 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 115' ' ' PHE . . . . . . . . . . . . . 28.1 t80 -68.28 -36.42 79.37 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.157 -0.474 . . . . 72.420000000000002 110.852 -179.979 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 53.4 mm-40 -67.54 -45.79 74.68 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.139 -0.482 . . . . 73.030000000000001 110.911 -179.945 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 117' ' ' ILE . . . . . 0.461 ' CG2' ' N ' ' A' ' 118' ' ' THR . 0.4 OUTLIER -67.15 -40.41 85.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.111 -0.495 . . . . 75.549999999999997 111.141 179.983 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 118' ' ' THR . . . . . 0.461 ' N ' ' CG2' ' A' ' 117' ' ' ILE . 62.1 p -68.35 -43.43 77.49 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.156 -0.475 . . . . 75.439999999999998 111.114 179.956 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -64.9 -43.89 91.39 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.26 -0.427 . . . . 73.140000000000001 110.829 -179.824 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -60.86 -48.58 81.15 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.13 -0.486 . . . . 74.349999999999994 110.904 -179.961 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 29.5 p -64.52 -40.31 95.39 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.128 -0.487 . . . . 73.140000000000001 111.145 -179.949 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 16.1 tt0 -60.17 -38.14 82.28 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.211 -0.449 . . . . 74.450000000000003 110.955 179.985 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 123' ' ' GLU . . . . . 0.515 ' C ' ' CD ' ' A' ' 123' ' ' GLU . 0.1 OUTLIER -77.87 -46.38 21.55 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.156 -0.475 . . . . 74.319999999999993 110.947 179.986 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 124' ' ' LYS . . . . . 0.464 ' CG ' ' HE3' ' A' ' 96' ' ' MET . 0.0 OUTLIER -64.4 -34.1 77.39 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.127 -0.488 . . . . 74.319999999999993 110.889 179.96 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 1.8 tp -68.96 -43.37 75.14 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.236 -0.438 . . . . 70.019999999999996 110.925 179.926 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -68.12 -36.95 80.55 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.139 -0.482 . . . . 74.530000000000001 110.885 179.863 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 127' ' ' GLU . . . . . 0.434 ' HG3' ' N ' ' A' ' 128' ' ' PHE . 0.0 OUTLIER -62.39 -28.76 70.0 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.155 -0.475 . . . . 73.239999999999995 110.906 -179.947 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 128' ' ' PHE . . . . . 0.645 ' CD1' ' CD ' ' A' ' 93' ' ' GLN . 0.2 OUTLIER -77.07 -31.26 55.92 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.143 -0.48 . . . . 74.530000000000001 110.907 -179.918 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 129' ' ' GLN . . . . . 0.538 ' CG ' ' CG2' ' A' ' 60' ' ' VAL . 0.3 OUTLIER -100.65 32.84 2.96 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.138 -0.483 . . . . 75.409999999999997 110.909 180.0 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 130' ' ' ASN . . . . . . . . . . . . . 1.7 t-20 -101.07 -39.61 7.62 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.208 -0.451 . . . . 73.540000000000006 110.902 -179.984 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 26.3 m -134.39 93.78 1.43 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.156 -0.475 . . . . 72.200000000000003 111.146 179.887 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 132' ' ' VAL . . . . . . . . . . . . . 94.8 t -92.74 127.2 45.02 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.14 -0.482 . . . . 74.530000000000001 111.137 179.911 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 133' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -139.91 30.2 2.05 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.212 -0.449 . . . . 72.239999999999995 110.864 179.961 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 134' ' ' THR . . . . . . . . . . . . . 34.7 p -126.45 156.0 41.33 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.207 -0.451 . . . . 55.340000000000003 111.143 -179.999 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -89.17 111.89 22.77 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.18 -0.463 . . . . 74.329999999999998 110.894 -179.967 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 3.4 m -137.23 124.45 21.76 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.214 -0.448 . . . . 73.0 110.808 -179.792 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 137' ' ' LEU . . . . . . . . . . . . . 15.4 tp -168.21 -49.15 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.125 -0.489 . . . . 75.409999999999997 110.927 -179.983 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.329 -0.283 0 CA-C-N 116.113 -0.494 . . . . 75.109999999999999 110.858 179.956 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.23 0.062 0 CA-C-O 120.798 0.332 . . . . 72.519999999999996 110.871 . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -120.25 133.78 55.4 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.215 -0.448 . . . . 72.239999999999995 110.892 -179.815 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER 177.19 125.14 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.162 -0.472 . . . . 71.219999999999999 110.903 -179.97 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 12.4 p -108.7 51.18 0.75 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.166 -0.47 . . . . 74.310000000000002 110.806 -179.9 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 1.1 t-160 -140.06 82.55 1.87 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.157 -0.474 . . . . 73.439999999999998 110.867 179.986 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . 0.416 HD23 ' C ' ' A' ' 6' ' ' LEU . 0.9 OUTLIER 38.9 89.08 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.258 -0.428 . . . . 64.510000000000005 110.945 -179.967 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -134.79 169.39 17.43 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.22 -0.446 . . . . 74.430000000000007 111.115 179.945 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 16.6 mt -58.34 -26.78 63.5 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.175 -0.466 . . . . 74.530000000000001 110.926 179.987 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -51.4 -32.02 24.8 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.181 -0.463 . . . . 73.540000000000006 110.885 179.802 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 11.4 mm-40 -68.4 -40.32 81.35 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.185 -0.462 . . . . 73.530000000000001 110.896 -179.906 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 10.4 m-85 -49.37 -23.32 1.42 Allowed 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.229 -0.441 . . . . 74.25 110.896 -179.85 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 9.1 m-85 -57.72 -36.34 71.88 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.158 -0.474 . . . . 73.120000000000005 110.958 -179.919 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . 0.477 ' HG3' ' N ' ' A' ' 14' ' ' ILE . 11.9 pt-20 -60.97 -43.55 98.6 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.068 -0.514 . . . . 74.230000000000004 110.868 -179.965 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . 0.477 ' N ' ' HG3' ' A' ' 13' ' ' GLU . 2.8 mp -68.15 -43.32 85.11 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.179 -0.464 . . . . 74.219999999999999 111.19 179.932 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . 0.459 ' HG2' ' CB ' ' A' ' 70' ' ' MET . 20.4 mt-30 -63.16 -45.74 90.44 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.118 -0.492 . . . . 73.049999999999997 110.931 179.928 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 16.1 t -58.86 -41.59 87.38 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.224 -0.444 . . . . 65.129999999999995 110.869 -179.934 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 4.8 m-20 -63.15 -34.02 76.71 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.191 -0.459 . . . . 73.040000000000006 110.87 -179.917 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . 0.415 ' N ' ' OE1' ' A' ' 18' ' ' GLU . 0.0 OUTLIER -66.22 -38.99 89.25 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.193 -0.458 . . . . 61.100000000000001 110.89 -179.994 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 6.0 mt -60.79 -51.64 68.48 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.18 -0.463 . . . . 72.519999999999996 110.883 -179.968 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 4.8 pt-20 -68.74 -38.15 79.93 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.227 -0.442 . . . . 71.450000000000003 110.863 179.943 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -58.63 -50.54 73.47 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.154 -0.475 . . . . 62.130000000000003 111.084 179.977 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . 0.475 HD11 ' N ' ' A' ' 22' ' ' ILE . 0.7 OUTLIER -75.49 -35.83 33.45 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.218 -0.446 . . . . 74.209999999999994 111.115 179.984 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 7.2 mtp180 -52.55 -34.25 49.28 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.178 -0.464 . . . . 72.450000000000003 110.873 179.981 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -66.39 -34.55 78.21 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.183 -0.462 . . . . 74.049999999999997 110.831 -179.816 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . 0.565 HD12 ' CD1' ' A' ' 115' ' ' PHE . 3.7 mt -79.92 -45.34 22.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.178 -0.465 . . . . 61.109999999999999 111.117 179.977 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' TYR . . . . . 0.433 ' CD2' HG23 ' A' ' 50' ' ' ILE . 34.9 m-85 -109.78 45.38 1.1 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.177 -0.465 . . . . 74.420000000000002 110.974 -179.989 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -39.68 -55.6 1.86 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.103 -0.499 . . . . 72.319999999999993 110.882 179.921 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -95.28 -14.69 23.76 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.252 -0.431 . . . . 75.349999999999994 110.88 179.945 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 4.4 m-20 -92.75 31.01 1.44 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.185 -0.461 . . . . 72.409999999999997 110.897 179.997 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' PHE . . . . . 0.519 ' C ' ' CD1' ' A' ' 30' ' ' PHE . 2.0 t80 -120.39 142.26 49.35 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.163 -0.471 . . . . 74.510000000000005 110.846 -179.881 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' THR . . . . . 0.45 ' N ' ' CD1' ' A' ' 30' ' ' PHE . 18.2 m -119.01 129.38 55.1 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.16 -0.473 . . . . 74.439999999999998 111.148 -179.925 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 10.2 t0 -89.27 113.6 24.87 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.206 -0.452 . . . . 72.430000000000007 110.883 179.902 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . 0.49 ' CD2' ' N ' ' A' ' 34' ' ' THR . 0.4 OUTLIER -120.19 -28.92 4.98 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.159 -0.473 . . . . 72.450000000000003 110.891 -179.962 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 34' ' ' THR . . . . . 0.49 ' N ' ' CD2' ' A' ' 33' ' ' LEU . 5.2 m -40.38 139.42 0.76 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.231 -0.441 . . . . 72.530000000000001 111.166 179.957 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -81.96 49.8 1.44 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.237 -0.438 . . . . 74.439999999999998 110.862 179.981 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . 0.403 ' HG2' ' CG2' ' A' ' 34' ' ' THR . 4.8 mmm180 -79.93 131.64 35.88 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.228 -0.442 . . . . 75.340000000000003 110.891 179.986 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER 38.41 66.2 0.53 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.176 -0.465 . . . . 74.140000000000001 110.901 179.975 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 1.2 m -135.85 156.35 48.92 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.219 -0.446 . . . . 75.310000000000002 110.827 -179.901 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 39' ' ' SER . . . . . 0.458 ' O ' ' HB3' ' A' ' 40' ' ' TRP . 21.1 m -82.79 174.77 10.66 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.106 -0.497 . . . . 60.119999999999997 110.883 -179.838 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 40' ' ' TRP . . . . . 0.594 ' O ' ' CE3' ' A' ' 40' ' ' TRP . 0.0 OUTLIER 78.41 -32.48 0.16 Allowed 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.175 -0.466 . . . . 71.219999999999999 110.939 -179.978 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . 0.543 ' HB2' ' CD2' ' A' ' 40' ' ' TRP . 0.7 OUTLIER 173.54 154.54 0.1 Allowed 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.248 -0.433 . . . . 55.310000000000002 110.887 179.933 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 8.1 mttt -135.58 67.34 1.48 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.183 -0.462 . . . . 74.310000000000002 110.914 179.99 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -119.24 62.25 6.2 Favored Pre-proline 0 C--N 1.329 -0.283 0 CA-C-O 121.608 0.718 . . . . 63.109999999999999 110.888 -179.995 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.72 162.56 41.57 Favored 'Trans proline' 0 C--N 1.341 0.178 0 C-N-CA 122.698 2.266 . . . . 75.329999999999998 112.346 179.995 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 45' ' ' GLN . . . . . 0.519 ' O ' ' CG ' ' A' ' 45' ' ' GLN . 7.3 tt0 -140.26 11.56 2.36 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.219 -0.446 . . . . 71.200000000000003 110.921 -179.999 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . 0.454 ' CB ' ' O ' ' A' ' 45' ' ' GLN . 0.0 OUTLIER 82.81 -28.1 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.215 -0.448 . . . . 73.310000000000002 111.118 179.952 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . 0.495 ' N ' HD12 ' A' ' 47' ' ' ILE . 0.2 OUTLIER -37.97 150.42 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.147 -0.479 . . . . 73.219999999999999 111.129 179.877 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 48' ' ' PHE . . . . . 0.475 ' HA ' ' CD2' ' A' ' 33' ' ' LEU . 1.6 p90 -152.35 157.93 41.99 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.187 -0.46 . . . . 72.239999999999995 110.902 179.967 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 7.1 mt-10 -108.76 147.43 32.03 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.164 -0.471 . . . . 71.329999999999998 110.886 -179.939 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . 0.433 HG23 ' CD2' ' A' ' 26' ' ' TYR . 10.8 mm -129.32 135.23 62.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.172 -0.467 . . . . 73.450000000000003 111.132 179.955 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 98.4 m -84.27 132.16 34.66 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.174 -0.466 . . . . 62.210000000000001 111.134 179.945 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 19.8 mt -132.83 157.04 46.01 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.18 -0.464 . . . . 72.219999999999999 110.88 179.983 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -178.64 166.02 1.71 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.219 -0.446 . . . . 74.510000000000005 110.921 179.952 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -62.63 -176.53 0.11 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.223 -0.444 . . . . 53.439999999999998 110.859 -179.765 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 18.5 m -99.08 -24.08 4.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.147 -0.479 . . . . 74.519999999999996 111.096 -179.991 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -112.92 -171.03 1.79 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.196 -0.456 . . . . 54.509999999999998 110.925 179.902 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 6.0 mmmm -119.33 -18.92 8.46 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.234 -0.439 . . . . 74.519999999999996 110.874 179.989 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . 0.548 ' HA ' ' C ' ' A' ' 59' ' ' PRO . 11.2 pt-20 -115.97 143.27 30.53 Favored Pre-proline 0 C--N 1.329 -0.315 0 CA-C-O 121.599 0.714 . . . . 73.409999999999997 110.898 179.939 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 59' ' ' PRO . . . . . 0.548 ' C ' ' HA ' ' A' ' 58' ' ' GLU . 54.0 Cg_endo -69.67 -9.23 10.74 Favored 'Cis proline' 0 C--O 1.232 0.205 0 C-N-CA 122.746 -1.772 . . . . 74.150000000000006 112.355 -0.051 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 60' ' ' VAL . . . . . 0.486 ' O ' ' NE2' ' A' ' 129' ' ' GLN . 11.9 m -152.13 -176.29 0.25 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.215 -0.448 . . . . 72.510000000000005 111.129 179.945 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . 0.457 ' O ' ' C ' ' A' ' 62' ' ' SER . 11.7 tt0 -113.24 -11.95 13.16 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.166 -0.47 . . . . 74.439999999999998 110.898 -179.977 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 62' ' ' SER . . . . . 0.457 ' C ' ' O ' ' A' ' 61' ' ' GLU . 0.1 OUTLIER 33.16 90.56 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.122 -0.49 . . . . 73.409999999999997 110.846 -179.794 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 32.3 t -109.53 124.73 51.58 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.11 -0.495 . . . . 63.25 110.876 -179.849 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 64' ' ' ILE . . . . . . . . . . . . . 14.5 mt -139.71 150.72 22.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.144 -0.48 . . . . 73.510000000000005 111.115 179.998 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 90.7 m -120.9 114.47 21.62 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.182 -0.463 . . . . 73.420000000000002 111.123 179.957 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . 0.577 HD21 ' CD1' ' A' ' 83' ' ' PHE . 17.5 mt -93.81 116.49 28.96 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.224 -0.444 . . . . 74.219999999999999 110.923 179.914 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 7.2 t60 -103.98 115.44 30.45 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.223 -0.444 . . . . 73.540000000000006 110.817 179.883 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 68' ' ' PHE . . . . . 0.555 ' CZ ' HG23 ' A' ' 114' ' ' ILE . 0.0 OUTLIER -103.86 139.75 38.62 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.183 -0.462 . . . . 74.439999999999998 110.889 -179.923 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . 0.425 ' HA ' ' CG2' ' A' ' 47' ' ' ILE . . . -120.44 114.93 22.53 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.125 -0.489 . . . . 74.319999999999993 111.108 179.906 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 70' ' ' MET . . . . . 0.459 ' CB ' ' HG2' ' A' ' 15' ' ' GLN . 1.0 OUTLIER -81.59 95.38 7.14 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.203 -0.453 . . . . 73.140000000000001 110.929 179.929 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -51.36 161.49 0.78 Allowed Pre-proline 0 C--N 1.329 -0.295 0 CA-C-O 121.602 0.715 . . . . 61.509999999999998 111.134 -179.89 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_endo -69.75 -15.09 36.97 Favored 'Trans proline' 0 C--N 1.341 0.158 0 C-N-CA 122.694 2.263 . . . . 72.420000000000002 112.316 179.991 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 73' ' ' MET . . . . . 0.501 ' O ' ' CB ' ' A' ' 76' ' ' TYR . 0.0 OUTLIER -101.38 -20.68 15.07 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.211 -0.45 . . . . 71.219999999999999 110.889 179.876 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 74' ' ' TYR . . . . . 0.668 ' CD1' ' C ' ' A' ' 74' ' ' TYR . 0.0 OUTLIER -50.72 152.42 3.5 Favored Pre-proline 0 C--N 1.328 -0.356 0 CA-C-O 121.654 0.74 . . . . 72.230000000000004 110.913 -179.899 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 75' ' ' PRO . . . . . 0.586 ' HA ' ' CD2' ' A' ' 74' ' ' TYR . 54.1 Cg_endo -69.75 -11.37 11.87 Favored 'Cis proline' 0 C--O 1.231 0.169 0 C-N-CA 122.684 -1.798 . . . . 71.530000000000001 112.334 -0.033 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 76' ' ' TYR . . . . . 0.501 ' CB ' ' O ' ' A' ' 73' ' ' MET . 2.3 t80 -34.06 -56.77 0.48 Allowed 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.175 -0.466 . . . . 63.399999999999999 110.927 -179.895 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 37.6 p -99.46 167.48 10.59 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.117 -0.492 . . . . 75.5 111.14 -179.969 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -89.03 129.93 46.36 Favored Pre-proline 0 C--N 1.329 -0.288 0 CA-C-O 121.576 0.703 . . . . 71.400000000000006 111.096 179.864 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 79' ' ' PRO . . . . . 0.423 ' CG ' HD11 ' A' ' 113' ' ' ILE . 53.4 Cg_endo -69.75 -176.59 1.53 Allowed 'Trans proline' 0 C--N 1.341 0.172 0 C-N-CA 122.695 2.263 . . . . 75.450000000000003 112.365 179.984 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . 0.4 ' HG3' ' N ' ' A' ' 81' ' ' ILE . 2.8 tt0 -114.55 141.16 48.1 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.223 -0.444 . . . . 64.129999999999995 110.912 -179.974 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 81' ' ' ILE . . . . . 0.468 ' CG2' HD22 ' A' ' 66' ' ' LEU . 17.4 mm -133.44 140.88 45.86 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.17 -0.468 . . . . 73.5 111.111 -179.979 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . 0.464 ' HG3' ' CD ' ' A' ' 84' ' ' LYS . 5.9 pt-20 -149.08 145.76 27.39 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.185 -0.461 . . . . 75.530000000000001 110.883 179.95 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 83' ' ' PHE . . . . . 0.577 ' CD1' HD21 ' A' ' 66' ' ' LEU . 26.5 m-85 -97.65 142.14 29.82 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.196 -0.457 . . . . 72.219999999999999 110.896 -179.946 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 84' ' ' LYS . . . . . 0.464 ' CD ' ' HG3' ' A' ' 82' ' ' GLU . 5.1 mmmt -126.92 173.65 9.44 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.167 -0.469 . . . . 75.510000000000005 110.872 179.975 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . 0.482 ' C ' HG21 ' A' ' 86' ' ' VAL . 1.7 m-80 63.29 -72.67 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.175 -0.466 . . . . 72.239999999999995 110.857 179.942 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 86' ' ' VAL . . . . . 0.482 HG21 ' C ' ' A' ' 85' ' ' ASN . 16.6 m 32.13 90.99 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.192 -0.458 . . . . 75.200000000000003 111.125 179.924 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -95.51 -74.14 0.56 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.167 -0.469 . . . . 72.430000000000007 110.91 -179.988 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 88' ' ' ASN . . . . . 0.469 ' ND2' ' HB ' ' A' ' 60' ' ' VAL . 62.4 m-80 -78.61 45.48 0.59 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.204 -0.453 . . . . 70.510000000000005 110.881 -179.974 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 89' ' ' VAL . . . . . 0.401 ' CG1' ' HG ' ' A' ' 94' ' ' LEU . 42.2 t -135.28 140.12 45.55 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.17 -0.468 . . . . 74.140000000000001 111.134 179.914 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 90' ' ' MET . . . . . 0.457 ' O ' ' CB ' ' A' ' 91' ' ' ASP . 22.0 mtm -92.1 -62.0 1.5 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.167 -0.469 . . . . 72.340000000000003 110.839 179.968 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 91' ' ' ASP . . . . . 0.457 ' CB ' ' O ' ' A' ' 90' ' ' MET . 0.4 OUTLIER 163.0 -22.15 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.226 -0.443 . . . . 75.140000000000001 110.857 179.968 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -62.9 -47.18 84.42 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.199 -0.455 . . . . 74.400000000000006 110.887 -179.789 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 93' ' ' GLN . . . . . 0.472 ' HB3' ' CE1' ' A' ' 128' ' ' PHE . 3.8 pm0 -71.26 -36.41 71.75 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.132 -0.485 . . . . 65.129999999999995 110.896 -179.945 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . 0.422 HD22 ' CG1' ' A' ' 86' ' ' VAL . 31.7 mt -58.0 -48.96 78.47 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.191 -0.458 . . . . 74.219999999999999 110.887 -179.97 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 2.4 mm-40 -65.79 -33.57 76.16 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.204 -0.453 . . . . 74.329999999999998 110.871 179.972 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 96' ' ' MET . . . . . . . . . . . . . 6.1 ttp -59.61 -36.65 76.74 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.222 -0.444 . . . . 74.329999999999998 110.898 179.954 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 97' ' ' LEU . . . . . 0.593 ' O ' ' CD1' ' A' ' 101' ' ' PHE . 61.2 mt -66.5 -43.63 84.82 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.201 -0.454 . . . . 73.109999999999999 110.899 -179.99 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 98' ' ' LYS . . . . . 0.421 ' HA ' ' CD2' ' A' ' 101' ' ' PHE . 8.5 mmtp -55.44 -37.1 67.26 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.239 -0.437 . . . . 73.540000000000006 110.897 179.823 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 8.9 m -62.4 -43.61 98.41 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.198 -0.455 . . . . 75.109999999999999 110.872 -179.873 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -71.01 -24.95 62.47 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.11 -0.496 . . . . 73.329999999999998 110.863 -179.96 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 101' ' ' PHE . . . . . 0.593 ' CD1' ' O ' ' A' ' 97' ' ' LEU . 9.0 m-30 -59.62 -40.84 88.92 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.167 -0.469 . . . . 74.439999999999998 110.912 -179.909 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -63.11 -40.26 97.1 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.122 -0.49 . . . . 75.420000000000002 110.882 179.992 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 14.7 ttpt -67.94 -36.5 80.22 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.25 -0.432 . . . . 74.430000000000007 110.901 179.847 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 3.8 mt -67.35 -47.6 80.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.208 -0.451 . . . . 74.340000000000003 111.115 179.895 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 105' ' ' HIS . . . . . . . . . . . . . 14.8 t60 -62.92 -42.19 99.71 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.161 -0.472 . . . . 74.129999999999995 110.881 179.868 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -57.96 -38.28 75.71 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.206 -0.452 . . . . 72.129999999999995 110.94 -179.966 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 8.9 t -88.15 -23.25 23.69 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.161 -0.472 . . . . 75.420000000000002 111.166 -179.992 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 13.4 m -114.59 41.01 2.43 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.174 -0.466 . . . . 55.240000000000002 110.898 -179.897 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 13.7 ttt180 -88.8 90.73 8.54 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.124 -0.489 . . . . 72.319999999999993 110.856 -179.914 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 140.09 -6.16 2.8 Favored Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.754 -0.736 . . . . 74.230000000000004 112.495 -179.966 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 111' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -136.11 -152.59 0.46 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.757 0.313 . . . . 74.129999999999995 110.919 -179.944 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 11.9 mt-10 -79.8 132.3 36.1 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.197 -0.456 . . . . 65.129999999999995 110.921 -179.956 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 113' ' ' ILE . . . . . 0.423 HD11 ' CG ' ' A' ' 79' ' ' PRO . 9.8 pt -126.27 -12.33 4.54 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 116.157 -0.474 . . . . 74.439999999999998 111.127 179.99 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 114' ' ' ILE . . . . . 0.555 HG23 ' CZ ' ' A' ' 68' ' ' PHE . 1.3 mp -63.05 -39.66 86.06 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.195 -0.457 . . . . 74.140000000000001 111.14 179.85 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 115' ' ' PHE . . . . . 0.565 ' CD1' HD12 ' A' ' 25' ' ' ILE . 40.9 t80 -70.96 -38.72 72.81 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.179 -0.464 . . . . 75.310000000000002 110.848 179.976 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 54.9 mm-40 -65.41 -44.04 88.65 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.128 -0.487 . . . . 64.019999999999996 110.849 -179.867 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 117' ' ' ILE . . . . . 0.506 HD12 ' CG ' ' A' ' 101' ' ' PHE . 0.4 OUTLIER -65.14 -40.15 87.89 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.172 -0.467 . . . . 72.530000000000001 111.142 179.965 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 118' ' ' THR . . . . . 0.45 ' N ' ' CG2' ' A' ' 117' ' ' ILE . 58.7 p -67.62 -42.9 81.62 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.176 -0.465 . . . . 74.540000000000006 111.157 179.974 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 119' ' ' SER . . . . . 0.407 ' HA ' ' CG ' ' A' ' 122' ' ' GLN . 0.7 OUTLIER -67.44 -31.41 71.57 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.238 -0.437 . . . . 72.329999999999998 110.864 -179.891 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 120' ' ' PHE . . . . . 0.422 ' O ' ' HG2' ' A' ' 123' ' ' GLU . 0.3 OUTLIER -77.65 -38.74 47.12 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.128 -0.487 . . . . 75.510000000000005 110.888 -179.941 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 121' ' ' THR . . . . . 0.444 ' CG2' HD12 ' A' ' 66' ' ' LEU . 9.7 p -71.64 -42.21 67.86 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.154 -0.476 . . . . 74.120000000000005 111.173 -179.948 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 122' ' ' GLN . . . . . 0.407 ' CG ' ' HA ' ' A' ' 119' ' ' SER . 1.1 pp0? -66.21 -41.08 90.62 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.229 -0.441 . . . . 72.540000000000006 110.93 179.953 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 123' ' ' GLU . . . . . 0.422 ' HG2' ' O ' ' A' ' 120' ' ' PHE . 11.9 pt-20 -68.37 -35.33 77.55 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.214 -0.448 . . . . 74.120000000000005 110.895 -179.915 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 124' ' ' LYS . . . . . 0.436 ' CE ' ' HA ' ' A' ' 124' ' ' LYS . 0.0 OUTLIER -72.16 -44.35 63.2 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.141 -0.481 . . . . 73.340000000000003 110.908 179.958 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 125' ' ' LEU . . . . . 0.551 ' CD1' ' C ' ' A' ' 125' ' ' LEU . 0.2 OUTLIER -65.18 -40.41 94.24 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.248 -0.433 . . . . 73.239999999999995 110.886 179.918 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -63.63 -45.43 90.28 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.223 -0.444 . . . . 74.109999999999999 110.893 179.835 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 127' ' ' GLU . . . . . 0.45 ' HG3' ' N ' ' A' ' 128' ' ' PHE . 0.0 OUTLIER -66.17 -29.3 69.56 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.158 -0.474 . . . . 72.219999999999999 110.896 -179.905 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 128' ' ' PHE . . . . . 0.472 ' CE1' ' HB3' ' A' ' 93' ' ' GLN . 1.8 t80 -61.41 -58.14 9.4 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.131 -0.486 . . . . 75.25 110.889 -179.901 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 129' ' ' GLN . . . . . 0.486 ' NE2' ' O ' ' A' ' 60' ' ' VAL . 1.7 mt-30 -49.02 -21.66 0.73 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.139 -0.482 . . . . 75.420000000000002 110.915 -179.982 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 130' ' ' ASN . . . . . . . . . . . . . 1.3 t-20 -82.52 -41.66 19.38 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.183 -0.462 . . . . 74.299999999999997 110.869 -179.926 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 2.9 m -108.01 24.65 2.88 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.154 -0.476 . . . . 75.530000000000001 111.1 179.944 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 132' ' ' VAL . . . . . . . . . . . . . 7.3 p -57.5 120.15 3.46 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.186 -0.461 . . . . 72.230000000000004 111.104 179.896 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 133' ' ' ASN . . . . . . . . . . . . . 30.2 m-80 -108.89 36.95 2.68 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.212 -0.449 . . . . 71.430000000000007 110.883 179.95 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 134' ' ' THR . . . . . 0.412 ' O ' ' C ' ' A' ' 135' ' ' GLN . 70.1 p -145.87 121.61 10.54 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.191 -0.459 . . . . 73.519999999999996 111.13 -179.973 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 135' ' ' GLN . . . . . 0.412 ' C ' ' O ' ' A' ' 134' ' ' THR . 0.0 OUTLIER -37.08 -38.03 0.18 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.225 -0.443 . . . . 71.010000000000005 110.898 -179.991 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 53.5 p 42.67 48.54 4.79 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.225 -0.443 . . . . 73.010000000000005 110.835 -179.804 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 137' ' ' LEU . . . . . 0.409 ' O ' ' C ' ' A' ' 138' ' ' GLU . 0.0 OUTLIER -105.01 110.31 22.66 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.134 -0.485 . . . . 74.030000000000001 110.915 179.975 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 138' ' ' GLU . . . . . 0.409 ' C ' ' O ' ' A' ' 137' ' ' LEU . 25.4 tt0 . . . . . 0 C--N 1.33 -0.278 0 CA-C-N 116.199 -0.455 . . . . 72.230000000000004 110.903 179.961 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.7 mmm . . . . . 0 C--O 1.231 0.115 0 CA-C-O 120.8 0.333 . . . . 64.540000000000006 110.879 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 6.0 m -135.02 141.22 46.12 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.229 -0.441 . . . . 71.340000000000003 110.869 -179.78 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -110.99 -176.25 2.91 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.128 -0.487 . . . . 74.409999999999997 110.899 -179.985 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 61.1 m -46.59 -64.82 0.67 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.189 -0.46 . . . . 74.200000000000003 110.872 -179.972 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 32.6 m80 -134.79 -63.2 0.71 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.141 -0.481 . . . . 74.129999999999995 110.854 179.966 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 1.1 mp -77.38 121.25 23.52 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.216 -0.447 . . . . 74.310000000000002 110.934 -179.956 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 11.7 t -146.36 158.93 43.94 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.202 -0.454 . . . . 74.099999999999994 111.122 179.98 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 20.2 mt -60.22 -30.49 69.43 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.157 -0.474 . . . . 74.150000000000006 110.888 179.974 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -51.25 -25.58 5.88 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.215 -0.448 . . . . 74.299999999999997 110.881 179.847 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . 0.414 ' O ' ' HG2' ' A' ' 13' ' ' GLU . 10.3 mm-40 -67.77 -38.99 84.16 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.221 -0.445 . . . . 75.409999999999997 110.913 -179.941 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 23.9 m-85 -64.51 -22.2 66.9 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.205 -0.452 . . . . 74.040000000000006 110.889 -179.834 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -57.43 -36.25 71.13 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.143 -0.48 . . . . 72.530000000000001 110.871 -179.842 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . 0.467 ' HG3' ' N ' ' A' ' 14' ' ' ILE . 5.6 pt-20 -59.82 -39.91 86.67 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.112 -0.494 . . . . 70.209999999999994 110.888 -179.981 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . 0.467 ' N ' ' HG3' ' A' ' 13' ' ' GLU . 3.7 mp -67.62 -47.47 80.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.178 -0.465 . . . . 73.450000000000003 111.109 179.967 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 46.4 mt-30 -64.56 -44.53 90.44 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.211 -0.45 . . . . 73.530000000000001 110.888 179.988 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 6.3 t -63.61 -41.47 98.3 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.218 -0.446 . . . . 73.310000000000002 110.865 -179.93 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 1.2 m-20 -57.98 -34.7 70.24 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.214 -0.448 . . . . 74.450000000000003 110.918 -179.936 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -67.23 -38.6 85.51 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.188 -0.46 . . . . 65.540000000000006 110.898 179.973 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . 0.459 ' CD1' HG13 ' A' ' 46' ' ' ILE . 6.1 mt -60.91 -51.52 68.93 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.148 -0.478 . . . . 65.310000000000002 110.936 -179.994 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 4.7 pt-20 -68.62 -37.9 80.11 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.198 -0.455 . . . . 73.209999999999994 110.905 179.917 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -63.83 -50.64 68.09 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.126 -0.488 . . . . 72.439999999999998 111.089 179.924 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . 0.451 ' N ' HD12 ' A' ' 22' ' ' ILE . 0.8 OUTLIER -71.4 -36.58 61.61 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 116.226 -0.443 . . . . 74.109999999999999 111.137 179.983 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -52.48 -34.45 49.32 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.177 -0.465 . . . . 74.439999999999998 110.889 179.963 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -67.23 -36.25 81.27 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.174 -0.466 . . . . 71.150000000000006 110.85 -179.77 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . 0.567 HD12 ' CE1' ' A' ' 115' ' ' PHE . 3.3 mt -79.33 -45.23 23.88 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.153 -0.476 . . . . 75.310000000000002 111.138 179.915 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 29.0 m-85 -109.04 46.35 0.98 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.155 -0.475 . . . . 74.219999999999999 110.936 -179.977 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 1.2 mtm -42.67 -57.4 2.74 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.081 -0.509 . . . . 74.430000000000007 110.9 179.903 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 6.2 p-10 -106.08 32.98 4.04 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.229 -0.441 . . . . 74.510000000000005 110.874 179.937 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -135.01 13.15 3.61 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.187 -0.46 . . . . 70.140000000000001 110.891 179.976 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' PHE . . . . . 0.611 ' C ' ' CD1' ' A' ' 30' ' ' PHE . 0.2 OUTLIER -111.89 139.92 46.98 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.195 -0.457 . . . . 73.319999999999993 110.854 -179.899 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 20.2 m -110.85 128.11 55.66 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.097 -0.501 . . . . 72.409999999999997 111.143 -179.928 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -87.61 113.71 23.55 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.218 -0.446 . . . . 70.030000000000001 110.891 179.918 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . 0.531 ' C ' ' CD2' ' A' ' 33' ' ' LEU . 0.1 OUTLIER -121.73 -16.68 7.63 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.193 -0.458 . . . . 71.040000000000006 110.899 -179.946 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 34' ' ' THR . . . . . 0.528 ' N ' ' CD2' ' A' ' 33' ' ' LEU . 15.8 m -43.6 146.29 0.54 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.204 -0.453 . . . . 73.340000000000003 111.146 179.933 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . 0.464 ' CD ' ' HA ' ' A' ' 44' ' ' PRO . 0.3 OUTLIER -43.48 90.94 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.222 -0.445 . . . . 73.030000000000001 110.902 179.923 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . 0.492 ' N ' ' O ' ' A' ' 34' ' ' THR . 8.1 mmm180 -92.95 40.06 1.05 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.227 -0.442 . . . . 73.140000000000001 110.911 179.963 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . 0.577 ' HB3' ' CZ3' ' A' ' 40' ' ' TRP . 2.3 mmmt -41.81 151.99 0.08 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.147 -0.479 . . . . 73.0 110.871 179.989 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 5.9 t -57.98 -92.65 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.198 -0.455 . . . . 64.040000000000006 110.835 -179.894 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 1.6 m -154.75 87.12 1.14 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.153 -0.476 . . . . 65.0 110.854 -179.817 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 40' ' ' TRP . . . . . 0.577 ' CZ3' ' HB3' ' A' ' 37' ' ' LYS . 0.1 OUTLIER 177.58 -29.47 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.131 -0.486 . . . . 73.319999999999993 110.916 179.979 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 1.3 t70 -138.9 135.11 34.1 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.19 -0.459 . . . . 71.510000000000005 110.867 179.939 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 1.4 mttt -140.66 81.55 1.81 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.203 -0.453 . . . . 75.129999999999995 110.873 180.0 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . 0.496 ' N ' ' CD ' ' A' ' 44' ' ' PRO . 3.6 tt0 -121.43 50.89 2.37 Favored Pre-proline 0 C--N 1.329 -0.283 0 CA-C-O 121.556 0.693 . . . . 74.5 110.892 179.956 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 44' ' ' PRO . . . . . 0.496 ' CD ' ' N ' ' A' ' 43' ' ' GLN . 54.1 Cg_endo -69.69 -179.61 3.0 Favored 'Trans proline' 0 C--N 1.341 0.145 0 C-N-CA 122.721 2.28 . . . . 73.319999999999993 112.349 179.97 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 45' ' ' GLN . . . . . 0.469 ' O ' ' CG ' ' A' ' 45' ' ' GLN . 15.2 tt0 -139.87 8.52 2.33 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.247 -0.433 . . . . 75.299999999999997 110.912 179.995 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . 0.459 HG13 ' CD1' ' A' ' 19' ' ' LEU . 0.0 OUTLIER 81.86 -34.74 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.229 -0.441 . . . . 73.439999999999998 111.112 -179.995 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . 0.473 ' N ' HD12 ' A' ' 47' ' ' ILE . 0.1 OUTLIER -32.97 141.02 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.209 -0.45 . . . . 73.120000000000005 111.12 179.878 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 48' ' ' PHE . . . . . 0.44 ' HA ' ' CD2' ' A' ' 33' ' ' LEU . 1.4 p90 -153.06 164.59 37.73 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.172 -0.467 . . . . 74.25 110.927 179.961 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . 0.437 ' CG ' HD11 ' A' ' 33' ' ' LEU . 12.5 mt-10 -108.86 152.31 25.08 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.183 -0.462 . . . . 71.519999999999996 110.893 -179.953 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 3.8 mm -133.89 141.54 43.73 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.142 -0.481 . . . . 73.010000000000005 111.144 179.951 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 85.8 m -86.28 126.7 34.49 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.168 -0.469 . . . . 73.430000000000007 111.144 179.957 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 16.2 mt -132.59 159.55 39.19 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.194 -0.457 . . . . 72.409999999999997 110.908 179.953 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -178.31 174.56 1.28 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.178 -0.465 . . . . 75.030000000000001 110.918 179.979 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 54' ' ' SER . . . . . 0.475 ' N ' HD11 ' A' ' 125' ' ' LEU . 7.3 p -63.16 -177.61 0.19 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.241 -0.436 . . . . 75.450000000000003 110.844 -179.792 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 30.2 m -91.18 -22.36 6.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.095 -0.502 . . . . 74.120000000000005 111.12 179.943 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -122.74 -170.13 2.04 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.208 -0.451 . . . . 61.030000000000001 110.862 179.95 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 1.7 mmmp? -118.11 -16.56 9.76 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.185 -0.462 . . . . 72.230000000000004 110.888 -179.97 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . 0.551 ' HA ' ' C ' ' A' ' 59' ' ' PRO . 56.8 mt-10 -120.22 146.69 43.14 Favored Pre-proline 0 C--N 1.329 -0.298 0 CA-C-O 121.675 0.75 . . . . 74.310000000000002 110.894 179.97 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 59' ' ' PRO . . . . . 0.551 ' C ' ' HA ' ' A' ' 58' ' ' GLU . 54.0 Cg_endo -69.75 -9.56 11.05 Favored 'Cis proline' 0 C--N 1.342 0.188 0 C-N-CA 122.695 -1.794 . . . . 52.299999999999997 112.334 0.034 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 60' ' ' VAL . . . . . 0.438 ' CG2' ' CG ' ' A' ' 129' ' ' GLN . 22.1 m -141.98 176.16 4.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.247 -0.433 . . . . 75.109999999999999 111.122 179.96 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . 0.447 ' O ' ' C ' ' A' ' 62' ' ' SER . 13.4 tt0 -106.97 -16.73 14.37 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.199 -0.455 . . . . 74.430000000000007 110.879 -180.0 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 62' ' ' SER . . . . . 0.447 ' C ' ' O ' ' A' ' 61' ' ' GLU . 26.7 m 34.12 87.19 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.161 -0.472 . . . . 72.0 110.87 -179.776 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 7.9 t -112.29 127.56 56.02 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.136 -0.483 . . . . 74.329999999999998 110.842 -179.777 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 64' ' ' ILE . . . . . . . . . . . . . 22.5 mt -140.61 140.34 33.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.144 -0.48 . . . . 64.340000000000003 111.127 179.948 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 29.8 m -103.28 117.3 34.19 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.15 -0.477 . . . . 72.299999999999997 111.159 179.968 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 8.9 mt -98.05 115.17 27.68 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.216 -0.447 . . . . 64.540000000000006 110.95 179.942 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 10.5 t60 -111.67 110.08 20.29 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.193 -0.458 . . . . 75.109999999999999 110.885 179.893 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 68' ' ' PHE . . . . . 0.577 ' CE1' HG21 ' A' ' 114' ' ' ILE . 0.0 OUTLIER -102.81 140.21 37.38 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.239 -0.437 . . . . 73.030000000000001 110.897 -179.893 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -120.73 116.41 25.21 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.144 -0.48 . . . . 73.340000000000003 111.073 179.961 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 70' ' ' MET . . . . . 0.479 ' HE3' ' CG1' ' A' ' 114' ' ' ILE . 1.1 mtt -87.06 108.96 19.1 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.241 -0.436 . . . . 74.319999999999993 110.908 179.934 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -61.68 160.38 27.26 Favored Pre-proline 0 C--N 1.33 -0.277 0 CA-C-O 121.516 0.674 . . . . 74.129999999999995 111.174 -179.924 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.83 -4.17 13.53 Favored 'Trans proline' 0 C--N 1.341 0.173 0 C-N-CA 122.636 2.224 . . . . 63.530000000000001 112.373 179.937 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 73' ' ' MET . . . . . 0.505 ' O ' ' CB ' ' A' ' 76' ' ' TYR . 0.0 OUTLIER -111.92 -24.58 9.88 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.183 -0.462 . . . . 74.420000000000002 110.868 179.909 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 74' ' ' TYR . . . . . 0.655 ' CD1' ' C ' ' A' ' 74' ' ' TYR . 0.0 OUTLIER -48.94 152.7 1.73 Allowed Pre-proline 0 C--N 1.329 -0.309 0 CA-C-O 121.666 0.746 . . . . 73.310000000000002 110.941 -179.861 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 75' ' ' PRO . . . . . 0.575 ' HA ' ' CD2' ' A' ' 74' ' ' TYR . 53.4 Cg_endo -69.75 -8.55 10.53 Favored 'Cis proline' 0 C--O 1.232 0.196 0 C-N-CA 122.714 -1.786 . . . . 65.540000000000006 112.319 -0.056 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 76' ' ' TYR . . . . . 0.505 ' CB ' ' O ' ' A' ' 73' ' ' MET . 31.1 t80 -33.0 -46.79 0.16 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.255 -0.43 . . . . 74.329999999999998 110.912 -179.902 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 13.8 p -106.83 -171.44 1.89 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.135 -0.484 . . . . 72.450000000000003 111.125 -179.961 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -104.8 130.41 23.22 Favored Pre-proline 0 C--N 1.329 -0.3 0 CA-C-O 121.577 0.703 . . . . 72.209999999999994 111.123 179.843 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 79' ' ' PRO . . . . . 0.464 ' HG3' ' CD1' ' A' ' 113' ' ' ILE . 53.3 Cg_endo -69.8 167.54 24.19 Favored 'Trans proline' 0 C--O 1.231 0.153 0 C-N-CA 122.648 2.232 . . . . 75.319999999999993 112.336 -179.975 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 1.7 tt0 -118.85 134.82 54.9 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.213 -0.449 . . . . 75.310000000000002 110.876 -179.962 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 81' ' ' ILE . . . . . 0.474 ' CG1' ' HA ' ' A' ' 68' ' ' PHE . 12.1 mt -142.8 150.83 17.8 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.152 -0.476 . . . . 75.340000000000003 111.129 179.973 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . 0.487 ' HG3' ' CD ' ' A' ' 84' ' ' LYS . 9.2 pt-20 -149.43 147.64 28.5 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.167 -0.47 . . . . 71.549999999999997 110.906 179.923 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 83' ' ' PHE . . . . . 0.519 ' CZ ' ' HD3' ' A' ' 98' ' ' LYS . 6.3 m-85 -89.03 140.58 29.29 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.161 -0.472 . . . . 72.329999999999998 110.861 -179.891 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 84' ' ' LYS . . . . . 0.51 ' O ' ' N ' ' A' ' 86' ' ' VAL . 8.7 mmmt -124.26 174.69 7.54 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.133 -0.485 . . . . 65.420000000000002 110.913 179.971 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . 0.411 ' C ' HG23 ' A' ' 86' ' ' VAL . 2.0 m-80 59.66 -76.06 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.265 -0.425 . . . . 63.310000000000002 110.852 179.937 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 86' ' ' VAL . . . . . 0.51 ' N ' ' O ' ' A' ' 84' ' ' LYS . 3.6 m 41.28 87.52 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.162 -0.472 . . . . 72.319999999999993 111.146 179.914 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -94.61 -78.39 0.44 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.187 -0.46 . . . . 75.310000000000002 110.934 -179.989 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 88' ' ' ASN . . . . . 0.423 ' ND2' HG11 ' A' ' 60' ' ' VAL . 33.6 m120 -83.96 55.02 3.11 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.173 -0.467 . . . . 71.219999999999999 110.871 -179.954 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 1.3 p -152.75 145.79 15.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.192 -0.458 . . . . 73.439999999999998 111.145 179.921 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 90' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -95.18 -155.65 0.48 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.176 -0.465 . . . . 65.329999999999998 110.88 179.904 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 91' ' ' ASP . . . . . 0.477 ' O ' ' CG ' ' A' ' 95' ' ' GLN . 0.1 OUTLIER -98.61 -17.76 18.46 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.227 -0.442 . . . . 75.209999999999994 110.883 179.955 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 78.8 p -66.64 -47.11 73.61 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.192 -0.458 . . . . 60.420000000000002 110.911 -179.783 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 93' ' ' GLN . . . . . 0.549 ' CG ' ' CD2' ' A' ' 128' ' ' PHE . 5.0 mt-30 -68.69 -42.97 77.07 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.114 -0.494 . . . . 74.120000000000005 110.918 -179.987 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . 0.419 ' CD2' HG12 ' A' ' 86' ' ' VAL . 0.1 OUTLIER -59.04 -49.11 79.14 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.156 -0.475 . . . . 64.530000000000001 110.91 -179.998 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 95' ' ' GLN . . . . . 0.477 ' CG ' ' O ' ' A' ' 91' ' ' ASP . 7.3 mm-40 -66.06 -35.25 80.03 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.149 -0.478 . . . . 74.140000000000001 110.941 179.911 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 96' ' ' MET . . . . . 0.512 ' SD ' ' CE1' ' A' ' 128' ' ' PHE . 29.5 ttp -60.3 -44.85 95.04 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.187 -0.461 . . . . 73.319999999999993 110.873 179.961 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 97' ' ' LEU . . . . . 0.521 ' O ' ' CD1' ' A' ' 101' ' ' PHE . 33.7 mt -58.13 -39.8 79.67 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.227 -0.442 . . . . 74.299999999999997 110.906 -179.968 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 98' ' ' LYS . . . . . 0.519 ' HD3' ' CZ ' ' A' ' 83' ' ' PHE . 5.6 mmtp -57.39 -43.78 83.94 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.186 -0.461 . . . . 74.219999999999999 110.881 179.82 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -61.3 -39.0 88.83 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.229 -0.442 . . . . 62.5 110.853 -179.879 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 100' ' ' GLU . . . . . 0.501 ' HG2' ' CE1' ' A' ' 120' ' ' PHE . 0.3 OUTLIER -69.86 -28.6 65.79 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.168 -0.469 . . . . 65.129999999999995 110.916 -179.97 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 101' ' ' PHE . . . . . 0.521 ' CD1' ' O ' ' A' ' 97' ' ' LEU . 9.2 m-30 -59.42 -39.17 82.62 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.143 -0.481 . . . . 72.450000000000003 110.843 -179.906 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.81 -39.5 94.38 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.143 -0.48 . . . . 73.310000000000002 110.904 -179.999 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 37.7 mtmt -68.77 -40.98 79.45 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.209 -0.451 . . . . 74.109999999999999 110.891 179.865 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 4.3 mt -65.09 -47.57 87.26 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 116.278 -0.419 . . . . 72.409999999999997 111.166 179.842 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 105' ' ' HIS . . . . . 0.495 ' O ' ' N ' ' A' ' 109' ' ' ARG . 4.6 t60 -62.76 -41.35 99.18 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.191 -0.459 . . . . 63.539999999999999 110.853 179.873 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -59.17 -42.35 90.56 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.224 -0.444 . . . . 74.25 110.89 -179.944 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 10.7 t -82.67 -28.12 30.85 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.191 -0.459 . . . . 74.019999999999996 111.126 -179.955 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 108' ' ' SER . . . . . 0.448 ' O ' ' N ' ' A' ' 110' ' ' GLY . 23.5 m -101.74 13.38 35.05 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.195 -0.457 . . . . 73.109999999999999 110.904 -179.874 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 109' ' ' ARG . . . . . 0.495 ' N ' ' O ' ' A' ' 105' ' ' HIS . 2.6 ttt-85 -61.57 77.88 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.114 -0.494 . . . . 72.230000000000004 110.882 -179.949 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 110' ' ' GLY . . . . . 0.448 ' N ' ' O ' ' A' ' 108' ' ' SER . . . 137.12 31.76 0.25 Allowed Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.739 -0.744 . . . . 61.43 112.52 -179.98 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 111' ' ' GLN . . . . . . . . . . . . . 4.4 pt20 -173.2 -165.69 0.3 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.743 0.306 . . . . 60.350000000000001 110.958 -179.841 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 38.8 mt-10 -65.74 127.64 32.77 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.216 -0.447 . . . . 73.5 110.88 179.994 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 113' ' ' ILE . . . . . 0.464 ' CD1' ' HG3' ' A' ' 79' ' ' PRO . 19.3 pt -126.5 -10.9 4.66 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.133 -0.485 . . . . 74.239999999999995 111.112 179.974 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 114' ' ' ILE . . . . . 0.577 HG21 ' CE1' ' A' ' 68' ' ' PHE . 13.6 mm -67.06 -44.9 87.92 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.221 -0.445 . . . . 75.200000000000003 111.079 179.887 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 115' ' ' PHE . . . . . 0.567 ' CE1' HD12 ' A' ' 25' ' ' ILE . 19.7 t80 -68.98 -34.5 75.41 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.19 -0.459 . . . . 61.329999999999998 110.894 179.962 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 4.9 mm-40 -67.47 -47.53 69.79 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.154 -0.475 . . . . 73.200000000000003 110.89 -179.909 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 117' ' ' ILE . . . . . 0.468 ' CG2' ' N ' ' A' ' 118' ' ' THR . 0.5 OUTLIER -64.31 -40.53 89.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.108 -0.496 . . . . 71.319999999999993 111.165 179.949 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 118' ' ' THR . . . . . 0.468 ' N ' ' CG2' ' A' ' 117' ' ' ILE . 58.3 p -67.03 -43.38 82.94 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.166 -0.47 . . . . 75.209999999999994 111.13 179.93 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -68.07 -39.24 83.01 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.24 -0.437 . . . . 73.420000000000002 110.876 -179.861 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 120' ' ' PHE . . . . . 0.501 ' CE1' ' HG2' ' A' ' 100' ' ' GLU . 0.4 OUTLIER -69.69 -45.21 68.81 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.12 -0.491 . . . . 73.0 110.92 -179.995 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 19.0 p -66.63 -42.17 87.18 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.142 -0.481 . . . . 71.349999999999994 111.144 -179.935 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 122' ' ' GLN . . . . . 0.442 ' NE2' ' O ' ' A' ' 122' ' ' GLN . 0.7 OUTLIER -65.06 -51.28 62.36 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.266 -0.425 . . . . 74.239999999999995 110.943 179.98 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 123' ' ' GLU . . . . . 0.474 ' CG ' ' N ' ' A' ' 124' ' ' LYS . 7.3 pt-20 -62.13 -46.2 90.08 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.188 -0.46 . . . . 74.540000000000006 110.869 -179.953 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 124' ' ' LYS . . . . . 0.474 ' N ' ' CG ' ' A' ' 123' ' ' GLU . 1.1 mmpt? -63.91 -40.07 95.64 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.189 -0.46 . . . . 73.340000000000003 110.874 179.986 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 125' ' ' LEU . . . . . 0.558 ' CD1' ' C ' ' A' ' 125' ' ' LEU . 0.1 OUTLIER -70.09 -38.97 75.83 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.231 -0.44 . . . . 73.510000000000005 110.9 179.92 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 126' ' ' ASP . . . . . 0.451 ' N ' HD13 ' A' ' 125' ' ' LEU . 1.6 t0 -66.72 -46.49 75.35 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.158 -0.474 . . . . 74.120000000000005 110.856 179.872 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -67.88 -28.63 67.69 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.215 -0.448 . . . . 75.129999999999995 110.914 -179.93 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 128' ' ' PHE . . . . . 0.549 ' CD2' ' CG ' ' A' ' 93' ' ' GLN . 0.5 OUTLIER -72.17 -55.65 6.9 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.17 -0.468 . . . . 64.340000000000003 110.906 -179.934 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 129' ' ' GLN . . . . . 0.453 ' C ' ' OE1' ' A' ' 129' ' ' GLN . 1.1 tm0? -42.65 -50.02 5.49 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.132 -0.485 . . . . 74.450000000000003 110.894 -179.952 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 130' ' ' ASN . . . . . 0.403 ' C ' HG11 ' A' ' 131' ' ' VAL . 1.5 t-20 -59.4 -74.57 0.07 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.221 -0.445 . . . . 74.209999999999994 110.832 -179.925 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 131' ' ' VAL . . . . . 0.403 HG11 ' C ' ' A' ' 130' ' ' ASN . 1.4 p 169.23 -51.94 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.159 -0.473 . . . . 74.010000000000005 111.13 179.941 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 132' ' ' VAL . . . . . . . . . . . . . 61.6 t -143.5 136.58 24.72 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 116.143 -0.481 . . . . 74.409999999999997 111.125 179.948 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 133' ' ' ASN . . . . . . . . . . . . . 73.5 m-20 47.76 -174.06 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.164 -0.471 . . . . 72.530000000000001 110.896 179.977 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 134' ' ' THR . . . . . . . . . . . . . 8.6 t -119.3 153.97 34.24 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.214 -0.448 . . . . 72.409999999999997 111.119 -179.976 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -120.29 131.99 55.13 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.165 -0.47 . . . . 74.5 110.928 179.982 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 13.5 t 53.54 75.65 0.25 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.203 -0.453 . . . . 71.329999999999998 110.845 -179.799 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 137' ' ' LEU . . . . . . . . . . . . . 15.5 tp -42.91 -48.9 5.93 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.156 -0.475 . . . . 74.319999999999993 110.897 179.981 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--N 1.33 -0.273 0 CA-C-N 116.206 -0.452 . . . . 72.040000000000006 110.888 179.952 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.23 0.077 0 CA-C-O 120.786 0.327 . . . . 74.439999999999998 110.89 . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 35.3 t -169.18 130.93 1.18 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.169 -0.469 . . . . 71.239999999999995 110.816 -179.76 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER 169.65 125.79 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.172 -0.467 . . . . 75.310000000000002 110.886 179.977 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 15.6 m 59.35 166.33 0.06 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.229 -0.441 . . . . 74.519999999999996 110.878 -179.929 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 1.2 m80 -108.57 -60.49 1.73 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.124 -0.489 . . . . 72.010000000000005 110.835 179.989 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -83.98 93.66 8.11 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.199 -0.455 . . . . 73.400000000000006 110.94 -179.977 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -162.58 169.16 20.67 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.239 -0.437 . . . . 74.150000000000006 111.12 179.971 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 44.1 mt -54.81 -24.48 23.0 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.166 -0.47 . . . . 75.040000000000006 110.904 179.987 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 17.2 t0 -54.19 -31.67 53.55 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.198 -0.455 . . . . 72.209999999999994 110.866 179.828 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . 0.409 ' O ' ' HG2' ' A' ' 13' ' ' GLU . 97.0 mm-40 -66.72 -40.53 88.44 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.218 -0.447 . . . . 60.130000000000003 110.918 -179.901 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 20.1 m-85 -56.09 -22.94 30.9 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.194 -0.457 . . . . 73.439999999999998 110.925 -179.859 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' TYR . . . . . 0.456 ' CE1' ' CG1' ' A' ' 46' ' ' ILE . 0.3 OUTLIER -57.69 -36.34 71.82 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.145 -0.48 . . . . 75.010000000000005 110.869 -179.885 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . 0.469 ' HG3' ' N ' ' A' ' 14' ' ' ILE . 5.0 pt-20 -61.63 -41.11 97.04 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.173 -0.467 . . . . 64.030000000000001 110.874 -179.997 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . 0.469 ' N ' ' HG3' ' A' ' 13' ' ' GLU . 3.8 mp -68.28 -44.33 83.94 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-N 116.153 -0.476 . . . . 73.5 111.125 -179.99 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 10.2 mt-30 -65.99 -47.22 75.27 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.15 -0.477 . . . . 74.209999999999994 110.91 179.944 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 2.5 t -61.4 -40.69 95.29 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.177 -0.465 . . . . 72.200000000000003 110.871 -179.946 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -58.21 -33.72 69.6 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.208 -0.451 . . . . 75.540000000000006 110.887 -179.866 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . 0.401 ' OE1' ' SD ' ' A' ' 70' ' ' MET . 32.6 mt-10 -65.81 -39.08 90.54 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.197 -0.456 . . . . 74.5 110.876 -179.997 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 6.8 mp -63.18 -51.8 64.93 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.144 -0.48 . . . . 73.150000000000006 110.903 -179.943 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 1.7 pt-20 -68.8 -37.22 79.12 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.203 -0.453 . . . . 73.120000000000005 110.895 179.941 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -64.27 -50.51 67.63 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.148 -0.478 . . . . 65.510000000000005 111.066 179.97 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . 0.484 ' N ' HD12 ' A' ' 22' ' ' ILE . 0.9 OUTLIER -71.85 -35.31 54.35 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.272 -0.422 . . . . 73.340000000000003 111.117 179.971 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . 0.435 ' HG3' ' CD2' ' A' ' 30' ' ' PHE . 7.6 mtp180 -54.36 -37.99 65.59 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.174 -0.466 . . . . 71.040000000000006 110.887 179.936 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -65.38 -31.41 72.5 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.18 -0.464 . . . . 42.530000000000001 110.859 -179.786 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 5.1 mt -80.35 -45.43 22.1 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.135 -0.484 . . . . 74.530000000000001 111.099 179.972 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' TYR . . . . . 0.422 ' O ' ' N ' ' A' ' 30' ' ' PHE . 25.1 m-85 -107.97 41.28 1.57 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.175 -0.466 . . . . 70.109999999999999 110.909 -179.94 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' MET . . . . . 0.406 ' C ' ' O ' ' A' ' 26' ' ' TYR . 1.9 mtm -38.08 -52.94 1.42 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.137 -0.483 . . . . 74.420000000000002 110.869 179.907 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -88.83 -33.2 17.47 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.206 -0.452 . . . . 74.310000000000002 110.848 179.979 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -84.5 21.67 1.43 Allowed 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.237 -0.438 . . . . 62.5 110.875 179.997 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' PHE . . . . . 0.435 ' CD2' ' HG3' ' A' ' 23' ' ' ARG . 0.4 OUTLIER -111.0 128.67 55.92 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.189 -0.46 . . . . 71.530000000000001 110.89 -179.889 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 83.2 m -114.2 133.88 55.3 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.157 -0.474 . . . . 65.010000000000005 111.143 -179.923 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 41.8 t0 -98.11 120.5 38.62 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.213 -0.449 . . . . 71.510000000000005 110.891 179.918 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . 0.546 ' C ' ' CD2' ' A' ' 33' ' ' LEU . 0.2 OUTLIER -121.58 0.73 9.97 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.204 -0.453 . . . . 65.310000000000002 110.89 -179.904 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 34' ' ' THR . . . . . 0.454 ' CG2' ' H ' ' A' ' 35' ' ' LYS . 0.2 OUTLIER -53.39 -167.53 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.186 -0.461 . . . . 75.019999999999996 111.184 179.999 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . 0.454 ' H ' ' CG2' ' A' ' 34' ' ' THR . 0.2 OUTLIER -87.35 18.89 3.5 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.252 -0.431 . . . . 74.310000000000002 110.839 179.95 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.99 -94.44 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.242 -0.436 . . . . 74.340000000000003 110.867 179.992 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 5.5 mmpt? -87.27 57.53 4.51 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.206 -0.452 . . . . 73.510000000000005 110.916 179.95 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 52.9 p -142.41 78.83 1.64 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.252 -0.431 . . . . 73.420000000000002 110.887 -179.915 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 5.9 m -63.7 99.3 0.22 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.175 -0.466 . . . . 65.219999999999999 110.851 -179.789 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 40' ' ' TRP . . . . . . . . . . . . . 33.2 t-105 -171.59 -47.18 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.169 -0.469 . . . . 73.299999999999997 110.913 -179.963 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 34.1 t70 -143.74 152.19 40.96 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.265 -0.425 . . . . 55.43 110.904 179.949 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -123.65 65.22 1.02 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.228 -0.442 . . . . 75.430000000000007 110.911 179.987 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 23.6 mt-30 -159.12 75.01 3.34 Favored Pre-proline 0 C--N 1.329 -0.325 0 CA-C-O 121.574 0.702 . . . . 74.049999999999997 110.928 179.971 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 44' ' ' PRO . . . . . 0.45 ' CG ' ' HG2' ' A' ' 35' ' ' LYS . 53.4 Cg_endo -69.72 -177.84 2.05 Favored 'Trans proline' 0 C--N 1.341 0.161 0 C-N-CA 122.694 2.263 . . . . 71.049999999999997 112.35 179.992 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 45' ' ' GLN . . . . . 0.457 ' HG2' ' CD1' ' A' ' 47' ' ' ILE . 7.4 pt20 -157.13 18.19 0.29 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.225 -0.443 . . . . 75.010000000000005 110.913 -179.996 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . 0.456 ' CG1' ' CE1' ' A' ' 12' ' ' TYR . 15.4 mm 69.9 75.48 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.177 -0.465 . . . . 63.32 111.153 179.961 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . 0.527 ' N ' ' CD1' ' A' ' 47' ' ' ILE . 0.2 OUTLIER -142.52 148.33 20.13 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.171 -0.468 . . . . 73.409999999999997 111.135 179.875 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 22.3 p90 -162.14 155.4 20.58 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.146 -0.479 . . . . 72.129999999999995 110.903 179.919 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 13.4 mt-10 -108.44 151.88 25.44 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.199 -0.455 . . . . 74.319999999999993 110.87 -179.901 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . 0.401 ' CD1' ' HA ' ' A' ' 30' ' ' PHE . 29.9 mm -130.38 135.71 60.06 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.132 -0.486 . . . . 73.010000000000005 111.155 179.958 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 84.8 m -87.19 116.97 25.63 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.208 -0.451 . . . . 74.140000000000001 111.163 179.954 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 18.3 mt -117.0 164.91 13.99 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.241 -0.436 . . . . 71.420000000000002 110.94 179.959 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -175.76 175.84 1.96 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.203 -0.453 . . . . 75.010000000000005 110.865 179.943 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 76.6 p -66.69 -154.3 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.156 -0.474 . . . . 73.340000000000003 110.843 -179.789 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 17.3 m -119.21 -19.64 5.42 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.135 -0.484 . . . . 63.210000000000001 111.123 179.976 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -114.23 178.66 4.2 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.186 -0.461 . . . . 75.400000000000006 110.866 179.911 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . 0.457 ' C ' ' O ' ' A' ' 60' ' ' VAL . 0.0 OUTLIER -118.24 -5.63 10.88 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.168 -0.469 . . . . 73.310000000000002 110.917 179.974 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . 0.541 ' HA ' ' C ' ' A' ' 59' ' ' PRO . 2.9 pt-20 -135.57 145.65 54.24 Favored Pre-proline 0 C--N 1.329 -0.287 0 CA-C-O 121.654 0.74 . . . . 75.439999999999998 110.91 179.939 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 59' ' ' PRO . . . . . 0.541 ' C ' ' HA ' ' A' ' 58' ' ' GLU . 53.6 Cg_endo -69.78 -6.92 9.73 Favored 'Cis proline' 0 C--N 1.342 0.185 0 C-N-CA 122.654 -1.811 . . . . 71.049999999999997 112.332 0.011 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 60' ' ' VAL . . . . . 0.458 HG23 ' CG ' ' A' ' 129' ' ' GLN . 32.3 m -140.89 -174.25 0.75 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.205 -0.452 . . . . 75.540000000000006 111.115 179.954 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . 0.46 ' O ' ' C ' ' A' ' 62' ' ' SER . 7.2 tt0 -119.28 -12.2 9.45 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.182 -0.463 . . . . 73.219999999999999 110.879 -179.965 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 62' ' ' SER . . . . . 0.46 ' C ' ' O ' ' A' ' 61' ' ' GLU . 0.2 OUTLIER 33.8 89.21 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.158 -0.474 . . . . 71.540000000000006 110.888 -179.79 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 5.0 p -119.06 123.63 44.94 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.158 -0.474 . . . . 74.0 110.839 -179.802 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 64' ' ' ILE . . . . . . . . . . . . . 33.6 mt -135.69 134.96 51.46 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.126 -0.488 . . . . 75.219999999999999 111.131 179.921 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 36.6 m -98.81 113.98 26.34 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.157 -0.474 . . . . 62.539999999999999 111.133 179.969 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . 0.442 ' CD1' ' CD1' ' A' ' 83' ' ' PHE . 0.4 OUTLIER -94.74 111.37 23.15 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.236 -0.438 . . . . 74.329999999999998 110.899 179.984 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 5.1 t60 -103.38 112.02 24.72 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.217 -0.447 . . . . 75.340000000000003 110.873 179.843 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 68' ' ' PHE . . . . . 0.566 ' CE1' HG22 ' A' ' 114' ' ' ILE . 0.0 OUTLIER -103.76 139.91 38.35 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.227 -0.442 . . . . 74.209999999999994 110.861 -179.897 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . 0.504 ' CB ' HG21 ' A' ' 47' ' ' ILE . . . -123.66 116.22 22.73 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.171 -0.468 . . . . 75.540000000000006 111.058 179.94 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 70' ' ' MET . . . . . 0.453 ' HE1' ' CG1' ' A' ' 114' ' ' ILE . 0.0 OUTLIER -79.39 160.58 26.62 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.222 -0.445 . . . . 72.340000000000003 110.852 179.974 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -116.92 161.13 34.01 Favored Pre-proline 0 C--N 1.329 -0.295 0 CA-C-O 121.551 0.691 . . . . 63.340000000000003 111.145 -179.904 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.77 3.07 2.99 Favored 'Trans proline' 0 C--N 1.341 0.152 0 C-N-CA 122.702 2.268 . . . . 74.230000000000004 112.335 179.942 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 73' ' ' MET . . . . . 0.495 ' O ' ' CB ' ' A' ' 76' ' ' TYR . 0.5 OUTLIER -122.19 -24.98 4.97 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.201 -0.454 . . . . 73.099999999999994 110.901 179.889 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 74' ' ' TYR . . . . . 0.647 ' CD1' ' C ' ' A' ' 74' ' ' TYR . 0.0 OUTLIER -46.74 149.92 1.38 Allowed Pre-proline 0 C--N 1.329 -0.323 0 CA-C-O 121.698 0.761 . . . . 73.140000000000001 110.929 -179.875 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 75' ' ' PRO . . . . . 0.567 ' HA ' ' CD2' ' A' ' 74' ' ' TYR . 53.5 Cg_endo -69.8 -10.31 11.51 Favored 'Cis proline' 0 C--O 1.232 0.198 0 C-N-CA 122.713 -1.786 . . . . 41.530000000000001 112.307 0.007 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 76' ' ' TYR . . . . . 0.495 ' CB ' ' O ' ' A' ' 73' ' ' MET . 24.3 t80 -34.08 -45.84 0.22 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.264 -0.426 . . . . 72.129999999999995 110.914 -179.91 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 28.3 p -108.65 175.39 5.48 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.129 -0.487 . . . . 73.319999999999993 111.162 -179.969 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -100.55 127.69 32.07 Favored Pre-proline 0 C--N 1.329 -0.312 0 CA-C-O 121.541 0.686 . . . . 63.530000000000001 111.131 179.875 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.85 -168.82 0.3 Allowed 'Trans proline' 0 C--N 1.341 0.158 0 C-N-CA 122.656 2.237 . . . . 71.409999999999997 112.304 -179.947 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . 0.468 ' HG3' ' N ' ' A' ' 81' ' ' ILE . 0.3 OUTLIER -129.24 140.92 51.28 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.19 -0.459 . . . . 75.430000000000007 110.91 -179.976 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 81' ' ' ILE . . . . . 0.468 ' N ' ' HG3' ' A' ' 80' ' ' GLU . 3.1 mm -129.03 148.34 33.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.131 -0.486 . . . . 74.200000000000003 111.117 179.985 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . 0.497 ' HG3' ' CD ' ' A' ' 84' ' ' LYS . 4.1 pt-20 -147.83 142.85 27.0 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.195 -0.457 . . . . 63.240000000000002 110.908 179.966 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 83' ' ' PHE . . . . . 0.573 ' CE1' HD11 ' A' ' 97' ' ' LEU . 8.9 m-85 -99.39 138.64 36.19 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.171 -0.468 . . . . 71.109999999999999 110.899 -179.937 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 84' ' ' LYS . . . . . 0.497 ' CD ' ' HG3' ' A' ' 82' ' ' GLU . 7.7 mmmt -125.95 170.48 11.64 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.198 -0.455 . . . . 73.239999999999995 110.893 179.925 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . 0.62 ' N ' HD21 ' A' ' 85' ' ' ASN . 0.8 OUTLIER 63.86 -72.97 0.05 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.232 -0.44 . . . . 74.200000000000003 110.889 179.97 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 86' ' ' VAL . . . . . 0.444 ' N ' ' O ' ' A' ' 84' ' ' LYS . 4.7 m 35.62 89.96 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.18 -0.464 . . . . 75.519999999999996 111.098 179.906 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -95.09 -68.14 0.82 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.173 -0.467 . . . . 62.109999999999999 110.862 -179.991 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 88' ' ' ASN . . . . . 0.417 ' C ' HG23 ' A' ' 89' ' ' VAL . 19.9 t-20 -82.16 40.92 0.65 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.23 -0.441 . . . . 72.420000000000002 110.868 -179.943 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 89' ' ' VAL . . . . . 0.417 HG23 ' C ' ' A' ' 88' ' ' ASN . 6.6 t -132.95 149.19 31.54 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.223 -0.444 . . . . 73.030000000000001 111.142 179.902 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 90' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -101.86 -69.52 0.78 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.175 -0.466 . . . . 74.439999999999998 110.843 179.936 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 2.7 p30 -177.31 -43.44 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.208 -0.451 . . . . 72.340000000000003 110.848 -179.975 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -54.22 -38.93 66.23 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.173 -0.467 . . . . 73.0 110.886 -179.794 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 93' ' ' GLN . . . . . 0.54 ' OE1' ' CG ' ' A' ' 128' ' ' PHE . 4.0 tt0 -65.94 -45.18 82.75 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.083 -0.508 . . . . 75.010000000000005 110.932 -179.954 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 80.9 mt -60.51 -48.58 81.14 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.194 -0.457 . . . . 72.239999999999995 110.922 -179.994 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 2.7 mm-40 -63.66 -33.83 76.5 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.215 -0.448 . . . . 63.420000000000002 110.933 179.904 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 96' ' ' MET . . . . . . . . . . . . . 11.9 ttp -59.71 -39.49 84.8 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.191 -0.459 . . . . 73.519999999999996 110.901 179.946 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 97' ' ' LEU . . . . . 0.616 ' O ' ' CD1' ' A' ' 101' ' ' PHE . 29.1 mt -66.35 -39.13 88.98 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.193 -0.458 . . . . 73.519999999999996 110.934 -179.987 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 98' ' ' LYS . . . . . 0.437 ' HD3' ' CZ ' ' A' ' 83' ' ' PHE . 3.0 mmtp -61.62 -34.38 75.57 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.188 -0.46 . . . . 75.549999999999997 110.893 179.796 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 3.1 m -70.34 -45.88 65.28 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.233 -0.439 . . . . 74.409999999999997 110.872 -179.894 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 100' ' ' GLU . . . . . 0.403 ' HG2' ' O ' ' A' ' 97' ' ' LEU . 11.2 pt-20 -72.56 -23.79 61.03 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.159 -0.473 . . . . 62.520000000000003 110.906 -179.957 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 101' ' ' PHE . . . . . 0.616 ' CD1' ' O ' ' A' ' 97' ' ' LEU . 8.3 m-30 -59.87 -38.02 80.98 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.124 -0.489 . . . . 74.540000000000006 110.856 -179.918 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -62.33 -40.11 95.29 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.16 -0.473 . . . . 73.310000000000002 110.868 179.998 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 4.1 tmmt? -67.57 -39.81 84.89 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.31 -0.405 . . . . 72.439999999999998 110.873 179.877 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 1.8 mt -62.9 -47.15 94.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.217 -0.447 . . . . 61.140000000000001 111.16 179.861 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 105' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -62.84 -43.07 99.78 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.126 -0.488 . . . . 74.099999999999994 110.868 179.862 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -59.98 -31.04 69.53 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.198 -0.455 . . . . 64.409999999999997 110.907 -179.944 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 10.7 t -97.77 -9.66 26.18 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.15 -0.477 . . . . 73.420000000000002 111.152 -179.957 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 37.5 m -124.58 36.96 4.51 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.193 -0.458 . . . . 73.439999999999998 110.843 -179.827 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -97.18 93.83 6.77 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.155 -0.475 . . . . 75.140000000000001 110.878 -179.941 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 151.67 -13.88 0.79 Allowed Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.713 -0.756 . . . . 74.340000000000003 112.503 -179.954 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 111' ' ' GLN . . . . . . . . . . . . . 1.3 pt20 -132.09 -95.5 0.34 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.769 0.319 . . . . 75.230000000000004 110.884 -179.855 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 26.6 mt-10 -137.47 141.58 41.55 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.181 -0.463 . . . . 71.230000000000004 110.918 -179.942 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 113' ' ' ILE . . . . . . . . . . . . . 19.1 pt -124.17 -7.77 7.01 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.134 -0.484 . . . . 74.329999999999998 111.086 -179.977 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 114' ' ' ILE . . . . . 0.566 HG22 ' CE1' ' A' ' 68' ' ' PHE . 38.6 mm -67.07 -42.17 88.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.178 -0.464 . . . . 74.430000000000007 111.151 179.881 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 115' ' ' PHE . . . . . . . . . . . . . 29.2 t80 -72.53 -40.96 66.35 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.149 -0.478 . . . . 65.310000000000002 110.871 179.938 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 19.5 mm-40 -63.91 -42.57 97.37 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.16 -0.473 . . . . 74.230000000000004 110.923 -179.938 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 117' ' ' ILE . . . . . 0.576 HD12 ' CD2' ' A' ' 101' ' ' PHE . 0.4 OUTLIER -67.22 -41.97 87.37 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.116 -0.493 . . . . 74.519999999999996 111.179 179.952 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 118' ' ' THR . . . . . 0.481 ' N ' ' CG2' ' A' ' 117' ' ' ILE . 69.0 p -68.33 -43.12 78.26 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.158 -0.474 . . . . 61.539999999999999 111.141 179.903 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -64.51 -43.96 92.43 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.24 -0.436 . . . . 62.420000000000002 110.855 -179.809 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -63.1 -45.44 92.04 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.097 -0.501 . . . . 75.319999999999993 110.925 -179.986 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 25.0 p -69.17 -38.83 78.91 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.15 -0.477 . . . . 74.400000000000006 111.158 -179.982 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -64.21 -38.81 92.37 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.229 -0.441 . . . . 73.120000000000005 110.901 -179.999 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 123' ' ' GLU . . . . . 0.465 ' HG3' ' N ' ' A' ' 124' ' ' LYS . 6.4 pt-20 -77.65 -39.0 46.56 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.232 -0.44 . . . . 65.530000000000001 110.881 -179.925 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 124' ' ' LYS . . . . . 0.465 ' N ' ' HG3' ' A' ' 123' ' ' GLU . 0.1 OUTLIER -70.33 -39.64 74.63 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.214 -0.448 . . . . 74.120000000000005 110.865 179.982 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 1.3 tp -61.74 -50.43 72.45 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.253 -0.43 . . . . 65.409999999999997 110.928 179.929 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 3.1 t0 -57.84 -39.19 77.11 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.175 -0.466 . . . . 75.310000000000002 110.893 179.8 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 127' ' ' GLU . . . . . 0.469 ' HG3' ' N ' ' A' ' 128' ' ' PHE . 0.0 OUTLIER -63.96 -28.8 70.06 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.156 -0.474 . . . . 74.109999999999999 110.884 -179.879 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 128' ' ' PHE . . . . . 0.54 ' CG ' ' OE1' ' A' ' 93' ' ' GLN . 0.3 OUTLIER -71.45 -68.95 0.41 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.155 -0.475 . . . . 72.329999999999998 110.905 -179.949 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 129' ' ' GLN . . . . . 0.458 ' CG ' HG23 ' A' ' 60' ' ' VAL . 1.7 tm0? -35.58 -38.71 0.12 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.124 -0.489 . . . . 75.430000000000007 110.901 -179.967 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 130' ' ' ASN . . . . . . . . . . . . . 1.5 m-20 -64.38 -45.66 86.73 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.207 -0.451 . . . . 73.549999999999997 110.862 -179.956 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 131' ' ' VAL . . . . . 0.502 ' N ' ' O ' ' A' ' 128' ' ' PHE . 2.9 m -110.05 28.48 1.88 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.212 -0.449 . . . . 75.340000000000003 111.119 179.942 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 132' ' ' VAL . . . . . 0.401 ' N ' ' O ' ' A' ' 128' ' ' PHE . 14.4 p -73.87 132.59 33.16 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.177 -0.465 . . . . 74.200000000000003 111.135 179.89 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 133' ' ' ASN . . . . . . . . . . . . . 10.0 p30 -125.68 43.23 3.11 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.217 -0.447 . . . . 75.25 110.851 179.996 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 134' ' ' THR . . . . . . . . . . . . . 30.7 p -145.73 158.42 43.86 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.227 -0.442 . . . . 73.200000000000003 111.155 -179.991 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -143.59 133.89 24.56 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.241 -0.436 . . . . 73.140000000000001 110.895 -179.972 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 2.5 m -132.73 -49.87 0.9 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.217 -0.447 . . . . 73.140000000000001 110.845 -179.794 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 137' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -51.48 111.54 0.6 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.126 -0.488 . . . . 74.549999999999997 110.926 -179.992 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.329 -0.29 0 CA-C-N 116.185 -0.462 . . . . 75.329999999999998 110.897 179.929 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.458 -0.052 0 CA-C-O 120.819 0.342 . . . . 75.329999999999998 110.891 . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 3.1 m -133.54 -45.16 0.82 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.16 -0.473 . . . . 71.450000000000003 110.865 -179.843 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER 66.42 98.98 0.05 OUTLIER 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.13 -0.486 . . . . 62.340000000000003 110.927 -179.993 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -173.58 174.76 3.12 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.164 -0.471 . . . . 74.510000000000005 110.809 -179.936 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 6.6 m-70 -72.85 81.48 1.17 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.068 -0.514 . . . . 74.030000000000001 110.857 179.982 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 2.6 tp -126.82 114.68 18.24 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.175 -0.466 . . . . 73.030000000000001 110.903 -179.986 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 7.7 t -161.66 178.28 9.17 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.222 -0.444 . . . . 75.439999999999998 111.113 179.954 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 63.3 mt -70.01 -28.82 65.81 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.21 -0.45 . . . . 73.109999999999999 110.88 179.979 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 1.2 t70 -50.5 -33.93 23.26 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.208 -0.451 . . . . 62.329999999999998 110.874 179.84 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 59.0 mm-40 -67.65 -36.8 81.42 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.195 -0.457 . . . . 73.239999999999995 110.904 -179.934 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 16.8 m-85 -62.82 -27.67 69.48 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.206 -0.452 . . . . 65.310000000000002 110.916 -179.841 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 1.5 t80 -60.07 -37.77 80.88 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.111 -0.495 . . . . 74.319999999999993 110.955 -179.924 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 2.1 mm-40 -61.47 -45.65 93.35 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.107 -0.497 . . . . 65.329999999999998 110.872 180.0 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 3.7 mp -65.76 -40.73 88.58 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.196 -0.456 . . . . 73.230000000000004 111.145 179.974 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 80.5 mt-30 -59.2 -47.03 86.83 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.197 -0.456 . . . . 62.109999999999999 110.902 179.954 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 4.6 t -63.86 -42.34 97.58 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.21 -0.45 . . . . 72.25 110.844 -179.924 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -57.8 -33.51 68.66 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.199 -0.455 . . . . 71.450000000000003 110.842 -179.844 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . 0.487 ' OE1' ' CD1' ' A' ' 114' ' ' ILE . 1.4 mm-40 -67.25 -38.72 85.61 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.193 -0.458 . . . . 75.140000000000001 110.908 -179.996 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . 0.531 HD13 ' CE1' ' A' ' 48' ' ' PHE . 8.6 mp -62.63 -51.53 66.9 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.142 -0.481 . . . . 74.409999999999997 110.916 179.993 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 1.8 pt-20 -68.72 -31.77 71.08 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.165 -0.47 . . . . 70.019999999999996 110.889 179.964 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -63.93 -48.39 76.75 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.177 -0.465 . . . . 75.319999999999993 111.082 179.928 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 0.7 OUTLIER -76.93 -37.1 26.53 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.234 -0.439 . . . . 74.430000000000007 111.122 179.981 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 2.7 mtt180 -52.55 -34.22 49.14 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.198 -0.456 . . . . 73.099999999999994 110.844 -179.985 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -66.18 -37.81 86.5 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.194 -0.457 . . . . 73.209999999999994 110.874 -179.809 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . 0.499 HD13 ' CE1' ' A' ' 115' ' ' PHE . 3.2 mt -78.81 -45.16 25.11 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.127 -0.488 . . . . 72.219999999999999 111.171 179.922 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 17.5 m-85 -106.94 45.11 1.0 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.168 -0.469 . . . . 74.299999999999997 110.916 179.998 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 1.5 mtm -45.15 -61.25 1.72 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.11 -0.496 . . . . 74.430000000000007 110.902 179.871 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 15.6 m-20 -75.5 -28.55 59.22 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.2 -0.454 . . . . 74.400000000000006 110.892 179.95 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -94.2 37.84 1.1 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.153 -0.476 . . . . 63.130000000000003 110.871 -179.99 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 9.3 t80 -117.71 129.06 55.48 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.191 -0.459 . . . . 74.219999999999999 110.889 -179.908 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 82.7 m -118.13 131.13 56.44 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.167 -0.47 . . . . 72.430000000000007 111.174 -179.962 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 9.4 t0 -105.12 114.46 28.67 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.244 -0.434 . . . . 75.209999999999994 110.833 179.959 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . 0.655 ' CD2' ' CE1' ' A' ' 67' ' ' HIS . 0.2 OUTLIER -111.05 -6.3 14.66 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.208 -0.451 . . . . 65.019999999999996 110.913 -179.965 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 34' ' ' THR . . . . . 0.493 ' O ' ' N ' ' A' ' 36' ' ' ARG . 0.2 OUTLIER -45.95 123.49 4.57 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.198 -0.456 . . . . 72.450000000000003 111.148 179.968 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -51.48 86.35 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.207 -0.451 . . . . 74.420000000000002 110.863 179.915 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . 0.493 ' N ' ' O ' ' A' ' 34' ' ' THR . 0.7 OUTLIER -105.12 -63.92 1.18 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.242 -0.435 . . . . 74.430000000000007 110.924 179.906 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . 0.423 ' HE2' ' C ' ' A' ' 37' ' ' LYS . 0.0 OUTLIER -138.75 138.83 38.02 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.149 -0.478 . . . . 72.310000000000002 110.887 179.959 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 58.0 m 61.39 99.9 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.205 -0.452 . . . . 73.319999999999993 110.838 -179.873 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 68.9 m -167.97 -172.64 1.86 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.141 -0.481 . . . . 74.439999999999998 110.902 -179.83 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 40' ' ' TRP . . . . . . . . . . . . . 30.0 p90 -108.69 -20.84 12.94 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.138 -0.483 . . . . 72.010000000000005 110.943 179.965 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -131.23 167.16 19.66 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.244 -0.434 . . . . 62.350000000000001 110.892 179.911 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 2.9 mttt -142.58 63.87 1.38 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.196 -0.456 . . . . 75.430000000000007 110.918 -179.978 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 1.4 pp0? -150.43 61.81 5.01 Favored Pre-proline 0 C--N 1.33 -0.257 0 CA-C-O 121.629 0.728 . . . . 74.319999999999993 110.949 179.941 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.76 -163.52 0.11 Allowed 'Trans proline' 0 C--N 1.341 0.176 0 C-N-CA 122.683 2.255 . . . . 62.340000000000003 112.338 -179.974 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 45' ' ' GLN . . . . . 0.519 ' O ' ' CB ' ' A' ' 46' ' ' ILE . 0.1 OUTLIER -179.68 32.64 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.188 -0.46 . . . . 74.129999999999995 110.895 -179.976 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . 0.519 ' CB ' ' O ' ' A' ' 45' ' ' GLN . 0.1 OUTLIER 86.82 -16.67 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.222 -0.444 . . . . 63.340000000000003 111.126 179.974 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . 0.523 ' N ' ' CD1' ' A' ' 47' ' ' ILE . 0.1 OUTLIER -45.62 149.63 0.31 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-N 116.16 -0.473 . . . . 74.430000000000007 111.105 179.872 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 48' ' ' PHE . . . . . 0.531 ' CE1' HD13 ' A' ' 19' ' ' LEU . 27.8 p90 -158.46 171.09 20.79 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.122 -0.49 . . . . 75.230000000000004 110.885 179.936 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . 0.492 ' CG ' ' HB2' ' A' ' 67' ' ' HIS . 5.8 mt-10 -119.35 161.16 20.94 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.168 -0.469 . . . . 74.230000000000004 110.884 -179.924 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 8.2 mm -142.96 137.43 26.86 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.147 -0.478 . . . . 72.400000000000006 111.087 179.994 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 85.5 m -83.9 131.58 34.85 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.17 -0.468 . . . . 60.130000000000003 111.105 179.971 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . 0.451 HD13 ' CD1' ' A' ' 66' ' ' LEU . 17.4 mt -134.79 159.5 41.15 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.187 -0.461 . . . . 72.030000000000001 110.873 179.989 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 53' ' ' ARG . . . . . 0.411 ' HD2' ' C ' ' A' ' 52' ' ' LEU . 0.0 OUTLIER 178.82 166.21 0.89 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.156 -0.474 . . . . 75.239999999999995 110.885 179.977 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -57.38 167.3 1.0 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.153 -0.476 . . . . 75.430000000000007 110.841 -179.789 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 19.2 m -78.91 -21.52 12.81 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.111 -0.495 . . . . 73.049999999999997 111.096 179.965 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 2.4 t70 -118.54 -172.05 2.2 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.201 -0.454 . . . . 73.439999999999998 110.837 179.97 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 3.3 mmmm -119.04 -17.51 8.98 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.218 -0.446 . . . . 74.239999999999995 110.919 179.962 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . 0.539 ' HA ' ' C ' ' A' ' 59' ' ' PRO . 4.7 pt-20 -120.08 145.77 40.74 Favored Pre-proline 0 C--N 1.33 -0.28 0 CA-C-O 121.664 0.745 . . . . 72.340000000000003 110.868 179.944 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 59' ' ' PRO . . . . . 0.539 ' C ' ' HA ' ' A' ' 58' ' ' GLU . 52.9 Cg_endo -69.81 -14.67 12.59 Favored 'Cis proline' 0 C--N 1.342 0.217 0 C-N-CA 122.697 -1.793 . . . . 74.329999999999998 112.303 0.073 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 60' ' ' VAL . . . . . 0.429 ' HB ' ' CG ' ' A' ' 88' ' ' ASN . 13.3 m -142.37 166.86 15.68 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.261 -0.427 . . . . 73.329999999999998 111.154 179.925 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 26.0 tt0 -102.88 -22.05 13.91 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.191 -0.459 . . . . 71.519999999999996 110.88 -179.952 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 62' ' ' SER . . . . . 0.461 ' CB ' HD22 ' A' ' 125' ' ' LEU . 2.5 m 40.77 92.31 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.205 -0.452 . . . . 73.349999999999994 110.821 -179.783 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 1.1 p -108.95 123.07 48.53 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.12 -0.491 . . . . 63.25 110.886 -179.863 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 64' ' ' ILE . . . . . . . . . . . . . 41.6 mt -136.98 137.4 46.94 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.115 -0.493 . . . . 70.010000000000005 111.155 179.958 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 16.3 m -101.24 115.69 31.09 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.206 -0.452 . . . . 75.129999999999995 111.17 179.951 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . 0.562 ' CD2' ' CE1' ' A' ' 83' ' ' PHE . 14.8 mt -95.93 109.24 21.64 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.202 -0.454 . . . . 64.299999999999997 110.909 179.989 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 67' ' ' HIS . . . . . 0.655 ' CE1' ' CD2' ' A' ' 33' ' ' LEU . 3.6 t60 -101.76 110.46 22.45 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.208 -0.451 . . . . 74.120000000000005 110.813 179.894 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 68' ' ' PHE . . . . . 0.494 ' CE1' HG21 ' A' ' 114' ' ' ILE . 0.0 OUTLIER -101.74 138.91 38.09 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.17 -0.468 . . . . 74.319999999999993 110.87 -179.938 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . 0.478 ' CB ' HG22 ' A' ' 47' ' ' ILE . . . -118.68 123.56 45.22 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.157 -0.474 . . . . 63.030000000000001 111.119 179.903 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 70' ' ' MET . . . . . 0.481 ' HE3' ' CD1' ' A' ' 114' ' ' ILE . 7.8 mmt -90.72 89.88 7.7 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.241 -0.436 . . . . 74.310000000000002 110.864 179.99 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -47.06 159.55 0.38 Allowed Pre-proline 0 C--N 1.33 -0.274 0 CA-C-O 121.589 0.709 . . . . 72.409999999999997 111.122 -179.957 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.76 2.15 3.79 Favored 'Trans proline' 0 C--N 1.342 0.201 0 C-N-CA 122.66 2.24 . . . . 75.310000000000002 112.348 179.926 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 73' ' ' MET . . . . . 0.555 ' HE1' ' CD2' ' A' ' 76' ' ' TYR . 0.0 OUTLIER -116.86 -25.82 7.14 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.245 -0.434 . . . . 74.230000000000004 110.873 179.886 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 74' ' ' TYR . . . . . 0.662 ' CD1' ' C ' ' A' ' 74' ' ' TYR . 0.0 OUTLIER -52.24 153.75 4.73 Favored Pre-proline 0 C--N 1.328 -0.364 0 CA-C-O 121.693 0.759 . . . . 75.340000000000003 110.898 -179.846 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 75' ' ' PRO . . . . . 0.567 ' HA ' ' CD2' ' A' ' 74' ' ' TYR . 53.6 Cg_endo -69.74 -11.11 11.77 Favored 'Cis proline' 0 C--N 1.341 0.182 0 C-N-CA 122.682 -1.799 . . . . 72.420000000000002 112.359 -0.114 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 76' ' ' TYR . . . . . 0.555 ' CD2' ' HE1' ' A' ' 73' ' ' MET . 10.2 t80 -33.91 -57.01 0.47 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.241 -0.436 . . . . 75.409999999999997 110.947 -179.947 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 30.4 p -97.72 -179.66 4.52 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.098 -0.501 . . . . 73.120000000000005 111.089 -179.955 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -94.88 129.25 36.45 Favored Pre-proline 0 C--N 1.329 -0.291 0 CA-C-O 121.623 0.725 . . . . 73.329999999999998 111.068 179.888 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 79' ' ' PRO . . . . . 0.449 ' HG3' ' CD1' ' A' ' 113' ' ' ILE . 53.4 Cg_endo -69.78 174.09 10.04 Favored 'Trans proline' 0 C--N 1.342 0.205 0 C-N-CA 122.666 2.244 . . . . 70.340000000000003 112.344 -179.988 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 3.1 tt0 -118.45 138.54 52.41 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.196 -0.456 . . . . 73.140000000000001 110.874 -179.975 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 81' ' ' ILE . . . . . 0.464 ' CG1' ' HA ' ' A' ' 68' ' ' PHE . 15.0 mt -144.56 148.93 17.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.131 -0.486 . . . . 75.109999999999999 111.118 179.983 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . 0.506 ' HG3' ' CD ' ' A' ' 84' ' ' LYS . 11.3 pt-20 -146.34 148.28 32.21 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.188 -0.46 . . . . 71.049999999999997 110.88 179.953 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 83' ' ' PHE . . . . . 0.562 ' CE1' ' CD2' ' A' ' 66' ' ' LEU . 49.6 m-85 -90.42 136.68 32.9 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.172 -0.467 . . . . 72.140000000000001 110.915 -179.975 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 84' ' ' LYS . . . . . 0.506 ' CD ' ' HG3' ' A' ' 82' ' ' GLU . 9.4 mmmt -125.82 169.95 12.1 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.12 -0.491 . . . . 74.030000000000001 110.893 -179.996 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . 0.477 ' C ' HG23 ' A' ' 86' ' ' VAL . 5.7 m-80 62.63 -73.03 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.251 -0.431 . . . . 72.420000000000002 110.903 179.981 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 86' ' ' VAL . . . . . 0.477 HG23 ' C ' ' A' ' 85' ' ' ASN . 30.5 m 31.86 91.34 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.226 -0.443 . . . . 75.439999999999998 111.132 179.919 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -96.18 -72.99 0.61 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.172 -0.467 . . . . 64.510000000000005 110.932 -179.98 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 88' ' ' ASN . . . . . 0.429 ' CG ' ' HB ' ' A' ' 60' ' ' VAL . 70.2 m-80 -76.95 54.12 0.99 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.158 -0.473 . . . . 64.340000000000003 110.927 -179.995 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 16.2 t -139.2 154.99 25.95 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.203 -0.453 . . . . 74.409999999999997 111.114 179.954 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 90' ' ' MET . . . . . . . . . . . . . 4.8 mtm -100.95 -69.59 0.77 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.177 -0.465 . . . . 75.310000000000002 110.866 179.938 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 4.3 p-10 173.62 -44.63 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.201 -0.454 . . . . 72.349999999999994 110.86 179.945 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -54.38 -38.69 66.43 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.222 -0.444 . . . . 74.200000000000003 110.857 -179.74 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 93' ' ' GLN . . . . . 0.596 ' OE1' ' CD2' ' A' ' 128' ' ' PHE . 0.0 OUTLIER -66.6 -42.69 86.52 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.169 -0.469 . . . . 54.329999999999998 110.91 -179.969 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . 0.469 HD21 ' CG1' ' A' ' 86' ' ' VAL . 84.1 mt -62.26 -48.29 80.58 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.158 -0.474 . . . . 74.299999999999997 110.927 -179.983 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -65.45 -34.27 77.88 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.205 -0.452 . . . . 75.420000000000002 110.92 179.88 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 96' ' ' MET . . . . . . . . . . . . . 26.8 ttp -59.99 -39.36 85.45 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.194 -0.457 . . . . 74.409999999999997 110.878 179.939 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 97' ' ' LEU . . . . . 0.552 ' O ' ' CD1' ' A' ' 101' ' ' PHE . 17.3 mt -66.85 -39.65 87.65 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.243 -0.435 . . . . 55.210000000000001 110.908 -179.98 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 5.2 mmtm -56.29 -38.0 70.63 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.198 -0.455 . . . . 73.420000000000002 110.876 179.853 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 1.7 m -69.58 -39.64 77.2 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.237 -0.438 . . . . 74.329999999999998 110.85 -179.885 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 68.4 mm-40 -69.22 -24.53 64.03 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.137 -0.483 . . . . 75.209999999999994 110.876 -179.912 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 101' ' ' PHE . . . . . 0.552 ' CD1' ' O ' ' A' ' 97' ' ' LEU . 6.9 m-30 -63.0 -32.39 73.74 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.155 -0.475 . . . . 75.109999999999999 110.886 -179.947 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 102' ' ' LYS . . . . . 0.42 ' HE2' ' C ' ' A' ' 102' ' ' LYS . 2.3 ttpt -70.5 -41.79 72.17 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.171 -0.468 . . . . 74.310000000000002 110.893 179.965 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 12.2 ttpt -66.87 -41.17 87.74 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.223 -0.444 . . . . 73.409999999999997 110.912 179.872 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 3.2 mt -64.84 -47.59 87.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.22 -0.445 . . . . 73.239999999999995 111.112 179.856 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 105' ' ' HIS . . . . . 0.429 ' O ' ' N ' ' A' ' 109' ' ' ARG . 10.1 t60 -62.91 -41.23 99.39 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.224 -0.444 . . . . 74.420000000000002 110.889 179.899 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -59.11 -42.59 90.9 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.217 -0.447 . . . . 65.219999999999999 110.904 -179.962 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 10.4 t -81.97 -27.14 33.38 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.184 -0.462 . . . . 75.420000000000002 111.152 -179.97 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 40.5 m -107.44 24.31 13.08 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.225 -0.443 . . . . 64.040000000000006 110.839 -179.869 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 109' ' ' ARG . . . . . 0.429 ' N ' ' O ' ' A' ' 105' ' ' HIS . 18.0 ttt180 -71.65 81.76 0.84 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.156 -0.475 . . . . 75.040000000000006 110.861 -179.924 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 155.51 -33.35 0.64 Allowed Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 120.774 -0.727 . . . . 33.030000000000001 112.54 -179.931 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 111' ' ' GLN . . . . . 0.403 ' HG3' ' N ' ' A' ' 112' ' ' GLU . 10.5 pt20 -112.09 -158.72 0.66 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.746 0.308 . . . . 72.519999999999996 110.92 -179.862 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 112' ' ' GLU . . . . . 0.403 ' N ' ' HG3' ' A' ' 111' ' ' GLN . 4.0 mt-10 -69.85 136.65 50.97 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.242 -0.435 . . . . 74.409999999999997 110.871 -179.943 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 113' ' ' ILE . . . . . 0.449 ' CD1' ' HG3' ' A' ' 79' ' ' PRO . 2.3 pt -123.95 -6.73 7.21 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.108 -0.496 . . . . 74.230000000000004 111.095 179.998 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 114' ' ' ILE . . . . . 0.495 ' H ' ' CD1' ' A' ' 114' ' ' ILE . 3.5 mp -68.22 -46.66 80.74 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-N 116.194 -0.457 . . . . 74.430000000000007 111.155 179.834 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 115' ' ' PHE . . . . . 0.499 ' CE1' HD13 ' A' ' 25' ' ' ILE . 11.4 t80 -65.19 -37.46 87.42 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.142 -0.481 . . . . 72.219999999999999 110.916 179.91 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 6.6 mm-40 -67.87 -45.24 75.11 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.106 -0.497 . . . . 74.430000000000007 110.897 -179.947 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 117' ' ' ILE . . . . . 0.506 HD12 ' CD2' ' A' ' 101' ' ' PHE . 0.4 OUTLIER -67.55 -40.92 85.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.157 -0.474 . . . . 73.340000000000003 111.085 -179.981 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 118' ' ' THR . . . . . 0.454 ' N ' ' CG2' ' A' ' 117' ' ' ILE . 81.3 p -68.79 -43.49 75.59 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.204 -0.453 . . . . 73.340000000000003 111.134 179.978 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 3.3 t -68.1 -44.42 76.24 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.262 -0.427 . . . . 74.010000000000005 110.836 -179.832 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 4.6 t80 -62.9 -45.2 93.63 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.146 -0.479 . . . . 75.420000000000002 110.887 -179.939 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 17.1 p -66.23 -45.32 81.06 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.099 -0.5 . . . . 74.329999999999998 111.138 -179.892 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 40.8 tt0 -65.26 -43.81 90.08 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.266 -0.425 . . . . 73.510000000000005 110.902 -179.99 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 11.1 pt-20 -70.61 -28.8 65.12 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.178 -0.465 . . . . 71.439999999999998 110.895 -179.945 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 124' ' ' LYS . . . . . 0.459 ' CE ' ' HA ' ' A' ' 124' ' ' LYS . 0.2 OUTLIER -78.99 -40.86 30.46 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.173 -0.467 . . . . 74.120000000000005 110.894 179.921 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 125' ' ' LEU . . . . . 0.461 HD22 ' CB ' ' A' ' 62' ' ' SER . 0.7 OUTLIER -69.98 -38.1 75.93 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.236 -0.438 . . . . 70.230000000000004 110.949 179.906 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -66.7 -46.31 75.97 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.185 -0.461 . . . . 73.439999999999998 110.837 179.866 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 127' ' ' GLU . . . . . 0.443 ' OE1' ' C ' ' A' ' 127' ' ' GLU . 1.6 pp20? -65.88 -28.19 68.77 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.185 -0.461 . . . . 72.420000000000002 110.873 -179.885 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 128' ' ' PHE . . . . . 0.596 ' CD2' ' OE1' ' A' ' 93' ' ' GLN . 0.2 OUTLIER -78.83 -62.57 1.65 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.144 -0.48 . . . . 74.510000000000005 110.9 -179.913 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 129' ' ' GLN . . . . . 0.44 ' C ' ' O ' ' A' ' 128' ' ' PHE . 1.0 OUTLIER -34.73 -47.24 0.33 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.15 -0.477 . . . . 61.030000000000001 110.912 -179.938 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 130' ' ' ASN . . . . . . . . . . . . . 8.9 t-20 -49.34 -64.89 0.67 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.246 -0.434 . . . . 74.25 110.873 -179.963 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 5.7 p -176.58 -45.25 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.207 -0.451 . . . . 75.319999999999993 111.105 179.889 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 132' ' ' VAL . . . . . 0.424 ' CG2' ' N ' ' A' ' 133' ' ' ASN . 12.1 p -173.5 164.44 0.25 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.197 -0.456 . . . . 73.209999999999994 111.12 179.946 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 133' ' ' ASN . . . . . 0.424 ' N ' ' CG2' ' A' ' 132' ' ' VAL . 3.3 m120 -43.42 104.95 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.181 -0.463 . . . . 73.349999999999994 110.889 -179.982 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 134' ' ' THR . . . . . . . . . . . . . 34.2 m -108.62 -60.36 1.75 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.149 -0.478 . . . . 64.319999999999993 111.146 -179.974 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -67.99 165.56 17.61 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.222 -0.445 . . . . 73.0 110.892 -179.984 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -159.19 80.8 0.76 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.193 -0.458 . . . . 64.129999999999995 110.867 -179.84 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 137' ' ' LEU . . . . . . . . . . . . . 3.0 tt 54.4 88.23 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.148 -0.478 . . . . 75.349999999999994 110.934 179.988 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 2.9 mt-10 . . . . . 0 C--N 1.33 -0.276 0 CA-C-N 116.143 -0.48 . . . . 74.519999999999996 110.876 179.962 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 3.3 tpp . . . . . 0 C--O 1.231 0.088 0 CA-C-O 120.807 0.337 . . . . 74.349999999999994 110.857 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -144.08 143.89 31.36 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.194 -0.457 . . . . 74.209999999999994 110.887 -179.814 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -104.97 38.97 1.8 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.16 -0.473 . . . . 64.5 110.894 -179.966 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 4' ' ' SER . . . . . 0.441 ' O ' ' C ' ' A' ' 5' ' ' HIS . 18.0 p -48.82 -80.43 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.184 -0.462 . . . . 73.239999999999995 110.877 -179.947 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 5' ' ' HIS . . . . . 0.441 ' C ' ' O ' ' A' ' 4' ' ' SER . 34.4 t60 35.11 88.64 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.147 -0.479 . . . . 73.030000000000001 110.821 179.976 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 5.2 tt 55.37 95.23 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.212 -0.449 . . . . 73.310000000000002 110.945 -179.976 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 5.5 t -161.84 172.19 16.52 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.214 -0.448 . . . . 74.5 111.141 179.98 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . 0.446 ' CD2' ' HE1' ' A' ' 73' ' ' MET . 60.4 mt -69.18 -21.67 63.96 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.198 -0.455 . . . . 75.230000000000004 110.903 179.992 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . 0.417 ' O ' ' HB2' ' A' ' 12' ' ' TYR . 16.3 t70 -50.51 -33.38 21.28 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.21 -0.45 . . . . 75.120000000000005 110.841 179.831 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . 0.4 ' O ' ' HG2' ' A' ' 13' ' ' GLU . 2.3 mm-40 -70.11 -40.76 74.69 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.19 -0.459 . . . . 74.409999999999997 110.914 -179.865 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 12.7 m-85 -50.99 -24.72 3.92 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.199 -0.455 . . . . 72.409999999999997 110.929 -179.872 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' TYR . . . . . 0.417 ' HB2' ' O ' ' A' ' 9' ' ' ASP . 0.1 OUTLIER -59.17 -36.23 74.94 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.127 -0.488 . . . . 74.340000000000003 110.919 -179.947 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . 0.487 ' HG3' ' N ' ' A' ' 14' ' ' ILE . 6.5 pt-20 -60.28 -42.87 96.36 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.12 -0.491 . . . . 63.140000000000001 110.901 -179.938 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . 0.487 ' N ' ' HG3' ' A' ' 13' ' ' GLU . 3.9 mp -68.46 -39.95 81.46 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.144 -0.48 . . . . 72.400000000000006 111.149 179.927 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . 0.457 ' HG2' ' CE1' ' A' ' 74' ' ' TYR . 79.8 mt-30 -63.63 -48.28 77.91 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.175 -0.466 . . . . 71.209999999999994 110.888 179.941 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -64.84 -39.18 93.15 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.211 -0.449 . . . . 70.219999999999999 110.95 -179.958 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -59.08 -33.82 71.26 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.183 -0.462 . . . . 75.109999999999999 110.902 -179.927 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 2.1 mm-40 -66.61 -41.01 89.04 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.152 -0.477 . . . . 74.329999999999998 110.892 179.972 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . 0.401 ' CD1' HG13 ' A' ' 46' ' ' ILE . 6.0 mt -59.96 -51.39 69.88 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.164 -0.471 . . . . 75.450000000000003 110.898 -179.941 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 5.0 pt-20 -68.34 -34.95 77.02 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.191 -0.459 . . . . 75.329999999999998 110.891 179.916 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -62.76 -50.6 70.41 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.157 -0.474 . . . . 74.340000000000003 111.099 179.923 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . 0.437 ' N ' HD13 ' A' ' 22' ' ' ILE . 0.6 OUTLIER -77.65 -34.27 20.03 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.155 -0.475 . . . . 64.109999999999999 111.151 179.991 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 1.6 mtt180 -52.25 -35.23 49.23 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.202 -0.454 . . . . 70.420000000000002 110.887 179.94 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -67.23 -29.14 68.71 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.167 -0.47 . . . . 71.530000000000001 110.857 -179.743 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . 0.509 ' CD1' ' CE1' ' A' ' 115' ' ' PHE . 4.5 mt -84.49 -45.21 17.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.092 -0.504 . . . . 63.240000000000002 111.163 179.896 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 16.1 m-85 -110.38 46.69 1.02 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.196 -0.456 . . . . 75.140000000000001 110.904 -179.975 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 5.1 mtm -43.95 -61.83 1.32 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.114 -0.494 . . . . 64.5 110.9 179.897 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -82.7 -19.28 38.36 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.235 -0.438 . . . . 64.219999999999999 110.894 179.924 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 45.2 m-20 -100.55 37.15 1.75 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.209 -0.45 . . . . 74.200000000000003 110.885 179.967 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 3.9 t80 -125.5 126.28 44.61 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.186 -0.461 . . . . 74.230000000000004 110.869 -179.898 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 52.7 m -118.1 133.27 56.06 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.167 -0.47 . . . . 74.129999999999995 111.116 -179.958 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 5.7 t0 -103.74 114.32 28.49 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.236 -0.438 . . . . 74.540000000000006 110.892 179.863 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . 0.512 ' CD1' ' C ' ' A' ' 33' ' ' LEU . 0.2 OUTLIER -103.34 -5.44 22.99 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.182 -0.463 . . . . 74.109999999999999 110.885 -179.91 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 34' ' ' THR . . . . . 0.46 ' N ' HD12 ' A' ' 33' ' ' LEU . 0.3 OUTLIER -36.37 121.49 0.71 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.198 -0.456 . . . . 72.349999999999994 111.143 179.933 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . 0.492 ' HB3' ' CH2' ' A' ' 40' ' ' TRP . 6.7 mttm -44.15 92.9 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.266 -0.424 . . . . 74.120000000000005 110.89 179.886 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . 0.455 ' N ' ' O ' ' A' ' 34' ' ' THR . 29.9 mmt180 -88.32 179.25 6.38 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.236 -0.438 . . . . 71.140000000000001 110.838 -179.999 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -49.95 124.33 9.78 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.164 -0.471 . . . . 74.420000000000002 110.921 179.952 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 38' ' ' SER . . . . . 0.47 ' HB3' ' CE3' ' A' ' 40' ' ' TRP . 0.2 OUTLIER 177.09 -168.62 0.06 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.227 -0.442 . . . . 73.439999999999998 110.905 -179.858 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 1.5 m -127.59 96.28 4.49 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.174 -0.467 . . . . 72.329999999999998 110.842 -179.847 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 40' ' ' TRP . . . . . 0.492 ' CH2' ' HB3' ' A' ' 35' ' ' LYS . 0.2 OUTLIER 179.84 -34.85 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.144 -0.48 . . . . 74.519999999999996 110.956 179.977 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER 178.28 146.66 0.15 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.217 -0.447 . . . . 73.349999999999994 110.852 179.918 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 3.3 mttt -141.72 72.01 1.37 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.176 -0.465 . . . . 73.219999999999999 110.935 179.969 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . 0.488 ' N ' ' CD ' ' A' ' 44' ' ' PRO . 5.7 mt-30 -149.0 51.25 0.93 Allowed Pre-proline 0 C--N 1.329 -0.298 0 CA-C-O 121.629 0.728 . . . . 73.299999999999997 110.891 179.981 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 44' ' ' PRO . . . . . 0.488 ' CD ' ' N ' ' A' ' 43' ' ' GLN . 53.6 Cg_endo -69.8 -164.51 0.13 Allowed 'Trans proline' 0 C--N 1.341 0.171 0 C-N-CA 122.713 2.275 . . . . 72.219999999999999 112.278 -179.99 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 45' ' ' GLN . . . . . 0.497 ' O ' ' CB ' ' A' ' 46' ' ' ILE . 18.0 pt20 -179.13 38.24 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.199 -0.455 . . . . 64.140000000000001 110.906 -179.973 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . 0.497 ' CB ' ' O ' ' A' ' 45' ' ' GLN . 0.0 OUTLIER 84.83 -24.46 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.236 -0.438 . . . . 74.310000000000002 111.089 179.946 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . 0.473 HG23 ' CG ' ' A' ' 45' ' ' GLN . 0.2 OUTLIER -32.7 143.66 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.181 -0.463 . . . . 75.540000000000006 111.154 179.864 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 11.8 p90 -156.92 174.43 15.52 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.216 -0.447 . . . . 72.219999999999999 110.873 179.958 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . 0.473 ' CG ' ' HB2' ' A' ' 67' ' ' HIS . 6.3 mt-10 -123.54 161.03 25.73 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.146 -0.479 . . . . 74.230000000000004 110.888 -179.908 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 13.6 mm -138.04 129.34 38.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.171 -0.468 . . . . 73.349999999999994 111.084 -179.988 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 89.3 m -84.01 121.91 28.04 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.142 -0.481 . . . . 72.129999999999995 111.141 179.932 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 27.4 mt -121.56 166.06 14.77 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.23 -0.441 . . . . 54.350000000000001 110.941 179.935 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 53' ' ' ARG . . . . . 0.41 ' C ' ' CD2' ' A' ' 125' ' ' LEU . 18.8 ptt180 -179.31 164.79 1.39 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.206 -0.452 . . . . 75.299999999999997 110.85 179.97 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 54' ' ' SER . . . . . 0.477 ' N ' HD23 ' A' ' 125' ' ' LEU . 1.7 m -60.65 167.8 2.52 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.164 -0.471 . . . . 63.219999999999999 110.867 -179.809 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 27.5 m -76.9 -24.72 15.42 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.119 -0.491 . . . . 75.129999999999995 111.155 179.93 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 3.2 t0 -120.5 -171.97 2.28 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.147 -0.479 . . . . 73.329999999999998 110.845 179.936 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 7.4 mmmt -116.11 -20.53 9.83 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.141 -0.481 . . . . 74.120000000000005 110.888 179.969 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . 0.548 ' HA ' ' C ' ' A' ' 59' ' ' PRO . 6.3 pt-20 -115.15 144.38 32.05 Favored Pre-proline 0 C--N 1.329 -0.298 0 CA-C-O 121.674 0.749 . . . . 73.430000000000007 110.831 179.959 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 59' ' ' PRO . . . . . 0.548 ' C ' ' HA ' ' A' ' 58' ' ' GLU . 53.5 Cg_endo -69.79 -13.88 12.5 Favored 'Cis proline' 0 C--N 1.342 0.192 0 C-N-CA 122.683 -1.799 . . . . 74.530000000000001 112.308 -0.017 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 60' ' ' VAL . . . . . 0.479 HG23 ' CG ' ' A' ' 129' ' ' GLN . 10.2 m -147.32 171.3 3.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-N 116.266 -0.424 . . . . 65.409999999999997 111.148 179.892 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . 0.462 ' O ' ' C ' ' A' ' 62' ' ' SER . 1.4 pt-20 -107.1 -18.41 13.9 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.165 -0.47 . . . . 72.420000000000002 110.914 179.967 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 62' ' ' SER . . . . . 0.462 ' C ' ' O ' ' A' ' 61' ' ' GLU . 71.1 m 32.72 90.55 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.143 -0.481 . . . . 74.299999999999997 110.915 -179.821 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 26.8 t -107.75 123.16 48.13 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.131 -0.486 . . . . 72.310000000000002 110.866 -179.802 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 64' ' ' ILE . . . . . . . . . . . . . 35.8 mt -134.77 135.39 53.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-N 116.125 -0.489 . . . . 74.540000000000006 111.161 179.921 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 53.1 m -104.98 114.58 28.88 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.171 -0.468 . . . . 74.010000000000005 111.078 -179.947 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . 0.55 HD21 ' CZ ' ' A' ' 83' ' ' PHE . 19.9 mt -91.46 109.8 21.09 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.234 -0.439 . . . . 75.5 110.913 179.929 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 67' ' ' HIS . . . . . 0.501 ' CE1' HD23 ' A' ' 33' ' ' LEU . 0.8 OUTLIER -90.25 109.48 20.57 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.18 -0.464 . . . . 74.219999999999999 110.855 179.844 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 68' ' ' PHE . . . . . 0.529 ' CE2' HG21 ' A' ' 117' ' ' ILE . 0.0 OUTLIER -104.33 139.54 39.17 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.219 -0.446 . . . . 74.439999999999998 110.872 -179.904 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . 0.466 ' CB ' HG22 ' A' ' 47' ' ' ILE . . . -121.84 129.33 52.52 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.149 -0.478 . . . . 72.450000000000003 111.085 179.942 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 70' ' ' MET . . . . . 0.474 ' HE1' ' CG1' ' A' ' 114' ' ' ILE . 1.0 OUTLIER -100.64 102.61 13.78 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.219 -0.446 . . . . 74.099999999999994 110.898 179.929 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -58.66 160.12 11.08 Favored Pre-proline 0 C--N 1.329 -0.283 0 CA-C-O 121.595 0.712 . . . . 74.340000000000003 111.137 -179.908 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.75 -2.2 9.76 Favored 'Trans proline' 0 C--N 1.341 0.162 0 C-N-CA 122.706 2.271 . . . . 73.430000000000007 112.333 179.992 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 73' ' ' MET . . . . . 0.486 ' HG2' ' CG2' ' A' ' 77' ' ' THR . 2.0 ttm -117.58 -18.28 9.77 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.232 -0.44 . . . . 71.540000000000006 110.889 179.886 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 74' ' ' TYR . . . . . 0.685 ' CD1' ' C ' ' A' ' 74' ' ' TYR . 0.0 OUTLIER -58.58 162.28 6.73 Favored Pre-proline 0 C--N 1.328 -0.354 0 CA-C-O 121.729 0.776 . . . . 71.129999999999995 110.875 -179.832 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 75' ' ' PRO . . . . . 0.592 ' HA ' ' CD2' ' A' ' 74' ' ' TYR . 53.3 Cg_endo -69.75 -4.83 8.52 Favored 'Cis proline' 0 C--N 1.341 0.156 0 C-N-CA 122.678 -1.801 . . . . 72.420000000000002 112.343 -0.087 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 76' ' ' TYR . . . . . 0.435 ' N ' ' HA ' ' A' ' 74' ' ' TYR . 0.3 OUTLIER -35.95 -60.49 0.54 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.199 -0.455 . . . . 74.430000000000007 110.877 -179.912 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 77' ' ' THR . . . . . 0.486 ' CG2' ' HG2' ' A' ' 73' ' ' MET . 33.6 p -88.08 -170.57 3.03 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.141 -0.481 . . . . 75.430000000000007 111.123 -179.973 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -105.01 123.1 40.93 Favored Pre-proline 0 C--N 1.33 -0.282 0 CA-C-O 121.593 0.711 . . . . 54.530000000000001 111.069 179.878 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 79' ' ' PRO . . . . . 0.456 ' HG3' ' CD1' ' A' ' 113' ' ' ILE . 53.8 Cg_endo -69.79 -165.46 0.16 Allowed 'Trans proline' 0 C--N 1.341 0.176 0 C-N-CA 122.696 2.264 . . . . 74.230000000000004 112.339 179.952 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . 0.449 ' HG3' ' N ' ' A' ' 81' ' ' ILE . 1.5 tt0 -128.0 141.7 51.44 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.19 -0.459 . . . . 73.150000000000006 110.846 -179.968 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 81' ' ' ILE . . . . . 0.449 ' N ' ' HG3' ' A' ' 80' ' ' GLU . 9.1 mm -138.41 138.09 43.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.113 -0.494 . . . . 74.310000000000002 111.109 179.969 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . 0.482 ' HG3' ' CD ' ' A' ' 84' ' ' LYS . 4.4 pt-20 -147.7 144.69 28.5 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.144 -0.48 . . . . 71.219999999999999 110.885 179.958 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 83' ' ' PHE . . . . . 0.55 ' CZ ' HD21 ' A' ' 66' ' ' LEU . 1.8 m-85 -95.16 139.82 30.95 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.156 -0.474 . . . . 72.409999999999997 110.922 -179.943 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 84' ' ' LYS . . . . . 0.482 ' CD ' ' HG3' ' A' ' 82' ' ' GLU . 10.6 mmmt -124.64 175.26 7.31 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.164 -0.471 . . . . 72.329999999999998 110.888 -179.998 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . 0.428 ' C ' HG23 ' A' ' 86' ' ' VAL . 3.9 m-80 61.63 -75.01 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.223 -0.444 . . . . 65.319999999999993 110.914 179.956 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 86' ' ' VAL . . . . . 0.472 ' N ' ' O ' ' A' ' 84' ' ' LYS . 4.2 m 37.4 87.04 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.178 -0.465 . . . . 73.409999999999997 111.141 179.878 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -98.74 -69.15 0.77 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.207 -0.452 . . . . 74.340000000000003 110.889 -179.98 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 88' ' ' ASN . . . . . 0.427 ' CG ' ' HB ' ' A' ' 60' ' ' VAL . 62.3 m-80 -83.28 42.24 0.81 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.248 -0.433 . . . . 62.240000000000002 110.889 -179.978 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 89' ' ' VAL . . . . . 0.455 ' CG1' ' HG ' ' A' ' 94' ' ' LEU . 38.7 t -134.48 146.75 30.51 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.191 -0.459 . . . . 75.349999999999994 111.143 179.923 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 90' ' ' MET . . . . . . . . . . . . . 16.5 mtm -96.51 -70.99 0.69 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.144 -0.48 . . . . 74.409999999999997 110.876 179.918 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER 171.29 -31.62 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.192 -0.458 . . . . 73.0 110.92 179.993 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -55.96 -46.66 78.53 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.157 -0.474 . . . . 74.049999999999997 110.879 -179.776 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 93' ' ' GLN . . . . . 0.601 ' OE1' ' CE2' ' A' ' 128' ' ' PHE . 3.4 pt20 -70.56 -40.75 73.16 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.155 -0.475 . . . . 74.540000000000006 110.935 179.991 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . 0.541 HD21 ' CD2' ' A' ' 83' ' ' PHE . 54.8 mt -57.81 -48.98 78.15 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.159 -0.473 . . . . 72.209999999999994 110.914 -179.963 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -65.86 -33.83 76.74 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.151 -0.477 . . . . 70.049999999999997 110.879 179.949 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 96' ' ' MET . . . . . 0.475 ' HG2' ' N ' ' A' ' 97' ' ' LEU . 0.0 OUTLIER -59.73 -36.49 76.68 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.213 -0.448 . . . . 75.230000000000004 110.867 179.98 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 97' ' ' LEU . . . . . 0.483 ' O ' ' CD1' ' A' ' 101' ' ' PHE . 17.0 mt -69.01 -41.68 77.42 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.194 -0.457 . . . . 73.140000000000001 110.925 -179.962 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -55.04 -36.65 65.76 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.159 -0.473 . . . . 73.439999999999998 110.895 179.864 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -67.46 -43.38 81.2 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.226 -0.443 . . . . 62.25 110.883 -179.948 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -71.92 -25.22 61.82 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.119 -0.491 . . . . 72.140000000000001 110.87 -179.953 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 101' ' ' PHE . . . . . 0.562 ' CD2' HD11 ' A' ' 117' ' ' ILE . 10.8 m-30 -59.51 -26.84 65.64 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.188 -0.46 . . . . 75.450000000000003 110.897 -179.944 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 102' ' ' LYS . . . . . 0.416 ' HE2' ' C ' ' A' ' 102' ' ' LYS . 0.2 OUTLIER -72.18 -41.72 66.69 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.141 -0.482 . . . . 74.129999999999995 110.875 179.967 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.39 -40.48 73.92 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.244 -0.434 . . . . 74.299999999999997 110.869 179.895 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 104' ' ' ILE . . . . . 0.575 HD12 ' CD2' ' A' ' 120' ' ' PHE . 4.0 mt -62.46 -47.11 94.55 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-N 116.245 -0.434 . . . . 74.120000000000005 111.093 179.881 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 105' ' ' HIS . . . . . 0.481 ' CE1' ' HG3' ' A' ' 109' ' ' ARG . 16.8 t60 -62.97 -41.0 99.4 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.184 -0.462 . . . . 75.430000000000007 110.865 179.91 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 1.1 t-20 -59.51 -38.25 80.46 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.205 -0.452 . . . . 74.109999999999999 110.927 -179.945 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 6.8 t -83.21 -27.95 29.62 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.155 -0.475 . . . . 75.430000000000007 111.096 179.995 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 1.6 m -112.89 46.7 1.18 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.278 -0.419 . . . . 73.230000000000004 110.85 -179.837 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 109' ' ' ARG . . . . . 0.481 ' HG3' ' CE1' ' A' ' 105' ' ' HIS . 2.7 ttp-105 -97.89 84.5 3.34 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.143 -0.481 . . . . 75.219999999999999 110.873 -179.976 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 110' ' ' GLY . . . . . 0.418 ' HA2' ' CG ' ' A' ' 75' ' ' PRO . . . 137.99 1.3 2.35 Favored Glycine 0 N--CA 1.452 -0.296 0 C-N-CA 120.768 -0.73 . . . . 71.530000000000001 112.488 -179.981 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 111' ' ' GLN . . . . . 0.505 ' O ' ' CG ' ' A' ' 112' ' ' GLU . 11.4 mm-40 -127.64 -75.11 0.57 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.732 0.301 . . . . 75.450000000000003 110.934 -179.923 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 112' ' ' GLU . . . . . 0.505 ' CG ' ' O ' ' A' ' 111' ' ' GLN . 31.0 mt-10 -163.6 141.74 7.68 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.223 -0.444 . . . . 74.430000000000007 110.875 -179.945 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 113' ' ' ILE . . . . . 0.456 ' CD1' ' HG3' ' A' ' 79' ' ' PRO . 21.7 pt -128.34 -10.93 3.4 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.118 -0.492 . . . . 72.430000000000007 111.16 179.963 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 114' ' ' ILE . . . . . 0.474 ' CG1' ' HE1' ' A' ' 70' ' ' MET . 25.5 mm -66.87 -44.72 88.75 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.148 -0.478 . . . . 71.430000000000007 111.149 179.846 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 115' ' ' PHE . . . . . 0.509 ' CE1' ' CD1' ' A' ' 25' ' ' ILE . 11.3 t80 -72.55 -37.04 68.37 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.141 -0.481 . . . . 74.329999999999998 110.873 179.976 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 6.7 mm-40 -67.39 -45.51 76.0 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.141 -0.481 . . . . 73.549999999999997 110.901 -179.924 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 117' ' ' ILE . . . . . 0.562 HD11 ' CD2' ' A' ' 101' ' ' PHE . 1.0 OUTLIER -66.91 -42.12 88.48 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.101 -0.499 . . . . 73.340000000000003 111.137 179.97 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 118' ' ' THR . . . . . 0.483 ' N ' ' CG2' ' A' ' 117' ' ' ILE . 79.8 p -68.21 -40.16 82.19 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.172 -0.467 . . . . 74.120000000000005 111.132 179.953 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 4.5 t -68.03 -44.03 77.39 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.226 -0.443 . . . . 71.230000000000004 110.857 -179.82 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 120' ' ' PHE . . . . . 0.575 ' CD2' HD12 ' A' ' 104' ' ' ILE . 0.3 OUTLIER -60.5 -46.23 90.9 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.111 -0.495 . . . . 71.310000000000002 110.868 -179.928 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 44.4 p -69.34 -39.09 78.37 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.183 -0.462 . . . . 73.25 111.132 -179.921 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 2.4 tt0 -67.24 -39.68 86.21 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.251 -0.431 . . . . 75.299999999999997 110.946 179.958 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 123' ' ' GLU . . . . . 0.489 ' HG3' ' N ' ' A' ' 124' ' ' LYS . 10.1 pt-20 -73.83 -40.47 63.31 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.167 -0.47 . . . . 71.420000000000002 110.889 -179.946 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 124' ' ' LYS . . . . . 0.489 ' N ' ' HG3' ' A' ' 123' ' ' GLU . 2.0 mmpt? -78.73 -19.52 52.14 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.174 -0.466 . . . . 65.030000000000001 110.894 179.949 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 125' ' ' LEU . . . . . 0.477 HD23 ' N ' ' A' ' 54' ' ' SER . 1.9 tp -69.49 -52.45 26.46 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.255 -0.429 . . . . 74.519999999999996 110.941 179.863 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 10.7 t70 -69.51 -36.86 76.84 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.199 -0.455 . . . . 74.409999999999997 110.826 179.854 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 127' ' ' GLU . . . . . 0.486 ' HG3' ' N ' ' A' ' 128' ' ' PHE . 0.4 OUTLIER -59.73 -36.22 76.14 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.221 -0.445 . . . . 71.200000000000003 110.858 -179.865 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 128' ' ' PHE . . . . . 0.601 ' CE2' ' OE1' ' A' ' 93' ' ' GLN . 0.0 OUTLIER -78.89 -42.26 27.69 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.15 -0.477 . . . . 72.019999999999996 110.894 -179.927 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 129' ' ' GLN . . . . . 0.479 ' CG ' HG23 ' A' ' 60' ' ' VAL . 1.3 tm0? -65.52 -29.52 70.17 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.165 -0.47 . . . . 70.409999999999997 110.908 -179.963 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 130' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -72.71 -35.36 67.58 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.176 -0.466 . . . . 74.25 110.887 -179.938 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 3.6 t -123.09 30.8 2.16 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.17 -0.468 . . . . 75.400000000000006 111.143 179.882 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 132' ' ' VAL . . . . . 0.47 ' N ' ' O ' ' A' ' 128' ' ' PHE . 3.6 p -59.55 131.41 24.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.187 -0.46 . . . . 74.340000000000003 111.123 179.9 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 133' ' ' ASN . . . . . . . . . . . . . 42.1 p-10 -103.46 43.15 1.1 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.156 -0.475 . . . . 73.019999999999996 110.904 179.96 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 134' ' ' THR . . . . . . . . . . . . . 11.1 m -155.9 103.93 2.27 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.146 -0.479 . . . . 72.530000000000001 111.151 -179.997 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 2.7 tt0 -89.83 98.93 12.05 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.254 -0.43 . . . . 64.5 110.926 179.979 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 29.1 p -167.64 179.8 4.68 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.177 -0.465 . . . . 62.520000000000003 110.87 -179.819 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 137' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -161.68 163.15 29.97 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.165 -0.47 . . . . 73.040000000000006 110.936 -179.991 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 1.1 pt-20 . . . . . 0 C--N 1.329 -0.299 0 CA-C-N 116.2 -0.455 . . . . 72.140000000000001 110.905 179.945 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 4.2 mmt . . . . . 0 C--O 1.231 0.089 0 CA-C-O 120.826 0.346 . . . . 74.120000000000005 110.86 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 25.0 p 52.87 -175.14 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.228 -0.442 . . . . 60.43 110.872 -179.801 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER 61.37 112.13 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.135 -0.484 . . . . 73.319999999999993 110.929 180.0 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 29.1 t -62.72 96.63 0.09 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.155 -0.475 . . . . 74.319999999999993 110.875 -179.931 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 1.6 t-80 -144.71 36.54 1.17 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.17 -0.468 . . . . 72.519999999999996 110.87 -179.993 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER 56.17 108.5 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.229 -0.441 . . . . 73.400000000000006 110.899 -179.938 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 5.9 t -166.6 172.28 10.85 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.192 -0.458 . . . . 73.329999999999998 111.131 179.894 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 20.5 mt -64.72 -24.88 67.71 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.18 -0.464 . . . . 74.109999999999999 110.91 179.977 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 9.3 t0 -55.13 -34.97 64.2 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.202 -0.454 . . . . 74.299999999999997 110.862 179.856 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 94.2 mm-40 -63.59 -35.78 81.63 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.223 -0.444 . . . . 73.040000000000006 110.859 -179.891 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 21.6 m-85 -65.77 -24.97 67.05 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.236 -0.438 . . . . 74.439999999999998 110.897 -179.853 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -58.93 -41.05 86.43 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.167 -0.47 . . . . 75.010000000000005 110.893 -179.898 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 2.0 mm-40 -59.65 -45.94 90.51 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.142 -0.481 . . . . 72.400000000000006 110.904 -179.964 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 4.2 mp -68.03 -41.08 84.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.138 -0.483 . . . . 70.329999999999998 111.145 179.955 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 57.1 mt-30 -62.79 -48.06 80.77 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.192 -0.458 . . . . 72.340000000000003 110.944 179.922 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -61.84 -45.1 95.28 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.152 -0.477 . . . . 65.099999999999994 110.887 -179.981 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -57.84 -33.82 69.05 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.215 -0.448 . . . . 73.439999999999998 110.883 -179.907 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 2.9 mt-10 -64.03 -38.62 91.72 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.197 -0.456 . . . . 72.230000000000004 110.887 -179.96 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . 0.567 HD13 ' CE1' ' A' ' 48' ' ' PHE . 7.8 mp -66.06 -51.52 57.4 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.116 -0.493 . . . . 75.430000000000007 110.95 179.986 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 1.5 pt-20 -68.91 -33.77 74.3 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.145 -0.479 . . . . 70.109999999999999 110.869 179.948 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -65.98 -50.04 65.71 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.21 -0.45 . . . . 73.230000000000004 111.122 179.896 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . 0.463 ' N ' HD13 ' A' ' 22' ' ' ILE . 0.7 OUTLIER -72.19 -34.16 48.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.22 -0.446 . . . . 74.209999999999994 111.166 179.975 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . 0.428 ' NH2' ' NH2' ' A' ' 36' ' ' ARG . 0.0 OUTLIER -52.39 -36.19 53.46 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.164 -0.471 . . . . 73.299999999999997 110.899 179.931 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -67.27 -30.23 70.06 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.165 -0.47 . . . . 52.340000000000003 110.799 -179.777 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . 0.544 ' CD1' ' CE1' ' A' ' 115' ' ' PHE . 4.3 mt -83.31 -45.21 18.8 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.141 -0.481 . . . . 65.239999999999995 111.112 179.976 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 26' ' ' TYR . . . . . 0.466 ' CD2' HG22 ' A' ' 50' ' ' ILE . 25.7 m-85 -108.5 42.25 1.43 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.168 -0.469 . . . . 65.230000000000004 110.923 -179.96 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER -40.12 -59.07 1.32 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.128 -0.487 . . . . 75.450000000000003 110.887 179.884 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -86.14 -20.89 27.97 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.25 -0.432 . . . . 73.409999999999997 110.834 179.99 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 42.4 m-20 -96.29 34.79 1.54 Allowed 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.204 -0.453 . . . . 72.349999999999994 110.864 -179.996 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 16.1 t80 -118.67 138.48 52.59 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.215 -0.448 . . . . 74.439999999999998 110.899 -179.928 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 94.7 m -117.66 134.11 55.24 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.145 -0.48 . . . . 74.140000000000001 111.116 -179.894 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -101.23 118.51 37.13 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.249 -0.432 . . . . 74.219999999999999 110.901 179.923 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . 0.502 ' CD2' ' O ' ' A' ' 47' ' ' ILE . 0.4 OUTLIER -125.69 -5.68 6.95 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.235 -0.438 . . . . 75.219999999999999 110.916 -179.94 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -59.72 -158.72 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.171 -0.468 . . . . 73.030000000000001 111.141 179.914 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . 0.476 ' N ' ' HG3' ' A' ' 44' ' ' PRO . 0.4 OUTLIER -106.88 23.14 14.84 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.183 -0.462 . . . . 71.409999999999997 110.905 179.912 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . 0.428 ' NH2' ' NH2' ' A' ' 23' ' ' ARG . 0.0 OUTLIER -39.07 -71.08 0.09 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.205 -0.452 . . . . 72.310000000000002 110.898 179.99 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . 0.467 ' O ' ' CB ' ' A' ' 38' ' ' SER . 0.0 OUTLIER -175.45 125.81 0.24 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.187 -0.46 . . . . 64.150000000000006 110.847 179.96 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 38' ' ' SER . . . . . 0.467 ' CB ' ' O ' ' A' ' 37' ' ' LYS . 1.0 OUTLIER 162.51 -69.94 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.254 -0.43 . . . . 72.340000000000003 110.823 -179.945 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 70.9 m -79.61 -171.41 2.79 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.163 -0.471 . . . . 74.319999999999993 110.867 -179.823 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 40' ' ' TRP . . . . . . . . . . . . . 75.7 t-105 -104.2 -35.59 7.96 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.14 -0.482 . . . . 75.349999999999994 110.91 179.984 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 33.2 t70 -136.63 138.44 41.16 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.272 -0.422 . . . . 63.420000000000002 110.879 179.946 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . 0.53 ' CB ' ' HD3' ' A' ' 44' ' ' PRO . 0.1 OUTLIER -145.22 -53.01 0.28 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.204 -0.453 . . . . 75.120000000000005 110.886 -179.975 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . 0.57 ' N ' ' CD ' ' A' ' 44' ' ' PRO . 12.3 mm100 56.73 46.54 2.24 Favored Pre-proline 0 C--N 1.329 -0.311 0 CA-C-O 121.619 0.723 . . . . 75.209999999999994 110.902 179.966 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 44' ' ' PRO . . . . . 0.57 ' CD ' ' N ' ' A' ' 43' ' ' GLN . 53.7 Cg_endo -69.79 -161.55 0.08 OUTLIER 'Trans proline' 0 C--N 1.341 0.164 0 C-N-CA 122.702 2.268 . . . . 75.319999999999993 112.307 -179.972 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 45' ' ' GLN . . . . . 0.486 ' O ' ' CB ' ' A' ' 46' ' ' ILE . 26.3 pt20 -159.31 36.05 0.2 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.216 -0.447 . . . . 70.200000000000003 110.905 -179.975 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . 0.486 ' CB ' ' O ' ' A' ' 45' ' ' GLN . 0.1 OUTLIER 84.72 -1.27 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 116.235 -0.439 . . . . 74.430000000000007 111.144 179.963 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . 0.502 ' O ' ' CD2' ' A' ' 33' ' ' LEU . 0.3 OUTLIER -62.61 146.83 12.27 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.167 -0.47 . . . . 73.209999999999994 111.137 179.846 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 48' ' ' PHE . . . . . 0.567 ' CE1' HD13 ' A' ' 19' ' ' LEU . 3.6 p90 -151.05 153.8 35.78 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.174 -0.466 . . . . 72.25 110.876 179.943 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 10.7 mt-10 -108.52 143.85 36.98 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.117 -0.492 . . . . 73.140000000000001 110.864 -179.88 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . 0.466 HG22 ' CD2' ' A' ' 26' ' ' TYR . 30.8 mm -125.94 131.74 71.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.176 -0.466 . . . . 73.200000000000003 111.155 179.95 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 85.2 m -85.1 125.6 32.91 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.187 -0.46 . . . . 73.030000000000001 111.137 179.975 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . 0.457 HD11 ' CD1' ' A' ' 66' ' ' LEU . 19.9 mt -122.52 164.89 17.29 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.184 -0.462 . . . . 74.319999999999993 110.889 179.988 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER 179.11 172.87 0.81 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.205 -0.452 . . . . 74.230000000000004 110.861 179.954 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -62.91 170.96 2.38 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.2 -0.454 . . . . 70.409999999999997 110.843 -179.799 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 21.8 m -84.85 -24.2 7.21 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 116.14 -0.482 . . . . 72.109999999999999 111.143 179.964 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -117.83 -172.72 2.3 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.176 -0.466 . . . . 62.409999999999997 110.868 179.92 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -115.19 -12.58 11.85 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.222 -0.444 . . . . 74.340000000000003 110.914 -179.972 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . 0.533 ' HA ' ' C ' ' A' ' 59' ' ' PRO . 6.3 pm0 -126.79 149.45 68.67 Favored Pre-proline 0 C--N 1.33 -0.257 0 CA-C-O 121.674 0.75 . . . . 61.340000000000003 110.879 179.929 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 59' ' ' PRO . . . . . 0.533 ' C ' ' HA ' ' A' ' 58' ' ' GLU . 53.3 Cg_endo -69.8 -8.83 10.78 Favored 'Cis proline' 0 C--N 1.342 0.219 0 C-N-CA 122.674 -1.802 . . . . 72.230000000000004 112.303 0.076 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 60' ' ' VAL . . . . . 0.472 HG22 ' CG ' ' A' ' 129' ' ' GLN . 22.3 m -142.51 165.26 16.8 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.197 -0.456 . . . . 74.340000000000003 111.093 179.923 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . 0.405 ' O ' ' O ' ' A' ' 62' ' ' SER . 7.5 tt0 -93.58 -25.05 17.71 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.143 -0.481 . . . . 75.010000000000005 110.848 -179.918 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 62' ' ' SER . . . . . 0.405 ' O ' ' O ' ' A' ' 61' ' ' GLU . 0.5 OUTLIER 41.63 94.15 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.185 -0.461 . . . . 75.040000000000006 110.836 -179.79 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 9.2 p -116.57 122.74 45.52 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.145 -0.48 . . . . 72.540000000000006 110.874 -179.854 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 64' ' ' ILE . . . . . . . . . . . . . 21.1 mt -137.89 138.61 43.79 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.132 -0.485 . . . . 75.209999999999994 111.097 179.992 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 20.1 m -104.49 113.87 27.72 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.2 -0.455 . . . . 72.319999999999993 111.126 179.939 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . 0.564 HD23 ' CE1' ' A' ' 83' ' ' PHE . 6.5 mt -99.17 112.19 24.39 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.174 -0.466 . . . . 73.329999999999998 110.927 179.964 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -109.6 114.32 27.84 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.217 -0.447 . . . . 75.310000000000002 110.826 179.897 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 68' ' ' PHE . . . . . 0.569 ' CD1' HG22 ' A' ' 114' ' ' ILE . 0.0 OUTLIER -103.31 140.43 37.42 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.213 -0.448 . . . . 63.020000000000003 110.865 -179.928 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -117.28 131.33 56.84 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.128 -0.487 . . . . 74.25 111.114 179.944 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 70' ' ' MET . . . . . 0.503 ' SD ' ' CZ ' ' A' ' 74' ' ' TYR . 3.1 mmt -93.49 98.82 11.44 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.224 -0.443 . . . . 73.010000000000005 110.858 179.998 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -55.49 163.49 1.84 Allowed Pre-proline 0 C--N 1.33 -0.262 0 CA-C-O 121.57 0.7 . . . . 74.450000000000003 111.125 -179.923 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.77 3.14 2.95 Favored 'Trans proline' 0 C--N 1.341 0.168 0 C-N-CA 122.668 2.245 . . . . 61.340000000000003 112.348 179.935 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 73' ' ' MET . . . . . 0.507 ' O ' ' CB ' ' A' ' 76' ' ' TYR . 0.1 OUTLIER -126.31 -22.99 3.91 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.21 -0.45 . . . . 55.399999999999999 110.868 179.927 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 74' ' ' TYR . . . . . 0.643 ' CD1' ' C ' ' A' ' 74' ' ' TYR . 0.0 OUTLIER -49.56 150.04 3.77 Favored Pre-proline 0 C--N 1.329 -0.32 0 CA-C-O 121.67 0.748 . . . . 64.25 110.959 -179.872 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 75' ' ' PRO . . . . . 0.566 ' HA ' ' CD2' ' A' ' 74' ' ' TYR . 53.8 Cg_endo -69.74 -14.06 12.42 Favored 'Cis proline' 0 C--O 1.231 0.157 0 C-N-CA 122.706 -1.789 . . . . 75.310000000000002 112.32 -0.006 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 76' ' ' TYR . . . . . 0.507 ' CB ' ' O ' ' A' ' 73' ' ' MET . 9.0 t80 -33.6 -45.75 0.18 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.239 -0.437 . . . . 75.109999999999999 110.949 -179.855 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 45.6 p -108.79 164.86 12.01 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.147 -0.479 . . . . 74.239999999999995 111.165 -179.997 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -79.84 125.96 81.07 Favored Pre-proline 0 C--N 1.329 -0.292 0 CA-C-O 121.579 0.704 . . . . 51.329999999999998 111.119 179.839 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.74 176.43 6.76 Favored 'Trans proline' 0 C--N 1.341 0.147 0 C-N-CA 122.673 2.248 . . . . 72.329999999999998 112.343 -179.961 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -119.04 135.13 54.79 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.248 -0.433 . . . . 75.120000000000005 110.877 -179.983 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 81' ' ' ILE . . . . . 0.474 ' CG1' ' HA ' ' A' ' 68' ' ' PHE . 13.7 mt -143.27 151.29 17.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.156 -0.475 . . . . 74.430000000000007 111.135 179.949 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . 0.487 ' HG3' ' CD ' ' A' ' 84' ' ' LYS . 11.2 pt-20 -148.99 147.94 29.17 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.144 -0.48 . . . . 74.439999999999998 110.868 179.996 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 83' ' ' PHE . . . . . 0.564 ' CE1' HD23 ' A' ' 66' ' ' LEU . 64.6 m-85 -90.63 140.27 29.92 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.16 -0.473 . . . . 74.120000000000005 110.897 -179.937 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 84' ' ' LYS . . . . . 0.487 ' CD ' ' HG3' ' A' ' 82' ' ' GLU . 8.0 mmmt -126.4 165.58 18.78 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.201 -0.454 . . . . 74.120000000000005 110.877 179.964 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . 0.479 ' C ' HG22 ' A' ' 86' ' ' VAL . 4.1 m-80 63.55 -71.82 0.06 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.235 -0.439 . . . . 73.099999999999994 110.893 179.97 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 86' ' ' VAL . . . . . 0.479 HG22 ' C ' ' A' ' 85' ' ' ASN . 28.0 m 30.81 91.21 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.156 -0.475 . . . . 73.219999999999999 111.106 179.924 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -94.28 -85.25 0.3 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.117 -0.492 . . . . 64.239999999999995 110.881 -179.988 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 88' ' ' ASN . . . . . 0.421 ' CG ' HG21 ' A' ' 60' ' ' VAL . 1.0 OUTLIER -45.52 -38.14 6.04 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.207 -0.451 . . . . 74.230000000000004 110.923 -179.933 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 3.4 t -61.91 142.92 15.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.134 -0.485 . . . . 74.230000000000004 111.103 179.905 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 90' ' ' MET . . . . . . . . . . . . . 7.2 mtm -95.15 -56.46 2.72 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.134 -0.485 . . . . 74.530000000000001 110.899 179.91 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER 170.21 -41.87 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.197 -0.456 . . . . 71.230000000000004 110.9 179.98 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -54.27 -38.66 66.09 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.188 -0.46 . . . . 55.329999999999998 110.87 -179.781 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 93' ' ' GLN . . . . . 0.646 ' CD ' ' CD1' ' A' ' 128' ' ' PHE . 0.0 OUTLIER -68.25 -43.22 78.36 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.151 -0.477 . . . . 71.010000000000005 110.906 -179.977 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . 0.449 HD21 ' CG1' ' A' ' 86' ' ' VAL . 62.8 mt -60.52 -48.34 82.21 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.228 -0.442 . . . . 74.439999999999998 110.912 -179.957 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -63.38 -34.14 77.07 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.163 -0.471 . . . . 74.319999999999993 110.934 179.934 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 96' ' ' MET . . . . . . . . . . . . . 35.3 ttp -60.65 -40.36 91.72 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.175 -0.466 . . . . 73.549999999999997 110.832 179.982 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 97' ' ' LEU . . . . . 0.509 ' O ' ' CD1' ' A' ' 101' ' ' PHE . 81.2 mt -65.91 -39.88 90.98 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.247 -0.433 . . . . 73.010000000000005 110.896 -179.997 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 11.3 mmtm -54.69 -47.19 73.98 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.213 -0.449 . . . . 73.030000000000001 110.892 179.831 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 15.7 m -60.3 -36.75 78.59 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.235 -0.438 . . . . 60.240000000000002 110.87 -179.888 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 78.2 mm-40 -71.13 -30.21 66.21 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.16 -0.473 . . . . 71.219999999999999 110.885 -179.951 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 101' ' ' PHE . . . . . 0.554 ' CD2' HD12 ' A' ' 117' ' ' ILE . 9.0 m-30 -59.33 -37.52 78.01 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.173 -0.467 . . . . 73.319999999999993 110.877 -179.98 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -64.8 -40.36 95.09 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.201 -0.454 . . . . 74.099999999999994 110.93 179.986 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 25.8 ttpp -70.16 -43.39 70.94 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.197 -0.456 . . . . 75.549999999999997 110.88 179.859 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 104' ' ' ILE . . . . . 0.408 ' O ' ' N ' ' A' ' 108' ' ' SER . 4.5 mt -62.14 -47.53 92.68 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 116.232 -0.44 . . . . 73.510000000000005 111.128 179.903 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 105' ' ' HIS . . . . . . . . . . . . . 3.2 t60 -62.98 -43.47 98.71 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.187 -0.46 . . . . 73.209999999999994 110.839 179.889 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -57.38 -40.26 77.79 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.229 -0.441 . . . . 72.340000000000003 110.92 -179.997 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 14.3 t -89.14 -21.22 23.45 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.167 -0.469 . . . . 64.5 111.146 -179.968 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 108' ' ' SER . . . . . 0.408 ' N ' ' O ' ' A' ' 104' ' ' ILE . 60.0 m -109.54 31.16 6.0 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.229 -0.441 . . . . 71.540000000000006 110.838 -179.846 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 6.6 ttp180 -79.5 88.1 5.08 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.14 -0.482 . . . . 75.109999999999999 110.855 -179.92 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 113.31 44.82 0.77 Allowed Glycine 0 N--CA 1.451 -0.339 0 C-N-CA 120.747 -0.74 . . . . 50.030000000000001 112.473 -179.981 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 111' ' ' GLN . . . . . . . . . . . . . 21.5 pt20 -174.77 28.31 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.775 0.321 . . . . 74.420000000000002 110.924 -179.886 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER 70.97 140.45 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.198 -0.455 . . . . 75.030000000000001 110.935 -179.901 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 113' ' ' ILE . . . . . . . . . . . . . 34.1 pt -134.78 0.1 1.15 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.167 -0.469 . . . . 73.140000000000001 111.158 179.987 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 114' ' ' ILE . . . . . 0.569 HG22 ' CD1' ' A' ' 68' ' ' PHE . 18.8 mm -63.29 -45.88 97.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.148 -0.478 . . . . 74.219999999999999 111.158 179.872 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 115' ' ' PHE . . . . . 0.544 ' CE1' ' CD1' ' A' ' 25' ' ' ILE . 22.2 t80 -72.66 -32.03 65.53 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.114 -0.494 . . . . 75.430000000000007 110.835 179.964 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 20.5 mm-40 -67.91 -45.97 72.9 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.187 -0.46 . . . . 74.030000000000001 110.915 -179.967 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 117' ' ' ILE . . . . . 0.554 HD12 ' CD2' ' A' ' 101' ' ' PHE . 0.9 OUTLIER -66.39 -43.7 91.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.194 -0.457 . . . . 71.209999999999994 111.105 179.989 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 118' ' ' THR . . . . . 0.519 ' N ' ' CG2' ' A' ' 117' ' ' ILE . 43.9 p -67.95 -41.78 81.95 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.145 -0.48 . . . . 75.239999999999995 111.122 179.979 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 43.2 t -68.06 -43.18 79.24 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.242 -0.435 . . . . 73.049999999999997 110.833 -179.839 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 3.7 t80 -67.83 -48.63 65.66 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.179 -0.464 . . . . 64.010000000000005 110.894 -179.965 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 29.0 p -61.88 -39.56 92.38 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.18 -0.464 . . . . 71.219999999999999 111.128 -179.919 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 7.7 tm0? -66.68 -50.81 61.67 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.216 -0.447 . . . . 74.109999999999999 110.883 -179.968 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 123' ' ' GLU . . . . . 0.404 ' O ' ' CG ' ' A' ' 127' ' ' GLU . 5.5 pt-20 -63.01 -38.17 90.12 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.221 -0.445 . . . . 72.230000000000004 110.88 -179.96 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 124' ' ' LYS . . . . . 0.431 ' CE ' ' HA ' ' A' ' 124' ' ' LYS . 0.0 OUTLIER -75.82 -35.08 60.13 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.182 -0.463 . . . . 64.439999999999998 110.895 179.996 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 125' ' ' LEU . . . . . 0.504 ' C ' ' CD2' ' A' ' 125' ' ' LEU . 4.2 tt -70.57 -50.85 33.02 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.201 -0.454 . . . . 74.530000000000001 110.927 179.88 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 126' ' ' ASP . . . . . 0.411 ' CG ' ' N ' ' A' ' 127' ' ' GLU . 0.0 OUTLIER -57.56 -46.58 83.78 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.147 -0.478 . . . . 75.109999999999999 110.827 179.888 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 127' ' ' GLU . . . . . 0.457 ' HB2' ' N ' ' A' ' 133' ' ' ASN . 0.9 OUTLIER -65.08 -28.15 69.26 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.221 -0.445 . . . . 74.409999999999997 110.872 -179.896 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 128' ' ' PHE . . . . . 0.646 ' CD1' ' CD ' ' A' ' 93' ' ' GLN . 0.2 OUTLIER -73.5 -46.78 45.92 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.155 -0.475 . . . . 75.409999999999997 110.878 -179.908 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 129' ' ' GLN . . . . . 0.472 ' CG ' HG22 ' A' ' 60' ' ' VAL . 1.5 tm0? -60.17 -39.25 85.8 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.183 -0.462 . . . . 74.140000000000001 110.95 -179.956 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 130' ' ' ASN . . . . . 0.428 ' O ' ' CG1' ' A' ' 131' ' ' VAL . 2.3 m-20 -71.25 -79.73 0.06 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.186 -0.461 . . . . 65.430000000000007 110.916 -179.978 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 131' ' ' VAL . . . . . 0.428 ' CG1' ' O ' ' A' ' 130' ' ' ASN . 0.0 OUTLIER -173.82 -48.65 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.176 -0.465 . . . . 73.439999999999998 111.151 179.948 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 132' ' ' VAL . . . . . . . . . . . . . 91.8 t -157.29 129.22 0.99 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.206 -0.452 . . . . 73.439999999999998 111.174 179.895 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 133' ' ' ASN . . . . . 0.457 ' N ' ' HB2' ' A' ' 127' ' ' GLU . 14.9 m-20 50.31 -179.57 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.17 -0.468 . . . . 72.530000000000001 110.855 -179.98 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 134' ' ' THR . . . . . . . . . . . . . 60.4 p -76.21 -179.19 4.89 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.134 -0.484 . . . . 74.129999999999995 111.131 -179.952 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 4.6 tp-100 -158.6 -39.41 0.06 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.211 -0.45 . . . . 73.129999999999995 110.91 -179.997 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 18.1 t -99.54 -42.03 7.1 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.217 -0.447 . . . . 74.519999999999996 110.863 -179.807 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 137' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER 71.54 -69.37 0.19 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.124 -0.489 . . . . 75.010000000000005 110.924 179.978 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--N 1.329 -0.286 0 CA-C-N 116.204 -0.453 . . . . 74.129999999999995 110.876 179.951 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.232 0.136 0 CA-C-O 120.754 0.311 . . . . 75.450000000000003 110.919 . . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 173.54 108.36 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.265 -0.425 . . . . 70.200000000000003 110.884 -179.771 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 1.2 pt? -90.16 177.82 6.33 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.145 -0.48 . . . . 75.25 110.959 179.958 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 13.3 p -102.16 92.62 4.83 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.188 -0.46 . . . . 43.450000000000003 110.879 -179.896 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 17.0 t-80 -161.2 172.94 15.83 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.121 -0.49 . . . . 74.319999999999993 110.863 -179.966 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -99.37 44.37 1.03 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.223 -0.444 . . . . 75.030000000000001 110.913 -179.962 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 7' ' ' THR . . . . . 0.449 ' CG2' ' HB2' ' A' ' 9' ' ' ASP . 14.2 t -95.07 -167.62 1.66 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.184 -0.462 . . . . 74.310000000000002 111.109 179.979 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 29.0 mt -69.07 -24.64 64.18 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.188 -0.46 . . . . 74.439999999999998 110.925 179.913 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . 0.449 ' HB2' ' CG2' ' A' ' 7' ' ' THR . 0.3 OUTLIER -55.2 -30.18 59.42 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.201 -0.454 . . . . 73.099999999999994 110.835 179.867 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 77.5 mm-40 -67.2 -35.75 80.28 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.232 -0.44 . . . . 74.519999999999996 110.916 -179.852 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 11' ' ' TYR . . . . . 0.473 ' CD1' ' HD2' ' A' ' 75' ' ' PRO . 26.9 m-85 -66.6 -28.1 68.24 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.158 -0.474 . . . . 72.340000000000003 110.875 -179.876 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -59.3 -39.24 82.39 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.131 -0.486 . . . . 73.299999999999997 110.923 -179.865 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -59.04 -44.25 91.76 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.163 -0.471 . . . . 63.140000000000001 110.894 179.976 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . 0.419 ' O ' ' CD ' ' A' ' 18' ' ' GLU . 3.8 mp -66.94 -48.01 80.77 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.156 -0.475 . . . . 73.430000000000007 111.108 179.976 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 57.6 mt-30 -57.85 -46.55 84.63 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.231 -0.44 . . . . 73.109999999999999 110.927 179.934 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 6.7 t -58.6 -44.93 90.03 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.226 -0.443 . . . . 74.540000000000006 110.91 -179.964 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 1.1 t30 -59.03 -33.88 71.27 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.152 -0.476 . . . . 74.409999999999997 110.918 -179.912 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . 0.419 ' CD ' ' O ' ' A' ' 14' ' ' ILE . 2.2 mp0 -64.35 -39.09 93.2 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.174 -0.466 . . . . 73.400000000000006 110.91 179.961 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . 0.538 HD23 ' CE1' ' A' ' 48' ' ' PHE . 5.7 mt -63.56 -51.27 66.12 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.165 -0.471 . . . . 71.329999999999998 110.92 -179.971 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 6.6 pt-20 -68.59 -35.02 76.78 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.163 -0.471 . . . . 73.5 110.894 179.914 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -62.7 -50.67 70.2 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.161 -0.472 . . . . 73.349999999999994 111.072 179.962 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . 0.473 HD11 ' N ' ' A' ' 22' ' ' ILE . 0.6 OUTLIER -74.72 -34.98 35.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.234 -0.439 . . . . 74.239999999999995 111.163 179.96 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 16.4 mtt180 -52.6 -35.78 54.95 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.151 -0.477 . . . . 74.420000000000002 110.846 179.95 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -67.51 -31.2 71.16 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.212 -0.449 . . . . 60.240000000000002 110.88 -179.798 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 4.8 mt -80.32 -45.22 22.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.114 -0.494 . . . . 71.549999999999997 111.102 -179.997 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 17.5 m-85 -109.84 44.02 1.26 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.17 -0.468 . . . . 74.230000000000004 110.925 -179.975 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 1.3 mtm -43.49 -40.81 4.04 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.124 -0.489 . . . . 73.409999999999997 110.843 179.929 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -104.72 -20.12 13.72 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.275 -0.42 . . . . 61.43 110.863 179.963 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 3.6 m-20 -95.17 22.9 6.21 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.238 -0.437 . . . . 75.129999999999995 110.852 179.996 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 30' ' ' PHE . . . . . 0.577 ' C ' ' CD1' ' A' ' 30' ' ' PHE . 0.1 OUTLIER -114.52 143.78 44.42 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.231 -0.441 . . . . 74.239999999999995 110.866 -179.912 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 23.7 m -123.99 130.94 53.4 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.11 -0.495 . . . . 73.5 111.147 -179.936 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 1.2 t70 -94.05 114.3 26.43 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.202 -0.454 . . . . 74.530000000000001 110.849 179.926 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . 0.487 ' CD2' ' N ' ' A' ' 34' ' ' THR . 0.2 OUTLIER -117.89 -17.36 9.79 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.229 -0.441 . . . . 75.209999999999994 110.934 -179.967 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 34' ' ' THR . . . . . 0.487 ' N ' ' CD2' ' A' ' 33' ' ' LEU . 4.7 m -50.22 137.27 18.32 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.181 -0.463 . . . . 65.239999999999995 111.123 179.952 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 11.6 mttm -56.5 89.9 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.167 -0.469 . . . . 74.450000000000003 110.91 179.925 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 1.4 mmt180 -126.02 54.49 1.53 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.205 -0.452 . . . . 74.409999999999997 110.918 179.978 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 2.8 mmpt? -78.72 170.23 16.98 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.171 -0.468 . . . . 73.540000000000006 110.88 179.996 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 5.4 t -85.02 -62.16 1.6 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.187 -0.46 . . . . 64.519999999999996 110.839 -179.88 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 4.6 m -141.95 95.5 2.82 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.142 -0.481 . . . . 74.329999999999998 110.891 -179.836 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 40' ' ' TRP . . . . . . . . . . . . . 12.4 t-105 -178.36 -48.05 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.136 -0.484 . . . . 74.129999999999995 110.932 -179.98 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 20.5 t0 -159.68 164.14 34.24 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.24 -0.436 . . . . 72.129999999999995 110.905 179.92 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . 0.405 ' C ' ' CD ' ' A' ' 44' ' ' PRO . 0.0 OUTLIER -154.23 68.28 0.74 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.216 -0.447 . . . . 71.439999999999998 110.897 179.987 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . 0.462 ' N ' ' CD ' ' A' ' 44' ' ' PRO . 12.7 mt-30 -118.71 53.47 1.92 Allowed Pre-proline 0 C--N 1.329 -0.3 0 CA-C-O 121.599 0.714 . . . . 74.409999999999997 110.937 179.942 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 44' ' ' PRO . . . . . 0.462 ' CD ' ' N ' ' A' ' 43' ' ' GLN . 53.9 Cg_endo -69.75 157.0 61.91 Favored 'Trans proline' 0 C--N 1.341 0.155 0 C-N-CA 122.694 2.262 . . . . 70.340000000000003 112.343 -179.985 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 45' ' ' GLN . . . . . 0.428 ' O ' ' CB ' ' A' ' 46' ' ' ILE . 27.4 tt0 -139.71 12.81 2.5 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.238 -0.437 . . . . 72.420000000000002 110.917 -179.977 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . 0.464 HG21 ' N ' ' A' ' 47' ' ' ILE . 0.0 OUTLIER 79.72 -42.35 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.24 -0.436 . . . . 65.219999999999999 111.13 179.991 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . 0.488 ' N ' HD12 ' A' ' 47' ' ' ILE . 0.2 OUTLIER -34.03 143.27 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.206 -0.452 . . . . 75.340000000000003 111.156 179.87 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 48' ' ' PHE . . . . . 0.538 ' CE1' HD23 ' A' ' 19' ' ' LEU . 1.1 p90 -150.05 164.7 34.85 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.16 -0.473 . . . . 75.5 110.833 -179.989 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . 0.441 ' HG3' ' CD1' ' A' ' 33' ' ' LEU . 34.3 mt-10 -108.84 147.56 31.92 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.123 -0.489 . . . . 75.120000000000005 110.879 -179.945 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 14.4 mm -128.31 135.89 61.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.185 -0.461 . . . . 74.019999999999996 111.157 179.951 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 25.9 m -93.73 125.19 38.22 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.168 -0.469 . . . . 72.140000000000001 111.14 179.974 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . 0.424 HD11 ' CD1' ' A' ' 66' ' ' LEU . 13.9 mt -119.72 165.02 15.06 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.206 -0.452 . . . . 72.409999999999997 110.869 179.979 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -166.41 154.35 10.16 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.178 -0.464 . . . . 71.530000000000001 110.894 179.985 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 1.9 m -56.8 -172.95 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.162 -0.472 . . . . 73.439999999999998 110.868 -179.797 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 34.5 m -87.75 -33.04 6.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.145 -0.48 . . . . 75.140000000000001 111.096 179.978 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 5.1 t0 -119.42 -166.55 1.28 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.23 -0.441 . . . . 74.420000000000002 110.875 179.922 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . 0.446 ' O ' ' C ' ' A' ' 60' ' ' VAL . 1.6 mmmp? -119.31 -25.9 5.99 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.215 -0.448 . . . . 73.219999999999999 110.866 -179.995 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . 0.545 ' HA ' ' C ' ' A' ' 59' ' ' PRO . 7.0 pt-20 -112.14 144.46 30.82 Favored Pre-proline 0 C--N 1.329 -0.286 0 CA-C-O 121.613 0.721 . . . . 73.310000000000002 110.877 179.982 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 59' ' ' PRO . . . . . 0.545 ' C ' ' HA ' ' A' ' 58' ' ' GLU . 53.4 Cg_endo -69.81 -14.44 12.57 Favored 'Cis proline' 0 C--O 1.231 0.171 0 C-N-CA 122.684 -1.798 . . . . 72.099999999999994 112.348 0.051 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 60' ' ' VAL . . . . . 0.472 HG22 ' CG ' ' A' ' 129' ' ' GLN . 15.5 m -140.95 -177.88 1.37 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.211 -0.45 . . . . 74.450000000000003 111.128 179.938 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . 0.441 ' O ' ' C ' ' A' ' 62' ' ' SER . 2.3 pt-20 -119.6 -12.91 9.22 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.177 -0.465 . . . . 65.129999999999995 110.891 -179.98 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 62' ' ' SER . . . . . 0.46 ' CB ' HD12 ' A' ' 125' ' ' LEU . 3.6 m 34.26 90.02 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.162 -0.472 . . . . 74.450000000000003 110.869 -179.769 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 9.7 p -110.19 122.97 48.89 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.152 -0.476 . . . . 63.329999999999998 110.891 -179.865 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 64' ' ' ILE . . . . . 0.436 HG23 ' CG1' ' A' ' 86' ' ' VAL . 19.8 mt -135.69 142.0 40.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.127 -0.488 . . . . 54.240000000000002 111.124 179.944 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 99.6 m -109.71 116.2 31.26 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.194 -0.457 . . . . 74.329999999999998 111.115 179.94 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . 0.424 ' CD1' HD11 ' A' ' 52' ' ' LEU . 53.0 mt -95.16 116.52 28.84 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.2 -0.454 . . . . 72.510000000000005 110.942 179.904 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 13.4 t60 -105.64 113.83 27.63 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.152 -0.477 . . . . 74.540000000000006 110.87 179.861 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 68' ' ' PHE . . . . . 0.559 ' CE1' HG23 ' A' ' 114' ' ' ILE . 0.0 OUTLIER -103.83 139.92 38.37 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.229 -0.441 . . . . 73.209999999999994 110.899 -179.927 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -115.47 107.25 14.94 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.188 -0.46 . . . . 74.349999999999994 111.122 179.921 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 70' ' ' MET . . . . . 0.429 ' HE1' ' CG1' ' A' ' 114' ' ' ILE . 0.3 OUTLIER -74.7 81.98 2.07 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.248 -0.433 . . . . 73.329999999999998 110.911 179.949 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -40.61 158.75 0.16 Allowed Pre-proline 0 C--N 1.33 -0.273 0 CA-C-O 121.579 0.704 . . . . 64.099999999999994 111.143 -179.928 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.74 -1.12 7.92 Favored 'Trans proline' 0 C--N 1.341 0.179 0 C-N-CA 122.701 2.267 . . . . 62.439999999999998 112.39 179.886 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 73' ' ' MET . . . . . 0.49 ' O ' ' CB ' ' A' ' 76' ' ' TYR . 0.1 OUTLIER -112.75 -26.02 8.79 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.198 -0.455 . . . . 73.420000000000002 110.88 179.899 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 74' ' ' TYR . . . . . 0.635 ' CD1' ' C ' ' A' ' 74' ' ' TYR . 0.0 OUTLIER -48.87 149.93 2.92 Favored Pre-proline 0 C--N 1.328 -0.327 0 CA-C-O 121.681 0.753 . . . . 73.099999999999994 110.939 -179.893 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 75' ' ' PRO . . . . . 0.559 ' HA ' ' CD2' ' A' ' 74' ' ' TYR . 53.9 Cg_endo -69.72 -12.88 12.24 Favored 'Cis proline' 0 C--O 1.232 0.187 0 C-N-CA 122.761 -1.766 . . . . 73.400000000000006 112.329 -0.056 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 76' ' ' TYR . . . . . 0.49 ' CB ' ' O ' ' A' ' 73' ' ' MET . 6.5 t80 -35.74 -51.29 0.67 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.251 -0.431 . . . . 74.129999999999995 110.93 -179.9 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 48.2 p -107.1 167.51 9.85 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.12 -0.491 . . . . 74.420000000000002 111.122 -179.992 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -88.93 129.39 48.53 Favored Pre-proline 0 C--N 1.329 -0.314 0 CA-C-O 121.59 0.709 . . . . 72.530000000000001 111.122 179.858 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_endo -69.77 -172.47 0.58 Allowed 'Trans proline' 0 C--N 1.341 0.171 0 C-N-CA 122.667 2.244 . . . . 72.340000000000003 112.321 -179.948 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -120.57 132.98 55.42 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.212 -0.449 . . . . 63.240000000000002 110.871 -179.957 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 9.8 mm -122.96 142.31 40.04 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-N 116.161 -0.472 . . . . 71.430000000000007 111.159 179.97 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . 0.503 ' HG3' ' CD ' ' A' ' 84' ' ' LYS . 4.6 pt-20 -145.09 144.93 31.21 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.217 -0.447 . . . . 51.32 110.893 179.972 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 83' ' ' PHE . . . . . 0.504 ' CE2' ' HD3' ' A' ' 98' ' ' LYS . 33.7 m-85 -99.04 135.28 40.68 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.157 -0.474 . . . . 71.409999999999997 110.888 -179.94 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 84' ' ' LYS . . . . . 0.503 ' CD ' ' HG3' ' A' ' 82' ' ' GLU . 9.2 mmmt -125.4 171.84 10.13 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.165 -0.471 . . . . 75.310000000000002 110.847 -179.989 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . 0.486 ' O ' ' C ' ' A' ' 86' ' ' VAL . 2.8 m-80 62.41 -73.87 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.216 -0.447 . . . . 71.340000000000003 110.878 179.954 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 86' ' ' VAL . . . . . 0.486 ' C ' ' O ' ' A' ' 85' ' ' ASN . 33.6 m 29.74 91.51 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.18 -0.464 . . . . 75.439999999999998 111.11 179.911 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -93.64 -63.57 1.19 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.138 -0.483 . . . . 74.049999999999997 110.909 -179.958 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 88' ' ' ASN . . . . . 0.426 ' ND2' HG21 ' A' ' 60' ' ' VAL . 17.1 t30 -81.82 39.22 0.54 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.202 -0.454 . . . . 75.109999999999999 110.925 -179.987 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 89' ' ' VAL . . . . . 0.421 HG12 ' CD1' ' A' ' 94' ' ' LEU . 15.6 t -141.2 149.49 20.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.171 -0.468 . . . . 73.409999999999997 111.135 179.905 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 90' ' ' MET . . . . . . . . . . . . . 6.2 mtm -107.72 -61.49 1.56 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.152 -0.476 . . . . 74.329999999999998 110.865 179.927 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 91' ' ' ASP . . . . . 0.417 ' OD1' ' N ' ' A' ' 92' ' ' SER . 0.0 OUTLIER -177.64 -30.84 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.233 -0.439 . . . . 75.340000000000003 110.908 179.988 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 92' ' ' SER . . . . . 0.417 ' N ' ' OD1' ' A' ' 91' ' ' ASP . 47.4 t -55.46 -45.7 76.89 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.175 -0.466 . . . . 73.209999999999994 110.89 -179.807 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 93' ' ' GLN . . . . . 0.502 ' HG3' ' CE2' ' A' ' 128' ' ' PHE . 3.9 mp0 -68.58 -41.71 79.28 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.125 -0.489 . . . . 74.049999999999997 110.903 -179.985 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . 0.421 ' CD1' HG12 ' A' ' 89' ' ' VAL . 7.5 mp -58.61 -48.98 79.16 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.211 -0.45 . . . . 73.010000000000005 110.916 -179.986 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 45.7 mt-30 -66.16 -34.45 78.06 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.226 -0.443 . . . . 72.219999999999999 110.93 179.928 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 96' ' ' MET . . . . . 0.424 ' SD ' ' CE1' ' A' ' 128' ' ' PHE . 5.7 ttp -59.74 -39.7 85.62 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.159 -0.473 . . . . 74.439999999999998 110.864 179.972 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 97' ' ' LEU . . . . . 0.582 ' O ' ' CD1' ' A' ' 101' ' ' PHE . 13.4 mt -67.24 -42.18 84.39 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.288 -0.415 . . . . 70.420000000000002 110.892 -179.972 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 98' ' ' LYS . . . . . 0.504 ' HD3' ' CE2' ' A' ' 83' ' ' PHE . 3.2 mmmp? -55.23 -42.35 73.28 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.22 -0.445 . . . . 73.400000000000006 110.893 179.876 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -59.81 -44.57 93.94 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.206 -0.452 . . . . 72.420000000000002 110.883 -179.887 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 19.3 mt-10 -69.88 -27.44 64.82 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.111 -0.495 . . . . 75.349999999999994 110.872 -179.97 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 101' ' ' PHE . . . . . 0.582 ' CD1' ' O ' ' A' ' 97' ' ' LEU . 11.8 m-30 -59.37 -28.83 67.22 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.198 -0.455 . . . . 74.109999999999999 110.869 -179.945 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 6.5 ttmt -71.79 -43.38 65.77 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.136 -0.484 . . . . 72.510000000000005 110.903 179.983 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 16.8 ttpp -69.07 -42.97 75.5 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.235 -0.439 . . . . 75.340000000000003 110.882 179.857 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 3.5 mt -62.59 -47.46 92.82 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.248 -0.433 . . . . 75.040000000000006 111.148 179.854 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 105' ' ' HIS . . . . . . . . . . . . . 35.6 t-80 -62.84 -41.94 99.54 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.185 -0.461 . . . . 64.230000000000004 110.872 179.884 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -57.33 -41.25 79.65 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.172 -0.467 . . . . 75.519999999999996 110.866 -179.952 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 9.4 t -83.57 -15.61 48.55 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.226 -0.443 . . . . 73.510000000000005 111.137 -179.954 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 1.8 m -124.54 43.55 2.99 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.203 -0.453 . . . . 73.25 110.857 -179.899 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 4.9 ttt180 -90.38 83.23 5.9 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.123 -0.49 . . . . 73.099999999999994 110.845 -179.955 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 110' ' ' GLY . . . . . 0.473 ' HA2' ' CB ' ' A' ' 75' ' ' PRO . . . 136.63 -4.43 3.65 Favored Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.712 -0.756 . . . . 53.210000000000001 112.486 -179.971 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 111' ' ' GLN . . . . . . . . . . . . . 13.2 mm-40 -116.46 -94.76 0.48 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.784 0.326 . . . . 64.310000000000002 110.892 -179.909 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 39.9 mt-10 -149.05 131.4 15.62 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.236 -0.438 . . . . 71.349999999999994 110.915 -179.935 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 113' ' ' ILE . . . . . . . . . . . . . 16.3 pt -121.29 -9.52 9.71 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.157 -0.474 . . . . 73.420000000000002 111.166 179.932 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 114' ' ' ILE . . . . . 0.559 HG23 ' CE1' ' A' ' 68' ' ' PHE . 30.2 mm -65.53 -45.85 91.42 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.187 -0.461 . . . . 74.230000000000004 111.18 179.819 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 115' ' ' PHE . . . . . . . . . . . . . 31.8 t80 -73.03 -34.49 66.38 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.173 -0.467 . . . . 71.129999999999995 110.901 179.917 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 9.0 mm-40 -68.06 -47.88 67.11 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.131 -0.486 . . . . 73.230000000000004 110.92 -179.934 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 117' ' ' ILE . . . . . 0.545 HG13 ' CE1' ' A' ' 101' ' ' PHE . 0.9 OUTLIER -63.53 -39.98 87.35 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.13 -0.487 . . . . 73.310000000000002 111.133 179.938 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 118' ' ' THR . . . . . 0.499 ' CG2' ' O ' ' A' ' 114' ' ' ILE . 46.9 p -68.0 -43.54 78.65 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.18 -0.464 . . . . 74.230000000000004 111.13 179.972 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -68.01 -44.15 77.21 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.206 -0.452 . . . . 75.239999999999995 110.876 -179.877 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 1.2 t80 -60.79 -49.45 77.43 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.147 -0.479 . . . . 74.219999999999999 110.881 -179.948 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 121' ' ' THR . . . . . 0.443 ' O ' ' CB ' ' A' ' 125' ' ' LEU . 75.5 p -60.04 -40.37 89.14 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.143 -0.481 . . . . 73.230000000000004 111.171 -179.891 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -68.07 -51.34 47.65 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.208 -0.451 . . . . 74.109999999999999 110.894 179.972 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 123' ' ' GLU . . . . . 0.47 ' CG ' ' N ' ' A' ' 124' ' ' LYS . 4.5 pt-20 -58.91 -46.21 88.43 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.267 -0.424 . . . . 72.109999999999999 110.876 -179.908 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 124' ' ' LYS . . . . . 0.47 ' N ' ' CG ' ' A' ' 123' ' ' GLU . 0.0 OUTLIER -73.77 -26.91 60.89 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.17 -0.468 . . . . 73.049999999999997 110.896 179.966 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 125' ' ' LEU . . . . . 0.46 HD12 ' CB ' ' A' ' 62' ' ' SER . 2.5 tp -67.9 -50.21 57.5 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.234 -0.439 . . . . 74.319999999999993 110.944 179.913 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -61.41 -38.44 87.09 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.175 -0.466 . . . . 60.310000000000002 110.872 179.803 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 127' ' ' GLU . . . . . 0.441 ' HG3' ' N ' ' A' ' 128' ' ' PHE . 0.0 OUTLIER -62.27 -28.97 70.09 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.218 -0.446 . . . . 74.129999999999995 110.868 -179.879 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 128' ' ' PHE . . . . . 0.502 ' CE2' ' HG3' ' A' ' 93' ' ' GLN . 0.6 OUTLIER -77.09 -47.28 20.92 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.148 -0.478 . . . . 62.420000000000002 110.882 -179.912 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 129' ' ' GLN . . . . . 0.472 ' CG ' HG22 ' A' ' 60' ' ' VAL . 1.5 tm0? -67.92 -44.26 77.27 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.14 -0.482 . . . . 75.129999999999995 110.883 -179.916 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 130' ' ' ASN . . . . . 0.509 ' O ' ' CB ' ' A' ' 131' ' ' VAL . 37.8 t30 -62.89 -84.19 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.203 -0.453 . . . . 72.25 110.896 -179.933 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 131' ' ' VAL . . . . . 0.509 ' CB ' ' O ' ' A' ' 130' ' ' ASN . 2.7 t 86.29 -27.91 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 116.134 -0.485 . . . . 62.240000000000002 111.158 179.948 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 132' ' ' VAL . . . . . 0.502 ' CG2' ' O ' ' A' ' 131' ' ' VAL . 91.3 t -160.9 112.71 0.1 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.207 -0.451 . . . . 73.329999999999998 111.102 179.924 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 133' ' ' ASN . . . . . 0.42 ' O ' ' CB ' ' A' ' 134' ' ' THR . 11.0 p-10 -37.41 146.53 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.203 -0.453 . . . . 70.409999999999997 110.835 -179.987 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 134' ' ' THR . . . . . 0.42 ' CB ' ' O ' ' A' ' 133' ' ' ASN . 0.7 OUTLIER 78.97 -67.64 0.16 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.161 -0.472 . . . . 75.0 111.161 -179.97 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 69.59 159.32 0.18 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.2 -0.455 . . . . 74.25 110.896 179.969 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -84.83 125.17 32.37 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.184 -0.462 . . . . 74.200000000000003 110.863 -179.798 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 137' ' ' LEU . . . . . . . . . . . . . 5.5 tp -51.38 -45.82 62.58 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.172 -0.467 . . . . 74.310000000000002 110.888 -179.96 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--N 1.329 -0.291 0 CA-C-N 116.246 -0.434 . . . . 74.230000000000004 110.868 179.94 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 2.4 mtt . . . . . 0 C--O 1.231 0.084 0 CA-C-O 120.765 0.317 . . . . 75.230000000000004 110.861 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 83.6 p -154.01 -46.98 0.09 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.213 -0.448 . . . . 64.140000000000001 110.85 -179.798 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -91.35 145.69 24.43 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.116 -0.493 . . . . 73.420000000000002 110.881 -179.967 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 4' ' ' SER . . . . . 0.415 ' O ' ' CB ' ' A' ' 5' ' ' HIS . 19.1 m -167.13 162.26 15.15 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.162 -0.472 . . . . 75.310000000000002 110.836 -179.944 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 5' ' ' HIS . . . . . 0.415 ' CB ' ' O ' ' A' ' 4' ' ' SER . 0.2 OUTLIER 77.25 121.46 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.123 -0.489 . . . . 73.109999999999999 110.839 179.924 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . 0.406 ' C ' ' O ' ' A' ' 5' ' ' HIS . 0.2 OUTLIER 37.71 83.59 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.194 -0.457 . . . . 64.340000000000003 110.906 -179.951 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 7' ' ' THR . . . . . 0.449 ' OG1' ' N ' ' A' ' 8' ' ' LEU . 6.4 t 177.02 -174.94 0.12 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.201 -0.454 . . . . 65.299999999999997 111.181 179.923 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . 0.449 ' N ' ' OG1' ' A' ' 7' ' ' THR . 50.9 mt -65.54 -27.63 68.59 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.231 -0.441 . . . . 72.150000000000006 110.916 -180.0 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 37.2 t70 -50.61 -31.13 15.11 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.187 -0.46 . . . . 74.540000000000006 110.894 179.819 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 82.6 mm-40 -67.51 -39.65 85.11 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.185 -0.461 . . . . 74.510000000000005 110.931 -179.938 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 19.2 m-85 -59.41 -25.4 64.29 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.176 -0.466 . . . . 74.319999999999993 110.945 -179.925 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 1.6 t80 -59.33 -38.98 81.7 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.155 -0.475 . . . . 70.299999999999997 110.901 -179.905 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -61.43 -42.52 98.88 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.166 -0.47 . . . . 61.229999999999997 110.879 -179.964 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 3.1 mp -67.54 -41.9 86.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.171 -0.468 . . . . 73.109999999999999 111.169 179.957 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . 0.42 ' NE2' ' O ' ' A' ' 71' ' ' THR . 73.0 mt-30 -60.88 -44.7 96.71 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.12 -0.491 . . . . 75.25 110.901 179.917 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 6.9 t -64.02 -39.6 94.47 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.217 -0.447 . . . . 64.219999999999999 110.911 -179.919 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 8.0 m-20 -58.02 -33.92 69.48 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.158 -0.474 . . . . 72.040000000000006 110.889 -179.9 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . 0.4 ' CD ' ' OH ' ' A' ' 74' ' ' TYR . 1.6 mm-40 -65.38 -37.67 87.71 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.173 -0.467 . . . . 73.439999999999998 110.886 -179.986 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . 0.485 HD12 ' CE1' ' A' ' 48' ' ' PHE . 5.9 mp -66.14 -51.4 58.23 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.134 -0.485 . . . . 73.340000000000003 110.952 179.99 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -68.68 -34.18 75.24 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.196 -0.457 . . . . 74.019999999999996 110.881 179.915 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -64.54 -50.85 65.68 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.145 -0.479 . . . . 73.140000000000001 111.113 179.906 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 0.6 OUTLIER -75.1 -34.46 31.82 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 116.252 -0.431 . . . . 75.340000000000003 111.161 179.943 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . 0.519 ' O ' ' CA ' ' A' ' 27' ' ' MET . 0.0 OUTLIER -52.43 -35.53 52.33 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.177 -0.465 . . . . 74.409999999999997 110.896 179.972 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -68.43 -28.53 67.15 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.132 -0.486 . . . . 74.209999999999994 110.908 -179.833 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 4.7 mt -84.13 -45.15 18.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.134 -0.485 . . . . 72.519999999999996 111.137 179.939 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 26' ' ' TYR . . . . . 0.508 ' O ' ' N ' ' A' ' 29' ' ' ASP . 32.3 m-85 -106.32 21.01 18.1 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.146 -0.479 . . . . 73.310000000000002 110.915 -179.991 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 27' ' ' MET . . . . . 0.519 ' CA ' ' O ' ' A' ' 23' ' ' ARG . 0.0 OUTLIER -33.87 -45.56 0.19 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.112 -0.494 . . . . 75.230000000000004 110.873 179.951 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 31.1 t70 -86.19 -31.19 21.9 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.209 -0.45 . . . . 74.349999999999994 110.871 179.965 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . 0.508 ' N ' ' O ' ' A' ' 26' ' ' TYR . 1.3 m-20 -103.21 37.77 1.91 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.151 -0.477 . . . . 73.5 110.907 179.972 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 30' ' ' PHE . . . . . 0.411 ' N ' ' O ' ' A' ' 26' ' ' TYR . 0.6 OUTLIER -109.91 135.13 51.26 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.183 -0.462 . . . . 65.400000000000006 110.876 -179.881 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 45.4 m -115.24 130.9 57.04 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.132 -0.485 . . . . 72.5 111.182 -179.934 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -104.9 115.3 30.06 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.283 -0.417 . . . . 70.230000000000004 110.904 179.925 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . 0.57 HD21 ' CE1' ' A' ' 67' ' ' HIS . 0.5 OUTLIER -119.18 4.01 11.34 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.223 -0.444 . . . . 54.509999999999998 110.882 -179.915 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 1.3 m -68.91 127.26 32.49 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.213 -0.449 . . . . 74.109999999999999 111.125 179.945 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 1.4 ptmt -64.08 88.31 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.198 -0.455 . . . . 74.439999999999998 110.866 179.904 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . 0.443 ' O ' ' C ' ' A' ' 37' ' ' LYS . 0.4 OUTLIER -98.15 -62.17 1.28 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.208 -0.451 . . . . 74.120000000000005 110.894 179.929 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . 0.443 ' C ' ' O ' ' A' ' 36' ' ' ARG . 1.8 mmtt -34.53 142.06 0.05 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.24 -0.436 . . . . 72.209999999999994 110.875 179.957 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 2.8 t -70.12 167.33 17.96 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.245 -0.434 . . . . 64.409999999999997 110.812 -179.906 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 39' ' ' SER . . . . . 0.432 ' O ' ' CB ' ' A' ' 40' ' ' TRP . 2.9 m 58.84 164.05 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.09 -0.505 . . . . 74.420000000000002 110.868 -179.83 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 40' ' ' TRP . . . . . 0.554 ' O ' ' CE3' ' A' ' 40' ' ' TRP . 0.0 OUTLIER 78.25 -41.98 0.33 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.135 -0.484 . . . . 75.340000000000003 110.902 179.991 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . 0.531 ' HB2' ' CD2' ' A' ' 40' ' ' TRP . 7.3 t0 -178.74 148.19 0.41 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.247 -0.433 . . . . 63.219999999999999 110.872 179.945 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 32.2 mtmt -148.14 76.5 1.37 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.244 -0.435 . . . . 75.329999999999998 110.914 179.966 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 2.5 mt-30 -166.17 64.28 0.87 Allowed Pre-proline 0 C--N 1.329 -0.287 0 CA-C-O 121.634 0.73 . . . . 71.319999999999993 110.933 179.961 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.73 162.17 43.1 Favored 'Trans proline' 0 C--N 1.342 0.216 0 C-N-CA 122.681 2.254 . . . . 74.230000000000004 112.328 179.994 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 45' ' ' GLN . . . . . 0.451 ' O ' ' CG ' ' A' ' 45' ' ' GLN . 17.6 tt0 -132.65 11.36 4.4 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.192 -0.458 . . . . 72.319999999999993 110.899 179.996 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . 0.441 ' CB ' ' O ' ' A' ' 45' ' ' GLN . 0.0 OUTLIER 81.67 -11.56 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.178 -0.465 . . . . 74.310000000000002 111.108 179.936 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . 0.441 HG12 ' CD1' ' A' ' 33' ' ' LEU . 0.2 OUTLIER -51.5 150.57 0.91 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 116.157 -0.474 . . . . 74.319999999999993 111.114 179.879 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 48' ' ' PHE . . . . . 0.485 ' CE1' HD12 ' A' ' 19' ' ' LEU . 6.8 p90 -161.95 161.19 28.57 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.118 -0.492 . . . . 73.030000000000001 110.875 179.968 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . 0.474 ' CG ' ' HB2' ' A' ' 67' ' ' HIS . 8.6 mt-10 -111.25 161.02 16.44 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.137 -0.483 . . . . 73.129999999999995 110.858 -179.942 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 7.8 mm -140.27 132.38 32.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.114 -0.493 . . . . 73.519999999999996 111.173 179.941 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 24.2 m -84.44 123.29 30.07 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.205 -0.452 . . . . 75.209999999999994 111.164 179.995 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 31.2 mt -121.72 164.98 16.48 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.229 -0.442 . . . . 74.209999999999994 110.928 179.979 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 7.6 ptt180 175.68 163.42 0.32 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.231 -0.44 . . . . 72.030000000000001 110.848 179.943 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 54' ' ' SER . . . . . 0.463 ' CB ' HD11 ' A' ' 125' ' ' LEU . 1.4 t -60.59 -156.47 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.184 -0.462 . . . . 73.120000000000005 110.87 -179.842 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 15.7 m -122.31 -22.84 2.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.114 -0.494 . . . . 73.299999999999997 111.144 179.896 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 56' ' ' ASP . . . . . 0.439 ' OD1' ' N ' ' A' ' 56' ' ' ASP . 0.2 OUTLIER -110.5 -175.39 2.71 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.181 -0.463 . . . . 65.329999999999998 110.889 179.906 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 3.9 mmmm -118.47 -10.87 10.04 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.173 -0.467 . . . . 72.319999999999993 110.884 179.999 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . 0.546 ' HA ' ' C ' ' A' ' 59' ' ' PRO . 44.3 mt-10 -126.34 141.89 41.24 Favored Pre-proline 0 C--N 1.329 -0.288 0 CA-C-O 121.659 0.742 . . . . 74.25 110.885 179.974 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 59' ' ' PRO . . . . . 0.546 ' C ' ' HA ' ' A' ' 58' ' ' GLU . 53.4 Cg_endo -69.79 -3.18 7.58 Favored 'Cis proline' 0 C--N 1.342 0.205 0 C-N-CA 122.653 -1.811 . . . . 75.5 112.36 0.035 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 60' ' ' VAL . . . . . 0.478 ' O ' ' NE2' ' A' ' 129' ' ' GLN . 18.3 m -157.61 -173.29 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.232 -0.44 . . . . 74.530000000000001 111.144 179.918 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . 0.408 ' O ' ' O ' ' A' ' 62' ' ' SER . 8.3 tt0 -114.86 -22.1 9.8 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.184 -0.462 . . . . 72.129999999999995 110.873 -179.969 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 62' ' ' SER . . . . . 0.408 ' O ' ' O ' ' A' ' 61' ' ' GLU . 0.4 OUTLIER 49.4 101.63 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.137 -0.483 . . . . 61.149999999999999 110.864 -179.787 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 26.0 t -125.31 123.26 39.05 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.14 -0.482 . . . . 75.299999999999997 110.887 -179.83 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 64' ' ' ILE . . . . . . . . . . . . . 64.7 mt -145.16 142.56 22.59 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.178 -0.465 . . . . 61.109999999999999 111.163 179.938 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 23.5 m -107.52 119.07 38.4 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.198 -0.455 . . . . 51.229999999999997 111.123 -179.994 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . 0.458 HD22 ' CE1' ' A' ' 83' ' ' PHE . 54.1 mt -99.01 109.97 22.64 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.242 -0.436 . . . . 75.099999999999994 110.915 179.913 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 67' ' ' HIS . . . . . 0.57 ' CE1' HD21 ' A' ' 33' ' ' LEU . 1.9 t60 -96.47 109.76 22.26 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.152 -0.476 . . . . 74.049999999999997 110.853 179.869 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -103.92 139.91 38.42 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.245 -0.434 . . . . 73.140000000000001 110.875 -179.911 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . 0.451 ' O ' ' CB ' ' A' ' 79' ' ' PRO . . . -126.64 129.04 47.71 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.145 -0.479 . . . . 75.5 111.119 179.908 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -94.64 157.86 15.78 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.234 -0.439 . . . . 75.25 110.854 179.982 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 71' ' ' THR . . . . . 0.42 ' O ' ' NE2' ' A' ' 15' ' ' GLN . 0.1 OUTLIER -112.16 162.93 19.09 Favored Pre-proline 0 C--N 1.33 -0.241 0 CA-C-O 121.601 0.715 . . . . 60.219999999999999 111.096 -179.945 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.76 0.1 6.13 Favored 'Trans proline' 0 C--N 1.341 0.173 0 C-N-CA 122.71 2.273 . . . . 60.109999999999999 112.348 179.933 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 73' ' ' MET . . . . . 0.465 ' CB ' HG23 ' A' ' 77' ' ' THR . 0.0 OUTLIER -115.06 -26.71 7.6 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.241 -0.436 . . . . 63.240000000000002 110.911 179.895 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 74' ' ' TYR . . . . . 0.66 ' CD1' ' C ' ' A' ' 74' ' ' TYR . 0.0 OUTLIER -45.76 151.66 0.81 Allowed Pre-proline 0 C--N 1.329 -0.323 0 CA-C-O 121.675 0.75 . . . . 72.329999999999998 110.935 -179.873 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 75' ' ' PRO . . . . . 0.586 ' HA ' ' CD2' ' A' ' 74' ' ' TYR . 53.6 Cg_endo -69.8 2.15 5.02 Favored 'Cis proline' 0 C--O 1.232 0.205 0 C-N-CA 122.634 -1.819 . . . . 72.0 112.329 -0.036 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 76' ' ' TYR . . . . . 0.497 ' N ' ' HA ' ' A' ' 74' ' ' TYR . 19.6 t80 -75.3 44.46 0.26 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.258 -0.428 . . . . 74.519999999999996 110.967 -179.968 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 77' ' ' THR . . . . . 0.465 HG23 ' CB ' ' A' ' 73' ' ' MET . 0.6 OUTLIER -172.61 -177.57 1.75 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.086 -0.506 . . . . 75.409999999999997 111.181 -179.971 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -118.73 116.59 34.58 Favored Pre-proline 0 C--N 1.329 -0.313 0 CA-C-O 121.587 0.708 . . . . 73.099999999999994 111.075 179.863 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 79' ' ' PRO . . . . . 0.454 ' HG3' ' CD1' ' A' ' 113' ' ' ILE . 53.7 Cg_endo -69.72 -164.66 0.13 Allowed 'Trans proline' 0 C--N 1.342 0.192 0 C-N-CA 122.674 2.249 . . . . 73.150000000000006 112.356 179.978 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -135.32 136.03 41.24 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.19 -0.459 . . . . 73.329999999999998 110.907 179.985 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 10.0 mm -127.99 144.34 37.98 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.113 -0.494 . . . . 74.120000000000005 111.168 179.954 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . 0.435 ' HG3' ' CD ' ' A' ' 84' ' ' LYS . 1.2 pt-20 -148.51 145.93 28.12 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.162 -0.472 . . . . 72.230000000000004 110.888 179.973 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 83' ' ' PHE . . . . . 0.574 ' CE2' ' HD3' ' A' ' 98' ' ' LYS . 7.3 m-85 -99.33 139.95 34.22 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.171 -0.468 . . . . 74.420000000000002 110.895 -179.965 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 84' ' ' LYS . . . . . 0.478 ' O ' ' N ' ' A' ' 86' ' ' VAL . 5.3 mmmt -127.06 173.62 9.53 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.172 -0.467 . . . . 74.129999999999995 110.889 179.981 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . 0.544 ' N ' HD21 ' A' ' 85' ' ' ASN . 1.2 m-80 61.35 -75.51 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.191 -0.459 . . . . 73.040000000000006 110.907 179.946 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 86' ' ' VAL . . . . . 0.478 ' N ' ' O ' ' A' ' 84' ' ' LYS . 3.6 m 40.22 91.35 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.151 -0.477 . . . . 75.239999999999995 111.099 179.858 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -96.79 -65.08 0.99 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.143 -0.48 . . . . 74.299999999999997 110.934 179.974 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 88' ' ' ASN . . . . . 0.462 ' ND2' ' HB ' ' A' ' 60' ' ' VAL . 8.5 m120 -84.95 34.23 0.54 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.218 -0.447 . . . . 74.140000000000001 110.907 -179.995 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 89' ' ' VAL . . . . . 0.448 HG11 ' CD1' ' A' ' 94' ' ' LEU . 17.1 t -138.06 146.57 26.86 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.205 -0.452 . . . . 62.439999999999998 111.148 179.925 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 90' ' ' MET . . . . . . . . . . . . . 13.7 mtm -101.75 -62.97 1.19 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.186 -0.461 . . . . 71.219999999999999 110.857 179.932 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -179.53 -32.73 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.215 -0.448 . . . . 74.450000000000003 110.848 179.973 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 39.0 t -53.97 -42.3 68.8 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.206 -0.452 . . . . 74.219999999999999 110.872 -179.789 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 93' ' ' GLN . . . . . 0.554 ' HG3' ' CZ ' ' A' ' 128' ' ' PHE . 0.2 OUTLIER -70.36 -39.69 74.46 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.132 -0.485 . . . . 74.129999999999995 110.945 -179.98 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . 0.499 ' HG ' ' CG ' ' A' ' 83' ' ' PHE . 7.4 mp -59.76 -48.16 82.77 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.174 -0.466 . . . . 73.040000000000006 110.927 179.992 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 73.7 mt-30 -65.52 -33.91 77.03 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.186 -0.461 . . . . 71.340000000000003 110.944 179.91 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 96' ' ' MET . . . . . 0.414 ' HE2' ' CE2' ' A' ' 128' ' ' PHE . 46.7 ttp -59.8 -38.01 80.73 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.193 -0.458 . . . . 75.540000000000006 110.891 179.947 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 97' ' ' LEU . . . . . 0.596 ' O ' ' CD1' ' A' ' 101' ' ' PHE . 30.4 mt -72.21 -38.97 68.89 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.226 -0.443 . . . . 74.140000000000001 110.954 179.992 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 98' ' ' LYS . . . . . 0.574 ' HD3' ' CE2' ' A' ' 83' ' ' PHE . 2.3 mmmp? -57.1 -38.36 73.28 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.169 -0.469 . . . . 60.130000000000003 110.945 179.797 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 5.1 m -63.26 -40.32 97.08 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.185 -0.462 . . . . 74.540000000000006 110.872 -179.897 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 4.2 mm-40 -74.24 -26.46 60.25 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.129 -0.487 . . . . 72.200000000000003 110.894 -179.961 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 101' ' ' PHE . . . . . 0.596 ' CD1' ' O ' ' A' ' 97' ' ' LEU . 12.7 m-30 -59.44 -29.95 68.14 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.171 -0.468 . . . . 74.439999999999998 110.887 -179.94 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 1.9 tmpt? -74.82 -42.43 58.05 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.158 -0.474 . . . . 73.239999999999995 110.86 179.978 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.13 -37.82 75.4 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.242 -0.436 . . . . 73.019999999999996 110.905 179.885 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 4.2 mt -63.47 -47.52 91.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.217 -0.447 . . . . 75.140000000000001 111.088 179.888 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 105' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -61.49 -41.09 96.75 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.223 -0.444 . . . . 74.310000000000002 110.879 179.9 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -61.66 -41.05 97.01 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.157 -0.474 . . . . 74.310000000000002 110.877 -179.921 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 8.8 t -81.41 -28.27 34.38 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.15 -0.477 . . . . 55.340000000000003 111.18 -179.986 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 67.1 m -100.47 17.48 21.52 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.178 -0.464 . . . . 74.430000000000007 110.856 -179.897 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.23 90.86 0.15 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.135 -0.484 . . . . 75.239999999999995 110.875 -179.961 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 137.57 -23.39 3.11 Favored Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.737 -0.744 . . . . 75.239999999999995 112.447 -179.997 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 111' ' ' GLN . . . . . . . . . . . . . 4.7 pt20 -119.64 -156.8 0.68 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.721 0.296 . . . . 74.209999999999994 110.962 -179.903 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 46.8 mt-10 -72.62 139.54 47.45 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.208 -0.451 . . . . 74.120000000000005 110.866 -179.918 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 113' ' ' ILE . . . . . 0.454 ' CD1' ' HG3' ' A' ' 79' ' ' PRO . 4.7 pt -123.22 -24.66 2.25 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.196 -0.457 . . . . 73.340000000000003 111.139 179.96 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 36.9 mm -59.26 -45.13 93.27 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 116.189 -0.46 . . . . 71.239999999999995 111.136 179.856 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 115' ' ' PHE . . . . . . . . . . . . . 28.8 t80 -66.95 -35.29 79.65 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.116 -0.493 . . . . 75.510000000000005 110.865 179.967 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 5.2 mm-40 -66.81 -47.91 70.58 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.154 -0.475 . . . . 73.430000000000007 110.89 -179.888 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 117' ' ' ILE . . . . . 0.489 HG12 ' CE1' ' A' ' 101' ' ' PHE . 0.3 OUTLIER -64.42 -41.92 93.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.133 -0.485 . . . . 73.549999999999997 111.151 179.959 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 118' ' ' THR . . . . . 0.482 ' N ' ' CG2' ' A' ' 117' ' ' ILE . 66.1 p -67.84 -42.25 81.71 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.208 -0.451 . . . . 71.450000000000003 111.141 179.979 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 6.1 t -66.55 -44.25 82.87 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.229 -0.442 . . . . 65.439999999999998 110.869 -179.876 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 120' ' ' PHE . . . . . 0.501 ' CD2' ' NZ ' ' A' ' 124' ' ' LYS . 0.2 OUTLIER -64.95 -47.08 78.91 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.132 -0.485 . . . . 73.349999999999994 110.88 -179.948 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 76.3 p -67.68 -38.96 84.45 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.163 -0.472 . . . . 72.319999999999993 111.159 -179.933 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 9.9 tt0 -64.96 -47.99 75.66 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.238 -0.437 . . . . 73.420000000000002 110.884 179.986 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 3.0 pt-20 -63.73 -39.25 93.84 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.262 -0.426 . . . . 72.140000000000001 110.86 -179.897 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 124' ' ' LYS . . . . . 0.501 ' NZ ' ' CD2' ' A' ' 120' ' ' PHE . 0.0 OUTLIER -67.49 -40.95 85.25 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.189 -0.46 . . . . 74.099999999999994 110.896 179.948 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 125' ' ' LEU . . . . . 0.551 ' CD1' ' C ' ' A' ' 125' ' ' LEU . 0.2 OUTLIER -68.95 -36.89 78.46 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.17 -0.468 . . . . 72.219999999999999 110.94 179.944 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 7.9 t0 -64.02 -41.96 97.27 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.166 -0.47 . . . . 74.409999999999997 110.889 179.775 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 127' ' ' GLU . . . . . 0.418 ' CG ' ' O ' ' A' ' 124' ' ' LYS . 8.2 pt-20 -69.91 -37.49 75.98 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.152 -0.476 . . . . 75.519999999999996 110.87 -179.882 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 128' ' ' PHE . . . . . 0.554 ' CZ ' ' HG3' ' A' ' 93' ' ' GLN . 1.1 m-85 -50.04 -53.27 28.01 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.154 -0.476 . . . . 74.129999999999995 110.9 -179.932 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 129' ' ' GLN . . . . . 0.478 ' NE2' ' O ' ' A' ' 60' ' ' VAL . 1.9 mt-30 -53.41 -41.77 66.33 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.113 -0.494 . . . . 74.450000000000003 110.87 -179.927 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 130' ' ' ASN . . . . . . . . . . . . . 1.2 t30 -44.01 -38.42 3.52 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.2 -0.455 . . . . 73.430000000000007 110.874 -179.943 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 131' ' ' VAL . . . . . 0.484 ' CG2' ' O ' ' A' ' 131' ' ' VAL . 1.4 p -164.99 74.75 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.209 -0.45 . . . . 73.400000000000006 111.116 179.95 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 132' ' ' VAL . . . . . 0.459 HG13 ' CG2' ' A' ' 134' ' ' THR . 7.3 p -94.36 136.87 24.46 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.195 -0.457 . . . . 72.219999999999999 111.14 179.904 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 133' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -69.01 92.59 0.53 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.192 -0.458 . . . . 74.120000000000005 110.869 -179.985 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 134' ' ' THR . . . . . 0.459 ' CG2' HG13 ' A' ' 132' ' ' VAL . 0.4 OUTLIER 174.75 -40.4 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.172 -0.467 . . . . 71.310000000000002 111.125 179.998 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER 38.49 74.03 0.1 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.215 -0.448 . . . . 74.329999999999998 110.887 179.996 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 175.9 173.56 0.32 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.185 -0.462 . . . . 74.329999999999998 110.822 -179.824 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 137' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -85.54 -174.52 5.22 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.163 -0.471 . . . . 72.519999999999996 110.92 180.0 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--N 1.33 -0.282 0 CA-C-N 116.222 -0.444 . . . . 75.219999999999999 110.861 179.933 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 8.0 ptp . . . . . 0 C--O 1.232 0.137 0 CA-C-O 120.787 0.327 . . . . 73.239999999999995 110.912 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 51.9 p -120.12 151.06 39.61 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.246 -0.434 . . . . 72.409999999999997 110.838 -179.789 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 3.3 mt -128.56 177.54 6.94 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.122 -0.49 . . . . 63.219999999999999 110.96 179.987 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 69.5 m -99.09 87.21 3.62 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.214 -0.448 . . . . 73.209999999999994 110.858 -179.941 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 5' ' ' HIS . . . . . 0.401 ' O ' ' C ' ' A' ' 6' ' ' LEU . 1.3 p80 -149.28 105.48 3.5 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.128 -0.487 . . . . 71.510000000000005 110.852 179.973 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . 0.401 ' C ' ' O ' ' A' ' 5' ' ' HIS . 6.2 tp 37.96 72.74 0.12 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.187 -0.46 . . . . 75.450000000000003 110.882 179.999 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 7' ' ' THR . . . . . 0.427 ' OG1' ' N ' ' A' ' 8' ' ' LEU . 1.8 t -162.32 175.16 11.87 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.2 -0.454 . . . . 75.030000000000001 111.136 179.922 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . 0.427 ' N ' ' OG1' ' A' ' 7' ' ' THR . 47.9 mt -49.98 -23.29 1.93 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.22 -0.446 . . . . 73.319999999999993 110.929 179.924 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -51.5 -32.11 26.33 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.2 -0.455 . . . . 63.310000000000002 110.885 179.836 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 80.6 mm-40 -68.11 -37.75 81.51 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.149 -0.478 . . . . 74.430000000000007 110.903 -179.917 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 22.0 m-85 -59.74 -27.98 66.97 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.214 -0.448 . . . . 75.349999999999994 110.95 -179.857 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -59.54 -37.04 77.34 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.091 -0.504 . . . . 73.099999999999994 110.911 -179.94 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 1.4 mm-40 -64.13 -45.22 89.5 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.105 -0.498 . . . . 74.5 110.84 -179.944 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 4.2 mp -67.51 -42.64 87.2 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.178 -0.464 . . . . 74.219999999999999 111.184 179.95 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 62.4 mt-30 -65.59 -48.4 72.47 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.168 -0.469 . . . . 75.5 110.925 179.921 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 4.2 t -58.57 -37.22 75.28 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.223 -0.444 . . . . 71.450000000000003 110.903 -179.942 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -57.79 -33.83 68.97 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.143 -0.481 . . . . 73.140000000000001 110.913 -179.91 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 14.8 mt-10 -66.97 -38.15 85.55 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.141 -0.481 . . . . 72.200000000000003 110.9 -179.992 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 8.9 mp -63.42 -51.34 66.16 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.117 -0.492 . . . . 75.109999999999999 110.911 -179.96 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 3.0 pt-20 -68.48 -34.83 76.6 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.147 -0.478 . . . . 75.209999999999994 110.877 179.949 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -66.49 -50.44 63.29 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.163 -0.471 . . . . 74.150000000000006 111.107 179.923 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . 0.458 ' N ' HD13 ' A' ' 22' ' ' ILE . 0.8 OUTLIER -74.21 -34.46 37.71 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.261 -0.427 . . . . 74.299999999999997 111.165 179.968 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 38.1 mtp180 -52.9 -34.8 56.55 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.192 -0.458 . . . . 72.219999999999999 110.873 179.91 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -67.13 -35.26 79.35 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.221 -0.445 . . . . 74.5 110.831 -179.762 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . 0.554 HD12 ' CE1' ' A' ' 115' ' ' PHE . 3.2 mt -80.05 -45.09 22.74 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.155 -0.475 . . . . 75.219999999999999 111.126 179.978 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 25.2 m-85 -107.02 45.14 1.0 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.176 -0.465 . . . . 73.430000000000007 110.907 -179.97 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 2.2 mtm -43.08 -54.07 4.56 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.191 -0.459 . . . . 73.430000000000007 110.861 179.911 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -92.99 -24.42 18.37 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.236 -0.438 . . . . 73.230000000000004 110.865 179.987 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 9.1 m-20 -86.99 28.76 0.87 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.182 -0.463 . . . . 71.519999999999996 110.861 179.968 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 30' ' ' PHE . . . . . 0.611 ' C ' ' CD1' ' A' ' 30' ' ' PHE . 0.4 OUTLIER -113.5 144.34 43.01 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.222 -0.445 . . . . 72.129999999999995 110.892 -179.917 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 31' ' ' THR . . . . . 0.4 ' N ' ' CD1' ' A' ' 30' ' ' PHE . 52.6 m -123.9 130.07 52.0 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.126 -0.488 . . . . 75.400000000000006 111.092 -179.902 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -96.92 114.14 25.74 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.204 -0.453 . . . . 53.329999999999998 110.844 179.88 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . 0.596 ' CD2' ' N ' ' A' ' 34' ' ' THR . 0.1 OUTLIER -117.17 -18.35 10.01 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.217 -0.447 . . . . 74.140000000000001 110.894 -179.961 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 34' ' ' THR . . . . . 0.596 ' N ' ' CD2' ' A' ' 33' ' ' LEU . 4.9 m -34.55 94.39 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.199 -0.455 . . . . 70.439999999999998 111.122 -179.981 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . 0.472 ' N ' ' O ' ' A' ' 33' ' ' LEU . 0.2 OUTLIER -43.55 100.17 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.19 -0.459 . . . . 71.340000000000003 110.872 179.913 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 1.9 mmt-85 -98.85 -83.72 0.41 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.222 -0.445 . . . . 74.140000000000001 110.86 179.985 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 8.8 mmpt? -109.75 -13.41 14.49 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.255 -0.43 . . . . 74.510000000000005 110.908 179.932 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -85.77 -174.23 5.03 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.23 -0.441 . . . . 75.209999999999994 110.825 -179.878 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 4.1 m 63.07 -167.07 0.22 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.108 -0.496 . . . . 72.040000000000006 110.843 -179.807 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 40' ' ' TRP . . . . . . . . . . . . . 15.3 p90 -112.82 -12.47 13.32 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.112 -0.494 . . . . 72.219999999999999 110.943 179.994 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 2.0 t70 -123.14 138.43 54.66 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.223 -0.444 . . . . 74.409999999999997 110.821 179.944 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -123.28 73.6 1.18 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.145 -0.48 . . . . 75.310000000000002 110.867 179.973 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 1.7 mt-30 -141.55 60.79 12.25 Favored Pre-proline 0 C--N 1.329 -0.289 0 CA-C-O 121.611 0.72 . . . . 75.140000000000001 110.958 179.966 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_endo -69.78 -169.37 0.33 Allowed 'Trans proline' 0 C--N 1.341 0.157 0 C-N-CA 122.72 2.28 . . . . 75.519999999999996 112.304 -179.925 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 45' ' ' GLN . . . . . 0.515 ' O ' ' CB ' ' A' ' 46' ' ' ILE . 24.5 pt20 -170.81 31.64 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.236 -0.438 . . . . 70.349999999999994 110.875 -179.964 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . 0.515 ' CB ' ' O ' ' A' ' 45' ' ' GLN . 0.1 OUTLIER 86.68 2.52 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.244 -0.435 . . . . 71.310000000000002 111.182 -179.992 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . 0.459 ' CG2' ' HG2' ' A' ' 45' ' ' GLN . 0.2 OUTLIER -66.39 147.68 12.48 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.167 -0.47 . . . . 71.329999999999998 111.113 179.864 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 48' ' ' PHE . . . . . 0.437 ' HA ' ' CD2' ' A' ' 33' ' ' LEU . 6.6 p90 -160.94 163.41 31.86 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.189 -0.46 . . . . 75.140000000000001 110.885 179.977 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 19.1 mt-10 -110.73 157.39 19.8 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.128 -0.487 . . . . 75.209999999999994 110.878 -179.929 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 9.5 mm -134.27 135.24 54.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.177 -0.465 . . . . 60.210000000000001 111.136 -179.986 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 99.7 m -85.08 135.08 34.15 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.156 -0.474 . . . . 65.129999999999995 111.131 -179.996 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 9.1 mt -133.98 156.01 48.95 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.203 -0.453 . . . . 74.299999999999997 110.936 179.978 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 53' ' ' ARG . . . . . 0.431 ' CG ' ' HB2' ' A' ' 63' ' ' SER . 0.0 OUTLIER -155.92 163.43 39.77 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.174 -0.466 . . . . 74.420000000000002 110.858 179.956 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -58.72 -169.0 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.174 -0.466 . . . . 62.210000000000001 110.85 -179.753 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -82.51 -37.65 14.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.128 -0.487 . . . . 72.540000000000006 111.131 179.973 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 5.4 t0 -130.43 -153.55 0.57 Allowed 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.157 -0.474 . . . . 65.120000000000005 110.873 179.91 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . 0.42 ' HD2' ' CD ' ' A' ' 61' ' ' GLU . 0.5 OUTLIER -116.94 -11.09 10.85 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.213 -0.449 . . . . 73.319999999999993 110.891 -179.983 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . 0.536 ' HA ' ' C ' ' A' ' 59' ' ' PRO . 1.8 pt-20 -126.6 147.07 59.15 Favored Pre-proline 0 C--N 1.329 -0.3 0 CA-C-O 121.664 0.745 . . . . 70.340000000000003 110.888 179.982 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 59' ' ' PRO . . . . . 0.536 ' C ' ' HA ' ' A' ' 58' ' ' GLU . 53.6 Cg_endo -69.75 -8.38 10.45 Favored 'Cis proline' 0 C--N 1.342 0.217 0 C-N-CA 122.679 -1.8 . . . . 75.530000000000001 112.353 0.011 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 60' ' ' VAL . . . . . 0.429 HG22 ' CG ' ' A' ' 88' ' ' ASN . 14.1 m -149.11 164.77 4.04 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.198 -0.455 . . . . 74.25 111.143 179.924 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . 0.42 ' CD ' ' HD2' ' A' ' 57' ' ' LYS . 1.9 tp10 -93.95 -28.2 15.93 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.226 -0.443 . . . . 74.519999999999996 110.872 -179.919 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 62' ' ' SER . . . . . 0.426 ' HB3' ' CD1' ' A' ' 125' ' ' LEU . 5.1 t 40.42 93.82 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.146 -0.479 . . . . 62.399999999999999 110.885 -179.796 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 63' ' ' SER . . . . . 0.431 ' HB2' ' CG ' ' A' ' 53' ' ' ARG . 1.3 t -115.17 123.76 49.73 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.142 -0.481 . . . . 73.409999999999997 110.845 -179.801 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 64' ' ' ILE . . . . . 0.469 ' CG2' ' HB3' ' A' ' 83' ' ' PHE . 38.0 mt -134.8 137.49 50.83 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 116.165 -0.471 . . . . 75.010000000000005 111.134 179.934 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 51.6 m -100.16 114.6 28.11 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.159 -0.473 . . . . 73.409999999999997 111.156 179.956 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . 0.526 ' HB3' ' CE2' ' A' ' 68' ' ' PHE . 1.5 mp -94.04 111.46 23.18 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.22 -0.445 . . . . 73.120000000000005 110.887 179.966 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 1.5 t60 -102.77 111.4 23.7 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.184 -0.462 . . . . 71.430000000000007 110.844 179.831 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 68' ' ' PHE . . . . . 0.57 ' CE1' HG23 ' A' ' 114' ' ' ILE . 0.0 OUTLIER -103.83 142.38 34.48 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.199 -0.455 . . . . 75.200000000000003 110.904 -179.944 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -124.8 121.94 36.0 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.121 -0.491 . . . . 65.239999999999995 111.116 179.93 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -86.61 91.41 8.57 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.205 -0.452 . . . . 75.439999999999998 110.869 179.987 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -43.87 157.24 0.28 Allowed Pre-proline 0 C--N 1.33 -0.256 0 CA-C-O 121.589 0.709 . . . . 72.530000000000001 111.118 -179.932 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.7 2.21 3.71 Favored 'Trans proline' 0 C--N 1.341 0.169 0 C-N-CA 122.671 2.247 . . . . 64.140000000000001 112.364 179.93 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 73' ' ' MET . . . . . 0.492 ' O ' ' CB ' ' A' ' 76' ' ' TYR . 0.1 OUTLIER -118.57 -25.84 6.33 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.208 -0.451 . . . . 75.099999999999994 110.884 179.943 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 74' ' ' TYR . . . . . 0.658 ' CD1' ' C ' ' A' ' 74' ' ' TYR . 0.0 OUTLIER -47.66 150.45 1.8 Allowed Pre-proline 0 C--N 1.329 -0.316 0 CA-C-O 121.697 0.76 . . . . 75.120000000000005 110.915 -179.875 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 75' ' ' PRO . . . . . 0.557 ' HA ' ' CD2' ' A' ' 74' ' ' TYR . 53.4 Cg_endo -69.76 -10.97 11.76 Favored 'Cis proline' 0 C--N 1.341 0.182 0 C-N-CA 122.68 -1.8 . . . . 72.420000000000002 112.348 -0.038 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 76' ' ' TYR . . . . . 0.492 ' CB ' ' O ' ' A' ' 73' ' ' MET . 25.0 t80 -34.03 -52.21 0.44 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.189 -0.459 . . . . 73.040000000000006 110.934 -179.879 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 31.0 p -106.46 -175.74 2.88 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.075 -0.511 . . . . 75.120000000000005 111.066 -179.938 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -100.96 132.37 22.13 Favored Pre-proline 0 C--N 1.329 -0.306 0 CA-C-O 121.552 0.691 . . . . 61.229999999999997 111.08 179.89 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.71 -167.52 0.23 Allowed 'Trans proline' 0 C--N 1.341 0.155 0 C-N-CA 122.672 2.248 . . . . 71.430000000000007 112.339 179.969 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . 0.414 ' HG3' ' N ' ' A' ' 81' ' ' ILE . 1.7 tt0 -130.0 142.63 50.61 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.164 -0.471 . . . . 61.229999999999997 110.905 -179.983 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 81' ' ' ILE . . . . . 0.414 ' N ' ' HG3' ' A' ' 80' ' ' GLU . 6.1 mm -133.94 141.68 43.31 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.18 -0.464 . . . . 71.129999999999995 111.135 -179.996 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . 0.459 ' HG3' ' CD ' ' A' ' 84' ' ' LYS . 3.5 pt-20 -147.44 140.3 24.94 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.211 -0.45 . . . . 75.430000000000007 110.878 179.995 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 83' ' ' PHE . . . . . 0.501 ' CE2' ' HD3' ' A' ' 98' ' ' LYS . 11.8 m-85 -95.71 140.98 29.74 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.114 -0.493 . . . . 73.120000000000005 110.847 -179.899 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 84' ' ' LYS . . . . . 0.459 ' CD ' ' HG3' ' A' ' 82' ' ' GLU . 9.8 mmmt -124.53 171.01 10.34 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.149 -0.478 . . . . 73.439999999999998 110.895 179.965 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . 0.557 ' N ' HD21 ' A' ' 85' ' ' ASN . 1.1 m-80 63.35 -73.17 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.241 -0.436 . . . . 74.150000000000006 110.891 179.899 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 86' ' ' VAL . . . . . 0.461 ' CG1' HD22 ' A' ' 94' ' ' LEU . 2.7 m 40.96 94.5 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.142 -0.481 . . . . 71.040000000000006 111.125 179.893 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -97.13 -83.29 0.39 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.136 -0.484 . . . . 74.400000000000006 110.946 179.98 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 88' ' ' ASN . . . . . 0.429 ' CG ' HG22 ' A' ' 60' ' ' VAL . 13.2 t30 -59.99 -40.46 89.26 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.209 -0.45 . . . . 73.430000000000007 110.879 -179.984 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 89' ' ' VAL . . . . . 0.462 HG23 ' N ' ' A' ' 90' ' ' MET . 0.9 OUTLIER -62.58 141.03 18.5 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.157 -0.474 . . . . 74.319999999999993 111.109 179.953 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 90' ' ' MET . . . . . 0.462 ' N ' HG23 ' A' ' 89' ' ' VAL . 6.8 mtm -97.22 -67.25 0.86 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.149 -0.478 . . . . 71.329999999999998 110.848 179.935 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 6.8 p-10 178.77 -32.4 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.249 -0.432 . . . . 74.409999999999997 110.889 179.997 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -54.55 -46.45 73.64 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.175 -0.466 . . . . 71.409999999999997 110.882 -179.757 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 93' ' ' GLN . . . . . 0.601 ' OE1' ' CE2' ' A' ' 128' ' ' PHE . 1.5 pt20 -70.87 -36.84 72.97 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.136 -0.484 . . . . 72.310000000000002 110.943 -179.98 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . 0.49 ' HG ' ' CD2' ' A' ' 83' ' ' PHE . 0.6 OUTLIER -57.66 -47.42 82.31 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.185 -0.461 . . . . 72.510000000000005 110.967 179.991 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 3.5 mm-40 -62.93 -34.09 76.73 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.193 -0.458 . . . . 73.409999999999997 110.913 179.89 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 96' ' ' MET . . . . . . . . . . . . . 19.1 ttp -59.95 -40.04 87.61 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.173 -0.467 . . . . 74.140000000000001 110.912 179.943 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 97' ' ' LEU . . . . . 0.599 ' O ' ' CD1' ' A' ' 101' ' ' PHE . 27.0 mt -68.02 -40.78 82.87 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.204 -0.453 . . . . 71.329999999999998 110.914 179.98 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 98' ' ' LYS . . . . . 0.501 ' HD3' ' CE2' ' A' ' 83' ' ' PHE . 3.7 mmtp -57.26 -36.52 71.08 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.178 -0.465 . . . . 71.319999999999993 110.899 179.857 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -68.93 -43.73 74.51 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.209 -0.45 . . . . 74.209999999999994 110.847 -179.897 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 37.3 mm-40 -66.82 -24.0 66.11 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.173 -0.467 . . . . 75.200000000000003 110.905 -179.959 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 101' ' ' PHE . . . . . 0.599 ' CD1' ' O ' ' A' ' 97' ' ' LEU . 11.1 m-30 -60.53 -37.08 80.03 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.148 -0.478 . . . . 74.340000000000003 110.917 -179.972 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 1.7 tmpt? -63.96 -40.22 95.93 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.112 -0.495 . . . . 75.319999999999993 110.878 -180.0 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 2.3 mppt? -69.48 -40.35 77.12 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.226 -0.443 . . . . 71.209999999999994 110.89 179.868 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 104' ' ' ILE . . . . . 0.455 ' O ' ' CG2' ' A' ' 107' ' ' THR . 4.3 mt -64.12 -47.62 89.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.218 -0.446 . . . . 72.409999999999997 111.08 179.913 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 105' ' ' HIS . . . . . 0.474 ' O ' ' N ' ' A' ' 109' ' ' ARG . 3.4 t60 -62.56 -41.28 98.81 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.207 -0.451 . . . . 72.109999999999999 110.854 179.898 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 1.3 t-20 -57.66 -36.95 72.58 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.244 -0.435 . . . . 75.040000000000006 110.905 -179.946 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 107' ' ' THR . . . . . 0.455 ' CG2' ' O ' ' A' ' 104' ' ' ILE . 5.1 t -84.93 -26.1 27.45 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.149 -0.478 . . . . 74.420000000000002 111.141 179.995 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 108' ' ' SER . . . . . 0.427 ' O ' ' N ' ' A' ' 110' ' ' GLY . 27.5 p -109.05 20.87 17.9 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.251 -0.431 . . . . 72.319999999999993 110.885 -179.893 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 109' ' ' ARG . . . . . 0.474 ' N ' ' O ' ' A' ' 105' ' ' HIS . 11.6 ttt180 -62.83 77.48 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.104 -0.498 . . . . 75.040000000000006 110.875 -179.926 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 110' ' ' GLY . . . . . 0.427 ' N ' ' O ' ' A' ' 108' ' ' SER . . . 136.67 33.55 0.23 Allowed Glycine 0 N--CA 1.451 -0.365 0 C-N-CA 120.745 -0.741 . . . . 73.439999999999998 112.488 -179.977 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 111' ' ' GLN . . . . . . . . . . . . . 3.9 pt20 -170.12 -166.27 0.53 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.735 0.302 . . . . 73.319999999999993 110.897 -179.898 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 15.2 mt-10 -68.98 129.98 41.46 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.218 -0.446 . . . . 74.030000000000001 110.914 -179.926 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 113' ' ' ILE . . . . . . . . . . . . . 22.4 pt -126.69 -8.15 4.83 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.202 -0.453 . . . . 74.209999999999994 111.139 179.947 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 114' ' ' ILE . . . . . 0.57 HG23 ' CE1' ' A' ' 68' ' ' PHE . 42.3 mm -64.88 -44.17 96.25 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-N 116.189 -0.46 . . . . 74.299999999999997 111.127 179.8 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 115' ' ' PHE . . . . . 0.554 ' CE1' HD12 ' A' ' 25' ' ' ILE . 19.2 t80 -68.85 -35.24 76.69 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.208 -0.451 . . . . 73.420000000000002 110.884 179.966 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 35.5 mm-40 -66.48 -46.03 77.69 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.127 -0.488 . . . . 73.219999999999999 110.877 -179.943 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 117' ' ' ILE . . . . . 0.515 HD12 ' CG ' ' A' ' 101' ' ' PHE . 0.4 OUTLIER -64.03 -40.81 90.38 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.149 -0.478 . . . . 74.209999999999994 111.168 179.983 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 118' ' ' THR . . . . . 0.474 ' N ' ' CG2' ' A' ' 117' ' ' ILE . 67.7 p -68.25 -41.56 80.98 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.129 -0.487 . . . . 71.329999999999998 111.136 179.974 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 1.2 t -67.98 -43.5 78.82 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.215 -0.448 . . . . 74.430000000000007 110.871 -179.852 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -66.64 -41.56 88.07 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.174 -0.466 . . . . 74.519999999999996 110.87 -179.971 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 11.9 p -67.66 -39.18 84.56 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.119 -0.491 . . . . 74.329999999999998 111.133 -179.926 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 59.1 tt0 -64.99 -50.64 65.53 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.245 -0.434 . . . . 74.349999999999994 110.899 -179.981 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 123' ' ' GLU . . . . . 0.437 ' HG3' ' N ' ' A' ' 124' ' ' LYS . 12.3 pt-20 -60.16 -36.38 77.43 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.173 -0.467 . . . . 62.299999999999997 110.882 -179.921 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 124' ' ' LYS . . . . . 0.478 ' HA ' ' CG ' ' A' ' 127' ' ' GLU . 0.0 OUTLIER -78.52 -32.36 47.99 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.144 -0.48 . . . . 71.430000000000007 110.91 179.942 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 125' ' ' LEU . . . . . 0.426 ' CD1' ' HB3' ' A' ' 62' ' ' SER . 0.5 OUTLIER -72.25 -41.48 66.74 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.217 -0.447 . . . . 74.340000000000003 110.952 179.903 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -70.37 -46.28 64.4 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.151 -0.477 . . . . 71.219999999999999 110.896 179.835 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 127' ' ' GLU . . . . . 0.571 ' CD ' ' N ' ' A' ' 128' ' ' PHE . 3.1 pp20? -59.15 -50.82 72.56 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.153 -0.476 . . . . 71.340000000000003 110.859 -179.91 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 128' ' ' PHE . . . . . 0.601 ' CE2' ' OE1' ' A' ' 93' ' ' GLN . 0.0 OUTLIER -59.41 -37.3 77.7 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.145 -0.479 . . . . 75.219999999999999 110.873 -179.881 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 129' ' ' GLN . . . . . 0.402 ' OE1' ' C ' ' A' ' 129' ' ' GLN . 1.1 tm0? -72.97 -18.54 61.36 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.122 -0.49 . . . . 73.209999999999994 110.885 -179.957 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 130' ' ' ASN . . . . . . . . . . . . . 44.8 t30 -58.05 -70.76 0.13 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.234 -0.439 . . . . 75.409999999999997 110.868 -179.889 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 131' ' ' VAL . . . . . 0.418 ' O ' ' C ' ' A' ' 132' ' ' VAL . 40.1 t -136.96 -32.76 0.36 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.177 -0.465 . . . . 72.150000000000006 111.148 179.878 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 132' ' ' VAL . . . . . 0.465 ' CG2' ' HA ' ' A' ' 128' ' ' PHE . 26.7 t -35.76 153.7 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 116.167 -0.469 . . . . 73.209999999999994 111.135 179.914 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 133' ' ' ASN . . . . . 0.453 ' C ' ' O ' ' A' ' 132' ' ' VAL . 0.8 OUTLIER -32.76 97.09 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.183 -0.462 . . . . 73.430000000000007 110.922 179.993 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 134' ' ' THR . . . . . 0.425 ' N ' ' O ' ' A' ' 132' ' ' VAL . 0.2 OUTLIER -98.8 -166.09 1.32 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.183 -0.462 . . . . 73.319999999999993 111.141 -179.975 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 5.6 tp60 -157.72 130.54 7.45 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.205 -0.452 . . . . 73.030000000000001 110.951 179.988 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 136' ' ' SER . . . . . 0.419 ' O ' ' C ' ' A' ' 137' ' ' LEU . 20.1 m -85.93 51.72 2.28 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.242 -0.435 . . . . 74.209999999999994 110.866 -179.792 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 137' ' ' LEU . . . . . 0.419 ' C ' ' O ' ' A' ' 136' ' ' SER . 0.4 OUTLIER 36.23 79.66 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.177 -0.465 . . . . 75.329999999999998 110.928 -179.954 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 14.9 pt-20 . . . . . 0 C--N 1.329 -0.293 0 CA-C-N 116.22 -0.446 . . . . 70.219999999999999 110.917 179.934 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 8' ' ' LEU . . . . . 0.687 HD13 ' O ' ' A' ' 72' ' ' PRO . 11.0 mt . . . . . 0 C--O 1.231 0.129 0 CA-C-O 120.845 0.355 . . . . 71.11 110.954 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 -53.02 -32.18 45.26 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.156 -0.475 . . . . 75.14 110.834 179.868 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 62.8 mm-40 -64.84 -38.42 90.92 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.193 -0.458 . . . . 60.5 110.893 -179.84 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 11' ' ' TYR . . . . . 0.421 ' CD1' ' HD2' ' A' ' 75' ' ' PRO . 20.7 m-85 -64.16 -25.18 67.97 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.183 -0.462 . . . . 74.12 110.946 -179.887 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -58.98 -37.4 76.72 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.142 -0.481 . . . . 74.23 110.926 -179.957 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 1.6 mm-40 -65.91 -43.35 88.44 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.125 -0.489 . . . . 73.44 110.909 179.978 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 4.3 mp -67.22 -43.24 88.44 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 116.135 -0.484 . . . . 61.1 111.152 179.968 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 15' ' ' GLN . . . . . 0.543 ' HB3' HG21 ' A' ' 46' ' ' ILE . 81.7 mt-30 -64.69 -46.28 83.03 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.152 -0.476 . . . . 73.21 110.911 179.965 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 38.9 t -60.96 -38.84 87.33 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.182 -0.463 . . . . 72.22 110.847 -179.931 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 1.5 m-20 -58.79 -33.87 70.83 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.172 -0.467 . . . . 74.03 110.899 -179.878 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 15.6 mt-10 -67.71 -38.59 83.81 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.16 -0.473 . . . . 63.22 110.865 -179.954 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.469 HD13 ' O ' ' A' ' 15' ' ' GLN . 9.8 mp -61.48 -51.68 67.67 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.176 -0.466 . . . . 75.03 110.932 179.989 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 2.5 pt-20 -68.86 -34.6 75.73 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.192 -0.458 . . . . 75.14 110.895 179.958 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -65.35 -45.79 82.77 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.142 -0.481 . . . . 72.53 111.114 179.948 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 22' ' ' ILE . . . . . 0.783 ' HA ' HD12 ' A' ' 25' ' ' ILE . 0.5 OUTLIER -77.2 -34.59 21.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.186 -0.461 . . . . 73.34 111.14 179.944 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -53.39 -35.59 60.53 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.177 -0.465 . . . . 75.4 110.841 179.98 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -66.79 -31.43 72.06 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.167 -0.47 . . . . 72.15 110.863 -179.77 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 25' ' ' ILE . . . . . 0.783 HD12 ' HA ' ' A' ' 22' ' ' ILE . 5.0 mt -79.72 -45.09 23.3 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.163 -0.472 . . . . 73.11 111.112 179.943 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 38.4 m-85 -111.51 45.73 1.18 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.187 -0.46 . . . . 74.31 110.928 -179.988 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 27' ' ' MET . . . . . 0.44 ' H ' ' HE2' ' A' ' 27' ' ' MET . 0.2 OUTLIER -40.85 -40.56 1.39 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.131 -0.486 . . . . 73.32 110.884 179.909 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 11.4 m-20 -106.07 -27.2 11.27 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.204 -0.453 . . . . 75.12 110.887 179.942 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 10.7 m-20 -85.05 29.57 0.64 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.196 -0.456 . . . . 73.04 110.853 179.998 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 30' ' ' PHE . . . . . 0.545 ' CD1' ' C ' ' A' ' 30' ' ' PHE . 0.3 OUTLIER -113.21 146.04 39.98 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.229 -0.442 . . . . 64.34 110.853 -179.929 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 42.5 m -122.89 132.9 54.38 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.117 -0.492 . . . . 64.01 111.17 -179.928 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -98.33 114.72 27.12 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.257 -0.428 . . . . 75.2 110.852 179.923 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.952 HD21 HG12 ' A' ' 47' ' ' ILE . 0.3 OUTLIER -120.53 -16.47 8.31 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.147 -0.479 . . . . 74.04 110.951 -179.982 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 34' ' ' THR . . . . . 0.787 ' N ' HD23 ' A' ' 33' ' ' LEU . 0.9 OUTLIER . . . . . 0 C--N 1.33 -0.273 0 CA-C-N 116.154 -0.476 . . . . 72.54 111.14 179.918 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 45' ' ' GLN . . . . . 0.614 ' HB3' HD12 ' A' ' 47' ' ' ILE . 12.4 tt0 . . . . . 0 C--O 1.23 0.063 0 CA-C-O 120.798 0.332 . . . . 73.34 110.957 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 46' ' ' ILE . . . . . 0.576 HG22 ' O ' ' A' ' 45' ' ' GLN . 0.0 OUTLIER 84.1 -28.26 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.147 -0.479 . . . . 72.43 111.134 179.958 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 47' ' ' ILE . . . . . 0.952 HG12 HD21 ' A' ' 33' ' ' LEU . 0.2 OUTLIER -43.32 148.3 0.21 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.157 -0.474 . . . . 74.21 111.12 179.866 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 48' ' ' PHE . . . . . 0.768 ' HA ' HD22 ' A' ' 33' ' ' LEU . 5.8 p90 -156.53 158.05 36.48 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.197 -0.456 . . . . 70.02 110.909 179.933 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 49' ' ' GLU . . . . . 0.701 ' CG ' HD13 ' A' ' 33' ' ' LEU . 40.1 mt-10 -108.99 152.0 25.56 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.128 -0.487 . . . . 73.23 110.846 -179.891 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 50' ' ' ILE . . . . . 0.458 HD13 ' HA ' ' A' ' 30' ' ' PHE . 23.2 mm -131.46 137.03 56.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.157 -0.474 . . . . 71.42 111.101 179.963 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 75.9 m -84.67 124.3 31.33 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.164 -0.471 . . . . 73.35 111.104 179.974 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 52' ' ' LEU . . . . . 0.63 HD12 HD22 ' A' ' 66' ' ' LEU . 20.7 mt -126.8 159.55 33.49 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.222 -0.445 . . . . 61.34 110.886 179.95 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 53' ' ' ARG . . . . . 0.517 ' C ' HD21 ' A' ' 125' ' ' LEU . 0.1 OUTLIER -179.88 168.23 1.31 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.166 -0.47 . . . . 74.45 110.931 179.944 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 54' ' ' SER . . . . . 0.659 ' N ' HD21 ' A' ' 125' ' ' LEU . 16.3 p -56.14 -173.26 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.22 -0.445 . . . . 44.42 110.869 -179.808 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 18.1 m -94.21 -28.1 4.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.135 -0.484 . . . . 74.2 111.105 179.94 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 1.6 t0 -121.55 -164.07 1.11 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.224 -0.444 . . . . 71.53 110.862 179.966 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 3.1 mmmm -118.39 -12.88 9.82 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.196 -0.456 . . . . 72.42 110.89 179.987 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 58' ' ' GLU . . . . . 0.563 ' HA ' ' C ' ' A' ' 59' ' ' PRO . 68.1 mt-10 -121.38 145.51 42.61 Favored Pre-proline 0 C--N 1.329 -0.287 0 CA-C-O 121.636 0.732 . . . . 73.04 110.895 179.972 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 59' ' ' PRO . . . . . 0.563 ' C ' ' HA ' ' A' ' 58' ' ' GLU . 53.7 Cg_endo -69.75 -9.42 10.98 Favored 'Cis proline' 0 C--O 1.231 0.172 0 C-N-CA 122.701 -1.791 . . . . 73.1 112.326 0.035 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 21.7 m -146.31 178.96 1.06 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.241 -0.436 . . . . 75.33 111.134 179.91 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 61' ' ' GLU . . . . . 0.458 ' O ' ' C ' ' A' ' 62' ' ' SER . 15.2 tt0 -108.04 -18.43 13.79 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.169 -0.469 . . . . 65.0 110.886 -179.933 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 62' ' ' SER . . . . . 0.458 ' C ' ' O ' ' A' ' 61' ' ' GLU . 0.9 OUTLIER 33.8 77.56 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.167 -0.47 . . . . 61.02 110.87 -179.794 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -102.87 126.76 50.15 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.143 -0.48 . . . . 63.43 110.849 -179.804 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 64' ' ' ILE . . . . . . . . . . . . . 21.1 mt -140.24 143.29 29.88 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 116.175 -0.466 . . . . 70.03 111.102 179.947 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 92.1 m -106.98 118.94 38.02 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.169 -0.469 . . . . 63.24 111.083 179.99 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 66' ' ' LEU . . . . . 0.71 HD21 HG21 ' A' ' 121' ' ' THR . 1.7 mp -100.09 114.0 27.03 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.198 -0.456 . . . . 70.2 110.924 179.913 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 67' ' ' HIS . . . . . 0.492 ' CE1' HD11 ' A' ' 33' ' ' LEU . 7.5 t60 -108.4 113.28 26.22 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.233 -0.44 . . . . 75.43 110.798 179.888 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 68' ' ' PHE . . . . . 0.56 ' CE1' HG23 ' A' ' 114' ' ' ILE . 0.0 OUTLIER -103.98 139.96 38.38 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.197 -0.456 . . . . 74.41 110.866 -179.937 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -119.66 119.46 33.79 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.135 -0.484 . . . . 73.03 111.108 179.94 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 70' ' ' MET . . . . . 0.491 ' CE ' HD11 ' A' ' 114' ' ' ILE . 2.5 mmt -84.25 89.41 7.33 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.223 -0.444 . . . . 74.41 110.919 179.946 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -45.02 157.76 0.32 Allowed Pre-proline 0 C--N 1.33 -0.274 0 CA-C-O 121.583 0.706 . . . . 71.13 111.124 -179.903 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 72' ' ' PRO . . . . . 0.687 ' O ' HD13 ' A' ' 8' ' ' LEU . 54.0 Cg_endo -69.77 2.87 3.15 Favored 'Trans proline' 0 C--N 1.341 0.173 0 C-N-CA 122.643 2.229 . . . . 53.01 112.368 179.899 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 73' ' ' MET . . . . . 0.486 ' O ' ' CB ' ' A' ' 76' ' ' TYR . 0.0 OUTLIER -117.7 -26.38 6.58 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.23 -0.441 . . . . 74.03 110.879 179.918 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 74' ' ' TYR . . . . . 0.637 ' CD1' ' C ' ' A' ' 74' ' ' TYR . 0.0 OUTLIER -47.14 148.71 1.95 Allowed Pre-proline 0 C--N 1.328 -0.327 0 CA-C-O 121.712 0.768 . . . . 64.13 110.915 -179.862 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 75' ' ' PRO . . . . . 0.561 ' C ' ' HA ' ' A' ' 74' ' ' TYR . 54.1 Cg_endo -69.78 -13.46 12.44 Favored 'Cis proline' 0 C--N 1.342 0.185 0 C-N-CA 122.67 -1.804 . . . . 74.14 112.361 -0.009 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 76' ' ' TYR . . . . . 0.486 ' CB ' ' O ' ' A' ' 73' ' ' MET . 9.4 t80 -34.95 -46.3 0.3 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.207 -0.452 . . . . 62.44 110.867 -179.866 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 77' ' ' THR . . . . . 0.449 HG23 ' CB ' ' A' ' 73' ' ' MET . 66.7 p -111.58 177.7 4.57 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.14 -0.482 . . . . 75.45 111.16 -179.953 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -98.33 135.03 21.39 Favored Pre-proline 0 C--N 1.328 -0.327 0 CA-C-O 121.578 0.704 . . . . 72.24 111.058 179.893 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 79' ' ' PRO . . . . . 0.806 ' HG3' HD11 ' A' ' 113' ' ' ILE . 53.5 Cg_endo -69.74 -167.27 0.22 Allowed 'Trans proline' 0 C--N 1.341 0.159 0 C-N-CA 122.667 2.245 . . . . 33.51 112.374 179.97 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -131.09 127.23 37.72 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.259 -0.428 . . . . 51.14 110.853 -179.97 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 81' ' ' ILE . . . . . 0.507 HD13 ' HA ' ' A' ' 68' ' ' PHE . 10.0 mm -119.54 140.59 43.03 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.144 -0.48 . . . . 74.33 111.202 179.9 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 82' ' ' GLU . . . . . 0.471 ' HG3' ' CD ' ' A' ' 84' ' ' LYS . 1.0 OUTLIER -146.27 137.92 24.79 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.229 -0.441 . . . . 71.23 110.908 179.969 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 83' ' ' PHE . . . . . 0.45 ' CD1' HD11 ' A' ' 66' ' ' LEU . 9.9 m-85 -93.48 140.0 30.08 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.158 -0.474 . . . . 71.34 110.871 -179.919 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 84' ' ' LYS . . . . . 0.471 ' CD ' ' HG3' ' A' ' 82' ' ' GLU . 10.6 mmmt -123.78 172.0 9.2 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.14 -0.482 . . . . 74.13 110.914 179.956 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 85' ' ' ASN . . . . . 0.422 ' C ' HG22 ' A' ' 86' ' ' VAL . 4.2 m120 62.8 -74.19 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.23 -0.441 . . . . 74.11 110.947 179.971 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 86' ' ' VAL . . . . . 0.522 HG12 HD21 ' A' ' 94' ' ' LEU . 3.5 m 41.54 91.15 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.158 -0.473 . . . . 74.44 111.078 179.859 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -97.19 -85.72 0.35 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.179 -0.464 . . . . 72.54 110.893 179.979 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -52.58 -46.38 66.87 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.222 -0.444 . . . . 74.3 110.865 -179.943 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 89' ' ' VAL . . . . . 0.479 HG21 ' CD2' ' A' ' 94' ' ' LEU . 0.7 OUTLIER -60.45 141.38 17.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.221 -0.445 . . . . 71.12 111.154 179.926 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 90' ' ' MET . . . . . 0.432 ' C ' ' OD1' ' A' ' 91' ' ' ASP . 7.6 mtm -95.71 -54.76 3.24 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.181 -0.463 . . . . 75.14 110.895 179.979 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 91' ' ' ASP . . . . . 0.432 ' OD1' ' C ' ' A' ' 90' ' ' MET . 1.3 p-10 175.36 -34.58 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.184 -0.462 . . . . 63.5 110.874 179.911 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -54.55 -40.27 68.53 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.238 -0.437 . . . . 74.22 110.826 -179.77 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 93' ' ' GLN . . . . . 0.577 ' HG3' ' CZ ' ' A' ' 128' ' ' PHE . 0.0 OUTLIER -70.98 -37.46 72.74 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.134 -0.484 . . . . 70.43 110.95 -179.979 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 94' ' ' LEU . . . . . 0.522 HD21 HG12 ' A' ' 86' ' ' VAL . 39.5 mt -65.58 -49.21 69.68 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.187 -0.461 . . . . 75.12 110.941 179.95 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 41.2 mt-30 -65.91 -34.02 77.17 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.141 -0.481 . . . . 65.15 110.904 179.937 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 96' ' ' MET . . . . . . . . . . . . . 2.3 ttp -60.08 -41.15 91.83 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.194 -0.457 . . . . 75.23 110.839 -179.971 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 97' ' ' LEU . . . . . 0.855 HD22 HG22 ' A' ' 121' ' ' THR . 34.3 mt -65.99 -39.69 90.52 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.201 -0.454 . . . . 63.43 110.871 -179.941 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 98' ' ' LYS . . . . . 0.411 ' HD3' ' CZ ' ' A' ' 83' ' ' PHE . 3.2 mmtp -55.31 -39.33 69.8 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.19 -0.459 . . . . 74.22 110.892 179.846 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -66.24 -37.84 86.46 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.239 -0.437 . . . . 44.22 110.89 -179.917 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 100' ' ' GLU . . . . . 0.611 ' O ' HD12 ' A' ' 104' ' ' ILE . 2.4 mm-40 -74.14 -24.57 59.44 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.113 -0.494 . . . . 64.24 110.818 -179.924 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 101' ' ' PHE . . . . . 0.621 ' CD2' HD11 ' A' ' 117' ' ' ILE . 10.8 m-30 -59.38 -26.88 65.48 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.222 -0.444 . . . . 73.12 110.935 -179.929 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.27 -42.98 64.97 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.107 -0.497 . . . . 64.51 110.899 179.968 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.76 -40.87 84.0 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.213 -0.449 . . . . 64.34 110.917 179.862 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 104' ' ' ILE . . . . . 0.66 HD11 ' CD2' ' A' ' 120' ' ' PHE . 2.6 mt -63.55 -47.6 90.74 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.225 -0.443 . . . . 72.35 111.111 179.863 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 105' ' ' HIS . . . . . 0.478 ' O ' ' N ' ' A' ' 109' ' ' ARG . 28.2 t-80 -62.89 -42.51 99.8 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.148 -0.478 . . . . 71.51 110.888 179.912 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -56.52 -40.9 75.81 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.164 -0.471 . . . . 74.02 110.865 -179.924 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 107' ' ' THR . . . . . 0.449 HG22 ' O ' ' A' ' 104' ' ' ILE . 8.0 t -80.47 -31.18 37.42 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.222 -0.444 . . . . 55.34 111.146 -179.97 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 108' ' ' SER . . . . . 0.706 ' HB3' HG22 ' A' ' 113' ' ' ILE . 0.5 OUTLIER -103.9 21.91 15.48 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.201 -0.454 . . . . 43.44 110.877 -179.901 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 109' ' ' ARG . . . . . 0.478 ' N ' ' O ' ' A' ' 105' ' ' HIS . 0.0 OUTLIER -62.0 84.9 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.125 -0.488 . . . . 71.34 110.846 -179.93 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 110' ' ' GLY . . . . . 0.443 ' HA2' ' CB ' ' A' ' 75' ' ' PRO . . . 134.19 -23.15 3.7 Favored Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.705 -0.759 . . . . 65.22 112.452 179.988 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 111' ' ' GLN . . . . . . . . . . . . . 2.6 pt20 -109.06 -171.81 1.92 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.757 0.313 . . . . 73.53 110.894 -179.858 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 20.1 mt-10 -66.03 134.55 53.13 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.181 -0.463 . . . . 75.54 110.905 -179.987 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 113' ' ' ILE . . . . . 0.806 HD11 ' HG3' ' A' ' 79' ' ' PRO . 24.8 pt -123.23 -7.8 7.88 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.172 -0.467 . . . . 75.23 111.154 179.915 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 114' ' ' ILE . . . . . 0.83 ' O ' HG23 ' A' ' 118' ' ' THR . 28.6 mm -64.18 -44.19 97.46 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.161 -0.472 . . . . 73.21 111.101 179.865 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 115' ' ' PHE . . . . . 0.716 ' CD1' HD13 ' A' ' 25' ' ' ILE . 28.2 t80 -72.08 -36.9 69.65 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.194 -0.457 . . . . 71.44 110.864 179.99 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 50.2 mm-40 -65.93 -47.63 74.08 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.165 -0.47 . . . . 72.13 110.868 -179.927 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 117' ' ' ILE . . . . . 0.621 HD11 ' CD2' ' A' ' 101' ' ' PHE . 0.9 OUTLIER -64.26 -41.55 92.74 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.19 -0.459 . . . . 51.34 111.127 179.965 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 118' ' ' THR . . . . . 0.83 HG23 ' O ' ' A' ' 114' ' ' ILE . 71.1 p -68.03 -42.55 80.44 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.192 -0.458 . . . . 74.33 111.14 179.975 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 2.8 m -66.88 -43.48 83.4 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.249 -0.432 . . . . 54.25 110.861 -179.859 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 120' ' ' PHE . . . . . 0.66 ' CD2' HD11 ' A' ' 104' ' ' ILE . 0.3 OUTLIER -61.78 -47.65 84.23 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.115 -0.493 . . . . 73.22 110.871 -179.941 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 121' ' ' THR . . . . . 0.855 HG22 HD22 ' A' ' 97' ' ' LEU . 73.4 p -67.81 -40.76 83.83 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.13 -0.486 . . . . 61.14 111.116 -179.893 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 47.6 tt0 -64.3 -48.8 74.26 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.203 -0.453 . . . . 55.35 110.896 -179.94 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 123' ' ' GLU . . . . . 0.54 ' CG ' ' N ' ' A' ' 124' ' ' LYS . 3.5 pt-20 -61.84 -50.54 71.85 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.194 -0.457 . . . . 74.24 110.855 -179.929 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 124' ' ' LYS . . . . . 0.54 ' N ' ' CG ' ' A' ' 123' ' ' GLU . 0.0 OUTLIER -65.6 -37.18 85.88 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.159 -0.473 . . . . 63.34 110.871 -179.991 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 125' ' ' LEU . . . . . 0.659 HD21 ' N ' ' A' ' 54' ' ' SER . 1.1 tp -64.34 -51.5 63.09 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.249 -0.432 . . . . 71.54 110.912 179.901 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -57.2 -45.4 83.82 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.212 -0.449 . . . . 62.41 110.878 179.86 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 127' ' ' GLU . . . . . 0.448 ' HG3' ' N ' ' A' ' 128' ' ' PHE . 0.4 OUTLIER -61.27 -29.39 69.82 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.218 -0.446 . . . . 74.22 110.851 -179.885 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 128' ' ' PHE . . . . . 0.577 ' CZ ' ' HG3' ' A' ' 93' ' ' GLN . 0.3 OUTLIER . . . . . 0 C--N 1.329 -0.323 0 CA-C-N 116.18 -0.463 . . . . 71.31 110.863 -179.942 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 8' ' ' LEU . . . . . 0.532 HD13 ' O ' ' A' ' 72' ' ' PRO . 24.4 mt . . . . . 0 C--O 1.231 0.101 0 CA-C-O 120.798 0.333 . . . . 61.24 110.93 . . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -49.93 -34.08 19.47 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.195 -0.457 . . . . 73.12 110.868 179.794 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 7.0 mm100 -68.11 -39.26 82.84 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.181 -0.463 . . . . 53.52 110.847 -179.863 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 18.2 m-85 -58.9 -27.41 65.2 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.229 -0.441 . . . . 70.41 110.927 -179.858 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -60.72 -37.12 80.66 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.146 -0.479 . . . . 74.12 110.907 -179.906 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 3.1 mm-40 -58.58 -43.35 89.44 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.142 -0.481 . . . . 72.12 110.901 179.974 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 3.1 mp -66.06 -43.02 92.56 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.123 -0.489 . . . . 75.11 111.157 179.963 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 15' ' ' GLN . . . . . 0.49 ' HB3' HG21 ' A' ' 46' ' ' ILE . 73.0 mt-30 -62.62 -42.2 99.45 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.165 -0.47 . . . . 71.32 110.907 179.943 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -61.1 -42.02 97.76 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.187 -0.46 . . . . 73.23 110.89 -179.948 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 1.5 m-20 -59.04 -33.72 71.08 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.165 -0.47 . . . . 43.43 110.9 -179.889 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 1.7 mt-10 -64.74 -37.89 89.15 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.18 -0.464 . . . . 73.24 110.866 -179.966 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.407 ' CD2' HG13 ' A' ' 46' ' ' ILE . 7.2 mp -66.15 -51.61 56.27 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.159 -0.473 . . . . 73.33 110.93 -179.989 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -68.74 -33.35 73.76 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.171 -0.468 . . . . 73.52 110.925 179.923 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -66.44 -50.57 62.92 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.109 -0.496 . . . . 63.33 111.121 179.919 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 22' ' ' ILE . . . . . 0.75 HD11 ' HB2' ' A' ' 115' ' ' PHE . 0.5 OUTLIER -73.37 -37.15 50.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.201 -0.454 . . . . 72.52 111.176 179.968 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 30.8 mtp180 -52.79 -34.5 53.72 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.131 -0.486 . . . . 71.4 110.918 179.937 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -66.75 -31.2 71.69 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.187 -0.461 . . . . 61.2 110.844 -179.799 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 25' ' ' ILE . . . . . 0.771 HG21 ' HE1' ' A' ' 115' ' ' PHE . 3.5 mt -85.08 -44.5 17.33 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.142 -0.481 . . . . 52.34 111.123 179.926 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 27.7 m-85 -107.06 42.76 1.25 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.202 -0.453 . . . . 74.34 110.888 -179.925 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 1.9 mtm -41.29 -45.82 3.06 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.096 -0.502 . . . . 65.35 110.902 179.891 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -101.68 -14.23 17.46 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.202 -0.453 . . . . 70.2 110.878 179.928 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 3.1 m-20 -97.66 21.03 10.92 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.182 -0.463 . . . . 72.52 110.873 179.984 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 30' ' ' PHE . . . . . 0.75 ' HA ' HD13 ' A' ' 50' ' ' ILE . 5.4 t80 -109.87 137.23 47.95 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.204 -0.453 . . . . 73.31 110.878 -179.916 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 59.3 m -116.51 134.8 54.43 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.134 -0.485 . . . . 70.31 111.156 -179.914 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 32' ' ' ASP . . . . . 0.456 ' O ' ' CG ' ' A' ' 32' ' ' ASP . 0.0 OUTLIER -99.22 117.34 33.47 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.225 -0.443 . . . . 74.42 110.867 179.89 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.916 HD21 HG12 ' A' ' 47' ' ' ILE . 0.2 OUTLIER -121.19 -21.4 6.42 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.194 -0.457 . . . . 71.24 110.918 -179.972 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 34' ' ' THR . . . . . 0.896 ' N ' HD23 ' A' ' 33' ' ' LEU . 0.6 OUTLIER . . . . . 0 C--N 1.329 -0.302 0 CA-C-N 116.204 -0.453 . . . . 71.12 111.108 179.918 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 45' ' ' GLN . . . . . 0.567 ' O ' HG22 ' A' ' 46' ' ' ILE . 15.7 tt0 . . . . . 0 C--O 1.231 0.114 0 CA-C-O 120.807 0.337 . . . . 70.12 110.908 . . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 46' ' ' ILE . . . . . 0.567 HG22 ' O ' ' A' ' 45' ' ' GLN . 0.2 OUTLIER 83.57 -29.55 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.21 -0.45 . . . . 73.44 111.163 -179.991 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 47' ' ' ILE . . . . . 0.916 HG12 HD21 ' A' ' 33' ' ' LEU . 0.2 OUTLIER -45.1 146.14 0.44 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.151 -0.477 . . . . 63.2 111.145 179.827 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 48' ' ' PHE . . . . . 0.854 ' HA ' HD22 ' A' ' 33' ' ' LEU . 5.3 p90 -150.82 163.09 39.47 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.157 -0.474 . . . . 55.01 110.881 179.964 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 49' ' ' GLU . . . . . 0.818 ' HG3' HD13 ' A' ' 33' ' ' LEU . 33.5 mt-10 -108.87 149.57 28.93 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.147 -0.478 . . . . 60.14 110.863 -179.9 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 50' ' ' ILE . . . . . 0.75 HD13 ' HA ' ' A' ' 30' ' ' PHE . 6.2 mm -131.74 136.27 57.35 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.138 -0.483 . . . . 65.23 111.098 179.982 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 50.7 m -83.75 130.96 34.95 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.172 -0.467 . . . . 54.21 111.157 179.947 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 52' ' ' LEU . . . . . 0.673 HD12 HD12 ' A' ' 66' ' ' LEU . 12.6 mt -133.46 156.44 47.73 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.221 -0.445 . . . . 73.23 110.898 179.962 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -175.09 168.06 3.45 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.207 -0.451 . . . . 71.31 110.916 179.977 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 1.7 m -60.88 168.21 2.47 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.207 -0.452 . . . . 74.53 110.859 -179.837 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 35.0 m -80.54 -29.58 12.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.137 -0.483 . . . . 74.31 111.089 179.943 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -114.56 -169.69 1.59 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.214 -0.448 . . . . 44.2 110.873 179.944 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 5.1 mmmt -115.64 -21.93 9.45 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.2 -0.455 . . . . 73.53 110.92 179.998 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 58' ' ' GLU . . . . . 0.548 ' HA ' ' C ' ' A' ' 59' ' ' PRO . 8.3 pt-20 -113.6 144.49 31.47 Favored Pre-proline 0 C--N 1.33 -0.258 0 CA-C-O 121.65 0.738 . . . . 54.03 110.913 179.932 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 59' ' ' PRO . . . . . 0.548 ' C ' ' HA ' ' A' ' 58' ' ' GLU . 53.6 Cg_endo -69.77 -7.39 9.97 Favored 'Cis proline' 0 C--N 1.341 0.144 0 C-N-CA 122.646 -1.814 . . . . 75.31 112.348 -0.036 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 60' ' ' VAL . . . . . 0.479 ' HB ' ' ND2' ' A' ' 88' ' ' ASN . 13.2 m -154.37 -179.92 0.3 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.176 -0.465 . . . . 74.31 111.122 179.877 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 61' ' ' GLU . . . . . 0.464 ' O ' ' C ' ' A' ' 62' ' ' SER . 1.2 pt-20 -112.83 -16.25 12.77 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.171 -0.468 . . . . 62.32 110.909 -179.953 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 62' ' ' SER . . . . . 0.464 ' C ' ' O ' ' A' ' 61' ' ' GLU . 0.3 OUTLIER 33.14 91.54 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.126 -0.488 . . . . 52.03 110.867 -179.825 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 3.9 m -102.93 123.13 45.97 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.106 -0.497 . . . . 60.42 110.88 -179.832 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 64' ' ' ILE . . . . . 0.602 HD13 HD11 ' A' ' 94' ' ' LEU . 13.9 mt -138.15 150.94 24.74 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.142 -0.481 . . . . 73.04 111.156 179.944 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 65' ' ' THR . . . . . 0.573 HG23 ' O ' ' A' ' 50' ' ' ILE . 39.1 m -120.89 115.17 22.71 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.18 -0.464 . . . . 71.03 111.124 179.942 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 66' ' ' LEU . . . . . 0.716 HD11 HG21 ' A' ' 121' ' ' THR . 19.2 mt -90.95 110.77 22.02 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.192 -0.458 . . . . 54.22 110.944 179.96 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 9.1 t60 -100.92 114.52 28.46 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.21 -0.45 . . . . 74.33 110.855 179.892 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 68' ' ' PHE . . . . . 0.579 ' CG ' HD12 ' A' ' 114' ' ' ILE . 0.0 OUTLIER -105.17 141.13 37.26 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.195 -0.457 . . . . 73.4 110.885 -179.953 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -120.5 117.14 26.89 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.133 -0.485 . . . . 63.35 111.066 179.94 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 70' ' ' MET . . . . . 0.451 ' HE2' HD11 ' A' ' 114' ' ' ILE . 1.4 mmt -84.11 93.72 8.19 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.192 -0.458 . . . . 70.13 110.881 179.986 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -51.13 159.2 1.08 Allowed Pre-proline 0 C--N 1.329 -0.283 0 CA-C-O 121.582 0.706 . . . . 71.14 111.154 -179.922 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 72' ' ' PRO . . . . . 0.532 ' O ' HD13 ' A' ' 8' ' ' LEU . 53.9 Cg_endo -69.72 -4.5 14.12 Favored 'Trans proline' 0 C--O 1.231 0.174 0 C-N-CA 122.711 2.274 . . . . 65.02 112.339 179.973 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 73' ' ' MET . . . . . 0.527 ' HB3' HG23 ' A' ' 77' ' ' THR . 0.0 OUTLIER -109.28 -24.21 11.2 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.203 -0.453 . . . . 72.3 110.852 179.942 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 74' ' ' TYR . . . . . 0.651 ' CD1' ' C ' ' A' ' 74' ' ' TYR . 0.0 OUTLIER -48.29 150.75 2.1 Favored Pre-proline 0 C--N 1.328 -0.342 0 CA-C-O 121.688 0.756 . . . . 62.43 110.931 -179.859 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 75' ' ' PRO . . . . . 0.556 ' C ' ' HA ' ' A' ' 74' ' ' TYR . 54.2 Cg_endo -69.72 -11.69 11.89 Favored 'Cis proline' 0 C--N 1.341 0.171 0 C-N-CA 122.698 -1.792 . . . . 72.21 112.367 -0.124 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 76' ' ' TYR . . . . . 0.476 ' CB ' ' O ' ' A' ' 73' ' ' MET . 10.4 t80 -35.27 -52.88 0.62 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.221 -0.445 . . . . 64.01 110.969 -179.943 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 77' ' ' THR . . . . . 0.527 HG23 ' HB3' ' A' ' 73' ' ' MET . 53.2 p -101.39 175.3 5.62 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.087 -0.506 . . . . 75.51 111.139 -179.961 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -98.86 131.36 25.74 Favored Pre-proline 0 C--N 1.329 -0.288 0 CA-C-O 121.554 0.692 . . . . 72.14 111.079 179.884 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 79' ' ' PRO . . . . . 0.747 ' HG3' HD11 ' A' ' 113' ' ' ILE . 53.7 Cg_endo -69.77 176.84 6.23 Favored 'Trans proline' 0 C--N 1.341 0.171 0 C-N-CA 122.668 2.246 . . . . 74.05 112.369 179.957 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 2.0 tt0 -111.66 133.44 53.91 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.234 -0.439 . . . . 70.31 110.951 179.996 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 81' ' ' ILE . . . . . 0.473 HD13 ' HA ' ' A' ' 68' ' ' PHE . 10.0 mm -124.08 127.25 73.37 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.157 -0.474 . . . . 61.54 111.182 179.988 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 82' ' ' GLU . . . . . 0.478 ' HG3' ' CD ' ' A' ' 84' ' ' LYS . 7.3 pt-20 -135.07 142.13 46.24 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.22 -0.445 . . . . 74.14 110.902 179.975 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 83' ' ' PHE . . . . . 0.663 ' CE1' HD21 ' A' ' 66' ' ' LEU . 31.1 m-85 -93.23 140.88 29.04 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.165 -0.471 . . . . 71.22 110.839 -179.884 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 84' ' ' LYS . . . . . 0.478 ' CD ' ' HG3' ' A' ' 82' ' ' GLU . 9.7 mmmt -123.66 170.36 10.55 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.137 -0.483 . . . . 53.53 110.936 179.964 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 85' ' ' ASN . . . . . 0.44 ' O ' ' C ' ' A' ' 86' ' ' VAL . 6.1 m120 62.92 -73.38 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.22 -0.446 . . . . 73.31 110.891 179.946 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 86' ' ' VAL . . . . . 1.096 HG11 HD21 ' A' ' 94' ' ' LEU . 6.4 m 34.94 90.67 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.131 -0.486 . . . . 75.1 111.166 179.942 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -101.92 -84.74 0.44 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.17 -0.468 . . . . 72.4 110.911 -179.954 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 88' ' ' ASN . . . . . 0.479 ' ND2' ' HB ' ' A' ' 60' ' ' VAL . 27.8 m120 -49.5 -40.21 36.72 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.185 -0.461 . . . . 74.35 110.856 -179.913 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 89' ' ' VAL . . . . . 0.813 HG21 HD13 ' A' ' 94' ' ' LEU . 2.4 p -68.17 139.08 21.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.167 -0.47 . . . . 43.21 111.119 179.909 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 90' ' ' MET . . . . . . . . . . . . . 5.4 mtm -87.22 -67.43 0.82 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.155 -0.475 . . . . 73.45 110.892 179.91 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -178.77 -30.44 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.21 -0.45 . . . . 73.33 110.832 179.954 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -53.79 -42.72 68.63 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.198 -0.456 . . . . 74.3 110.861 -179.775 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -69.92 -40.11 75.73 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.136 -0.484 . . . . 73.45 110.94 -179.985 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 94' ' ' LEU . . . . . 1.096 HD21 HG11 ' A' ' 86' ' ' VAL . 0.1 OUTLIER -59.52 -46.3 89.26 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.208 -0.451 . . . . 63.4 110.95 179.997 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 9.9 mm-40 -64.89 -38.88 92.45 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.129 -0.487 . . . . 64.54 110.951 179.907 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 96' ' ' MET . . . . . 0.561 ' SD ' ' CE1' ' A' ' 128' ' ' PHE . 19.8 ttp -61.06 -36.96 80.99 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.178 -0.465 . . . . 64.41 110.856 179.965 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 97' ' ' LEU . . . . . 1.015 HD22 HG22 ' A' ' 121' ' ' THR . 90.3 mt -62.2 -42.45 99.3 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.221 -0.445 . . . . 54.24 110.902 -179.942 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 98' ' ' LYS . . . . . 0.578 ' HA ' ' CD2' ' A' ' 101' ' ' PHE . 13.2 mmtm -54.86 -44.56 74.11 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.181 -0.463 . . . . 72.22 110.872 179.845 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 66.3 m -57.63 -39.23 76.5 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.253 -0.43 . . . . 60.13 110.836 -179.897 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 100' ' ' GLU . . . . . 0.569 ' O ' HD12 ' A' ' 104' ' ' ILE . 3.6 mm-40 -71.36 -26.67 62.9 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.177 -0.465 . . . . 72.4 110.879 -179.928 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 101' ' ' PHE . . . . . 0.591 ' CD1' ' O ' ' A' ' 97' ' ' LEU . 8.7 m-30 -59.38 -30.36 68.37 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.147 -0.479 . . . . 65.44 110.937 -179.963 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 1.4 tmpt? -71.56 -40.76 69.77 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.113 -0.494 . . . . 75.53 110.882 179.98 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 3.2 tmmm? -70.35 -43.25 70.57 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.227 -0.442 . . . . 65.22 110.88 179.913 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 104' ' ' ILE . . . . . 0.569 HD12 ' O ' ' A' ' 100' ' ' GLU . 3.0 mt -62.36 -47.5 92.74 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.202 -0.454 . . . . 72.42 111.159 179.861 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 105' ' ' HIS . . . . . 0.409 ' O ' ' N ' ' A' ' 109' ' ' ARG . 14.4 t-80 -62.53 -41.78 99.09 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.151 -0.477 . . . . 72.41 110.874 179.851 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 1.1 t-20 -58.03 -42.35 85.13 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.218 -0.446 . . . . 73.34 110.902 -179.978 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 107' ' ' THR . . . . . 0.457 HG22 ' O ' ' A' ' 104' ' ' ILE . 8.0 t -77.95 -35.55 50.24 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.157 -0.474 . . . . 71.32 111.159 -179.996 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 108' ' ' SER . . . . . 0.524 ' HB2' HG22 ' A' ' 113' ' ' ILE . 19.8 m -103.97 29.96 5.51 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.21 -0.45 . . . . 73.33 110.865 -179.871 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 109' ' ' ARG . . . . . 0.409 ' N ' ' O ' ' A' ' 105' ' ' HIS . 26.1 ttt180 -72.13 80.64 0.96 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.133 -0.485 . . . . 60.14 110.872 -179.956 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 141.15 -9.23 2.72 Favored Glycine 0 N--CA 1.452 -0.254 0 C-N-CA 120.699 -0.763 . . . . 44.44 112.477 -179.971 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 111' ' ' GLN . . . . . . . . . . . . . 9.2 pt20 -126.44 -161.68 1.08 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.761 0.315 . . . . 52.22 110.921 -179.873 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 33.7 mt-10 -70.86 134.22 47.12 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.219 -0.446 . . . . 72.53 110.862 -179.95 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 113' ' ' ILE . . . . . 0.747 HD11 ' HG3' ' A' ' 79' ' ' PRO . 31.1 pt -126.65 -11.31 4.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.149 -0.478 . . . . 24.33 111.161 179.972 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 114' ' ' ILE . . . . . 0.776 ' O ' HG23 ' A' ' 118' ' ' THR . 33.7 mm -61.87 -45.72 98.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.156 -0.475 . . . . 53.3 111.136 179.855 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 115' ' ' PHE . . . . . 0.771 ' HE1' HG21 ' A' ' 25' ' ' ILE . 13.1 t80 -72.51 -32.65 66.32 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.171 -0.468 . . . . 74.44 110.932 179.9 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 42.9 mm-40 -67.45 -47.65 69.53 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.105 -0.498 . . . . 43.3 110.901 -179.971 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 117' ' ' ILE . . . . . 0.478 ' CG2' ' N ' ' A' ' 118' ' ' THR . 0.8 OUTLIER -64.15 -41.92 93.95 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.142 -0.481 . . . . 71.43 111.111 179.979 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 118' ' ' THR . . . . . 0.776 HG23 ' O ' ' A' ' 114' ' ' ILE . 46.7 p -67.85 -42.43 81.37 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.201 -0.454 . . . . 71.23 111.158 179.958 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 6.8 m -66.14 -43.96 85.54 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.245 -0.434 . . . . 70.42 110.838 -179.842 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 120' ' ' PHE . . . . . 0.506 ' CG ' HD11 ' A' ' 104' ' ' ILE . 0.2 OUTLIER -62.11 -49.97 73.8 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.161 -0.472 . . . . 73.33 110.883 -179.979 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 121' ' ' THR . . . . . 1.015 HG22 HD22 ' A' ' 97' ' ' LEU . 53.5 p -63.28 -39.3 94.21 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.141 -0.481 . . . . 61.45 111.169 -179.96 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -64.49 -46.33 83.49 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.201 -0.454 . . . . 72.34 110.945 179.999 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 4.8 pt-20 -70.99 -38.19 72.71 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.219 -0.446 . . . . 73.45 110.842 -179.968 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 124' ' ' LYS . . . . . 0.441 ' HA ' ' CE ' ' A' ' 124' ' ' LYS . 0.2 OUTLIER -74.51 -29.93 61.59 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.218 -0.446 . . . . 53.42 110.902 -179.999 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 125' ' ' LEU . . . . . 0.847 ' O ' HD12 ' A' ' 125' ' ' LEU . 0.9 OUTLIER -68.34 -46.36 70.38 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.221 -0.445 . . . . 74.22 110.92 179.945 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 6.4 m-20 -59.84 -37.43 79.23 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.214 -0.448 . . . . 70.24 110.85 179.819 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 3.0 mm-40 -60.41 -49.74 76.36 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.198 -0.455 . . . . 72.24 110.947 -179.931 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 128' ' ' PHE . . . . . 0.561 ' CE1' ' SD ' ' A' ' 96' ' ' MET . 11.3 m-85 . . . . . 0 C--N 1.329 -0.323 0 CA-C-N 116.124 -0.489 . . . . 73.1 110.856 -179.949 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 44.2 mt . . . . . 0 C--O 1.232 0.148 0 CA-C-O 120.817 0.341 . . . . 62.51 110.93 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -49.96 -30.6 10.72 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.217 -0.447 . . . . 73.14 110.847 179.863 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 5.1 mm100 -68.09 -40.01 82.72 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.213 -0.449 . . . . 73.05 110.884 -179.902 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 22.8 m-85 -61.9 -26.95 68.47 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.197 -0.456 . . . . 74.33 110.88 -179.805 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -58.96 -37.66 77.28 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.158 -0.474 . . . . 72.11 110.937 -179.958 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 2.2 mm-40 -63.07 -42.9 99.78 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.167 -0.47 . . . . 71.31 110.877 -179.97 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 3.8 mp -65.92 -41.99 91.03 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.163 -0.471 . . . . 73.23 111.126 179.989 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 15' ' ' GLN . . . . . 0.444 ' HB3' HG21 ' A' ' 46' ' ' ILE . 47.5 mt-30 -65.42 -44.02 88.68 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.199 -0.455 . . . . 73.23 110.897 179.944 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 1.7 t -62.35 -38.29 88.93 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.203 -0.453 . . . . 75.15 110.924 -179.952 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 1.6 m-20 -58.08 -33.9 69.56 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.126 -0.488 . . . . 65.41 110.896 -179.921 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 4.1 mt-10 -67.14 -39.1 86.51 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.165 -0.471 . . . . 73.11 110.859 -179.946 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.438 ' CD2' HG13 ' A' ' 46' ' ' ILE . 8.7 mp -63.87 -51.25 65.48 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.203 -0.453 . . . . 53.13 110.869 -179.941 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -68.51 -35.84 78.04 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.184 -0.462 . . . . 73.33 110.886 179.938 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -66.64 -50.36 63.21 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.133 -0.485 . . . . 74.43 111.137 179.907 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 22' ' ' ILE . . . . . 0.525 ' HA ' HD12 ' A' ' 25' ' ' ILE . 0.8 OUTLIER -73.12 -34.67 45.73 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.235 -0.439 . . . . 74.12 111.132 179.927 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -52.8 -35.46 56.91 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.17 -0.468 . . . . 64.11 110.891 179.977 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 53.3 p -67.18 -31.44 71.84 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.155 -0.475 . . . . 54.12 110.855 -179.782 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 25' ' ' ILE . . . . . 0.708 HD13 ' CE1' ' A' ' 115' ' ' PHE . 3.5 mt -83.84 -44.16 18.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.134 -0.484 . . . . 65.32 111.119 179.954 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 26' ' ' TYR . . . . . 0.44 ' CD2' HD12 ' A' ' 50' ' ' ILE . 19.8 m-85 -106.7 45.68 0.97 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.174 -0.466 . . . . 71.11 110.941 -179.982 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER -46.7 -54.88 8.73 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.117 -0.492 . . . . 74.41 110.9 179.919 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -96.49 -11.79 25.06 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.198 -0.456 . . . . 75.43 110.882 179.975 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -101.86 25.79 8.23 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.2 -0.454 . . . . 75.51 110.875 179.99 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 30' ' ' PHE . . . . . 0.483 ' HA ' HD13 ' A' ' 50' ' ' ILE . 3.9 t80 -111.41 134.65 52.84 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.205 -0.452 . . . . 63.1 110.865 -179.9 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 24.2 m -110.7 132.46 54.18 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.138 -0.483 . . . . 70.3 111.175 -179.947 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -95.73 114.28 26.0 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.228 -0.442 . . . . 71.2 110.89 179.936 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.645 HD12 ' N ' ' A' ' 34' ' ' THR . 0.2 OUTLIER -124.95 -0.13 7.92 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.174 -0.467 . . . . 51.41 110.88 -179.891 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 34' ' ' THR . . . . . 0.645 ' N ' HD12 ' A' ' 33' ' ' LEU . 1.4 m . . . . . 0 C--N 1.33 -0.261 0 CA-C-N 116.187 -0.461 . . . . 71.4 111.151 179.915 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 45' ' ' GLN . . . . . 0.649 ' HB3' HD12 ' A' ' 47' ' ' ILE . 24.3 tt0 . . . . . 0 C--O 1.231 0.12 0 CA-C-O 120.76 0.314 . . . . 62.32 110.937 . . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 46' ' ' ILE . . . . . 0.486 HG22 ' O ' ' A' ' 45' ' ' GLN . 0.0 OUTLIER 82.43 -34.19 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.179 -0.464 . . . . 74.31 111.166 179.978 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 47' ' ' ILE . . . . . 0.649 HD12 ' HB3' ' A' ' 45' ' ' GLN . 0.2 OUTLIER -34.94 148.66 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.181 -0.463 . . . . 31.15 111.101 179.843 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 48' ' ' PHE . . . . . 0.617 ' CZ ' HG21 ' A' ' 114' ' ' ILE . 14.3 p90 -159.43 158.0 31.25 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.165 -0.47 . . . . 54.22 110.909 179.889 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 49' ' ' GLU . . . . . 0.462 ' CG ' ' HB2' ' A' ' 67' ' ' HIS . 5.7 mt-10 -109.61 160.74 16.01 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.157 -0.474 . . . . 75.04 110.94 -179.949 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 50' ' ' ILE . . . . . 0.483 HD13 ' HA ' ' A' ' 30' ' ' PHE . 19.0 mm -137.61 139.04 43.93 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 116.148 -0.478 . . . . 75.31 111.161 179.987 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 24.1 m -85.26 117.07 23.98 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.186 -0.461 . . . . 75.1 111.134 179.979 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 52' ' ' LEU . . . . . 0.598 HD12 HD22 ' A' ' 66' ' ' LEU . 17.1 mt -121.59 161.08 23.03 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.234 -0.439 . . . . 75.13 110.939 179.932 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -177.51 178.79 1.0 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.23 -0.441 . . . . 64.1 110.915 179.906 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -64.89 175.48 1.5 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.201 -0.454 . . . . 74.21 110.85 -179.75 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 16.4 m -80.69 -29.45 11.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.155 -0.475 . . . . 62.12 111.081 179.962 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 1.7 t0 -117.02 -169.13 1.59 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.201 -0.454 . . . . 43.53 110.901 179.954 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 57' ' ' LYS . . . . . 0.472 ' CD ' ' N ' ' A' ' 57' ' ' LYS . 0.0 OUTLIER -117.55 -12.62 10.34 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.257 -0.429 . . . . 71.34 110.88 -179.985 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 58' ' ' GLU . . . . . 0.543 ' HA ' ' C ' ' A' ' 59' ' ' PRO . 9.8 pt-20 -126.06 150.98 71.0 Favored Pre-proline 0 C--N 1.329 -0.294 0 CA-C-O 121.639 0.733 . . . . 73.42 110.924 179.895 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 59' ' ' PRO . . . . . 0.543 ' C ' ' HA ' ' A' ' 58' ' ' GLU . 53.7 Cg_endo -69.77 -5.94 9.17 Favored 'Cis proline' 0 C--N 1.342 0.191 0 C-N-CA 122.686 -1.798 . . . . 75.23 112.349 0.041 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 60' ' ' VAL . . . . . 0.879 HG11 ' ND2' ' A' ' 88' ' ' ASN . 33.4 m -140.75 172.32 11.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.25 -0.432 . . . . 74.14 111.165 179.93 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 61' ' ' GLU . . . . . 0.447 ' O ' ' C ' ' A' ' 62' ' ' SER . 5.4 tt0 -102.45 -21.97 14.14 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.163 -0.471 . . . . 73.42 110.86 -179.979 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 62' ' ' SER . . . . . 0.816 ' HB3' HD11 ' A' ' 125' ' ' LEU . 41.7 m 34.0 90.78 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.181 -0.463 . . . . 55.01 110.889 -179.784 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 10.4 p -118.61 123.05 44.04 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.124 -0.489 . . . . 64.21 110.869 -179.836 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 64' ' ' ILE . . . . . 1.066 HD11 HG21 ' A' ' 89' ' ' VAL . 30.1 mt -133.05 139.31 49.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.093 -0.503 . . . . 73.23 111.125 179.976 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 20.4 m -104.53 116.87 32.85 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.176 -0.465 . . . . 74.02 111.157 179.959 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 66' ' ' LEU . . . . . 1.027 HD21 HG21 ' A' ' 121' ' ' THR . 1.4 mp -94.48 109.97 21.81 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.247 -0.433 . . . . 75.41 110.915 179.977 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 67' ' ' HIS . . . . . 0.531 ' CE1' HD21 ' A' ' 33' ' ' LEU . 1.9 t60 -97.4 109.96 22.61 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.18 -0.464 . . . . 73.14 110.833 179.875 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 68' ' ' PHE . . . . . 0.572 ' CE2' ' HB3' ' A' ' 66' ' ' LEU . 0.0 OUTLIER -105.11 139.97 38.98 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.206 -0.452 . . . . 73.3 110.839 -179.896 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -123.87 128.39 49.42 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.148 -0.478 . . . . 61.42 111.07 179.943 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 70' ' ' MET . . . . . 0.738 ' CE ' HD11 ' A' ' 114' ' ' ILE . 0.0 OUTLIER -96.32 103.42 15.32 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.23 -0.441 . . . . 65.21 110.882 179.953 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -57.33 161.17 5.82 Favored Pre-proline 0 C--N 1.33 -0.272 0 CA-C-O 121.564 0.697 . . . . 62.33 111.134 -179.935 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.8 -4.19 13.55 Favored 'Trans proline' 0 C--N 1.342 0.195 0 C-N-CA 122.692 2.261 . . . . 64.03 112.346 179.93 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 73' ' ' MET . . . . . 0.5 ' O ' ' CB ' ' A' ' 76' ' ' TYR . 0.0 OUTLIER -111.85 -24.26 10.09 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.199 -0.455 . . . . 74.32 110.891 179.92 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 74' ' ' TYR . . . . . 0.635 ' CD1' ' C ' ' A' ' 74' ' ' TYR . 0.0 OUTLIER -47.98 149.9 2.25 Favored Pre-proline 0 C--N 1.329 -0.319 0 CA-C-O 121.638 0.732 . . . . 75.44 110.924 -179.865 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 75' ' ' PRO . . . . . 0.542 ' C ' ' HA ' ' A' ' 74' ' ' TYR . 53.7 Cg_endo -69.79 -12.34 12.22 Favored 'Cis proline' 0 C--N 1.341 0.165 0 C-N-CA 122.696 -1.793 . . . . 75.12 112.302 -0.041 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 76' ' ' TYR . . . . . 0.5 ' CB ' ' O ' ' A' ' 73' ' ' MET . 9.4 t80 -33.95 -47.31 0.26 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.264 -0.425 . . . . 71.32 110.934 -179.925 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 77' ' ' THR . . . . . 0.41 HG23 ' CB ' ' A' ' 73' ' ' MET . 72.0 p -105.8 179.68 4.2 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.121 -0.491 . . . . 70.32 111.105 -179.964 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -100.74 129.95 26.44 Favored Pre-proline 0 C--N 1.329 -0.309 0 CA-C-O 121.638 0.733 . . . . 45.04 111.108 179.84 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 79' ' ' PRO . . . . . 0.616 ' HG3' HD11 ' A' ' 113' ' ' ILE . 53.9 Cg_endo -69.75 -175.18 1.07 Allowed 'Trans proline' 0 C--N 1.342 0.203 0 C-N-CA 122.685 2.256 . . . . 64.31 112.353 179.992 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 80' ' ' GLU . . . . . 0.58 ' O ' HD13 ' A' ' 81' ' ' ILE . 0.4 OUTLIER -124.18 141.2 52.26 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.26 -0.427 . . . . 73.23 110.871 -179.981 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 81' ' ' ILE . . . . . 0.58 HD13 ' O ' ' A' ' 80' ' ' GLU . 8.0 mm -133.02 143.89 38.12 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.141 -0.481 . . . . 61.54 111.096 179.983 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 82' ' ' GLU . . . . . 0.509 ' HG3' ' CD ' ' A' ' 84' ' ' LYS . 4.4 pt-20 -149.02 143.65 26.22 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.156 -0.475 . . . . 70.43 110.916 179.906 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 83' ' ' PHE . . . . . 0.465 ' CZ ' ' HD3' ' A' ' 98' ' ' LYS . 10.3 m-85 -96.21 136.85 36.13 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.167 -0.469 . . . . 74.22 110.898 -179.904 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 84' ' ' LYS . . . . . 0.509 ' CD ' ' HG3' ' A' ' 82' ' ' GLU . 12.8 mmmt -123.99 169.02 12.05 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.201 -0.454 . . . . 73.33 110.941 179.964 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 85' ' ' ASN . . . . . 0.455 ' O ' ' C ' ' A' ' 86' ' ' VAL . 3.2 m120 64.26 -72.46 0.06 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.249 -0.432 . . . . 74.05 110.888 179.942 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 86' ' ' VAL . . . . . 0.513 HG11 HD11 ' A' ' 94' ' ' LEU . 6.8 m 33.76 90.84 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.18 -0.464 . . . . 74.14 111.101 179.904 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -99.95 -53.65 3.1 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.173 -0.467 . . . . 71.21 110.934 179.995 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 88' ' ' ASN . . . . . 0.879 ' ND2' HG11 ' A' ' 60' ' ' VAL . 25.3 t-20 -85.4 20.88 1.89 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.206 -0.452 . . . . 63.34 110.866 -179.954 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 89' ' ' VAL . . . . . 1.066 HG21 HD11 ' A' ' 64' ' ' ILE . 2.8 t -130.81 154.62 40.96 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.175 -0.466 . . . . 74.02 111.133 179.918 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 90' ' ' MET . . . . . . . . . . . . . 3.0 mtm -108.31 -69.44 0.85 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.19 -0.459 . . . . 72.3 110.933 179.874 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 9.8 p-10 -170.82 -33.41 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.183 -0.462 . . . . 72.31 110.88 179.959 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 4.1 m -54.34 -46.47 72.93 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.197 -0.456 . . . . 64.1 110.869 -179.788 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 93' ' ' GLN . . . . . 0.441 ' HB2' ' CG1' ' A' ' 89' ' ' VAL . 4.1 mp0 -68.74 -38.78 80.39 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.131 -0.486 . . . . 74.32 110.897 -179.942 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 94' ' ' LEU . . . . . 0.521 ' CD1' HG11 ' A' ' 89' ' ' VAL . 8.2 mp -57.86 -49.16 77.63 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.185 -0.461 . . . . 64.34 110.931 179.977 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 74.2 mt-30 -66.08 -37.33 85.53 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.144 -0.48 . . . . 61.32 110.9 179.956 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 96' ' ' MET . . . . . . . . . . . . . 32.8 ttp -59.76 -41.27 90.66 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.205 -0.452 . . . . 62.24 110.884 179.958 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 97' ' ' LEU . . . . . 0.609 HD22 ' HA ' ' A' ' 121' ' ' THR . 87.6 mt -61.76 -44.8 96.18 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.21 -0.45 . . . . 75.13 110.945 -179.982 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 98' ' ' LYS . . . . . 0.48 ' HA ' ' CD2' ' A' ' 101' ' ' PHE . 5.5 mmtp -58.47 -34.98 71.48 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.169 -0.469 . . . . 74.24 110.893 179.81 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -63.89 -42.76 97.4 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.183 -0.462 . . . . 73.44 110.86 -179.847 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 100' ' ' GLU . . . . . 0.558 ' O ' HD12 ' A' ' 104' ' ' ILE . 69.5 mm-40 -71.0 -24.56 62.41 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.114 -0.494 . . . . 73.22 110.837 -179.948 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 101' ' ' PHE . . . . . 0.576 ' CD2' HD11 ' A' ' 117' ' ' ILE . 10.5 m-30 -59.57 -38.23 80.61 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.146 -0.479 . . . . 75.52 110.864 -179.905 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.28 -44.0 95.72 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.166 -0.47 . . . . 75.02 110.867 -179.988 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -67.36 -42.88 82.73 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.247 -0.433 . . . . 73.02 110.888 179.881 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 104' ' ' ILE . . . . . 0.904 HD11 ' CG ' ' A' ' 120' ' ' PHE . 3.4 mt -61.82 -47.68 92.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.245 -0.434 . . . . 60.42 111.158 179.855 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 105' ' ' HIS . . . . . 0.454 ' O ' ' N ' ' A' ' 109' ' ' ARG . 64.6 t-80 -62.97 -41.2 99.47 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.135 -0.484 . . . . 65.15 110.888 179.864 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 1.4 m-80 -56.82 -40.47 76.06 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.199 -0.455 . . . . 62.21 110.87 -179.941 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 107' ' ' THR . . . . . 0.413 ' CG2' ' O ' ' A' ' 104' ' ' ILE . 5.2 t -81.26 -26.31 35.88 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.212 -0.449 . . . . 72.23 111.112 -179.971 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 108' ' ' SER . . . . . 0.58 ' OG ' HG22 ' A' ' 113' ' ' ILE . 39.3 p -111.31 26.84 10.26 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.251 -0.431 . . . . 42.44 110.848 -179.813 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 109' ' ' ARG . . . . . 0.454 ' N ' ' O ' ' A' ' 105' ' ' HIS . 13.4 ttt-85 -68.34 76.55 0.26 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.154 -0.476 . . . . 74.24 110.868 -179.928 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 145.09 -20.22 1.94 Allowed Glycine 0 N--CA 1.451 -0.343 0 C-N-CA 120.78 -0.724 . . . . 55.44 112.501 -179.986 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 111' ' ' GLN . . . . . . . . . . . . . 7.3 pt20 -114.54 -170.2 1.69 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.749 0.309 . . . . 74.42 110.91 -179.877 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 32.8 mt-10 -62.3 128.92 38.34 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.204 -0.453 . . . . 75.42 110.874 -179.962 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 113' ' ' ILE . . . . . 0.616 HD11 ' HG3' ' A' ' 79' ' ' PRO . 21.2 pt -120.67 -15.08 7.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.133 -0.485 . . . . 63.25 111.098 179.999 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 114' ' ' ILE . . . . . 0.92 ' O ' HG23 ' A' ' 118' ' ' THR . 35.0 mm -60.11 -43.64 93.33 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.175 -0.466 . . . . 73.43 111.166 179.816 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 115' ' ' PHE . . . . . 0.708 ' CE1' HD13 ' A' ' 25' ' ' ILE . 22.0 t80 -72.31 -35.35 68.61 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.176 -0.465 . . . . 65.34 110.925 179.929 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 56.6 mm-40 -67.89 -47.62 68.3 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.096 -0.502 . . . . 74.43 110.929 -179.97 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 117' ' ' ILE . . . . . 0.576 HD11 ' CD2' ' A' ' 101' ' ' PHE . 1.1 tt -64.27 -40.45 89.11 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.133 -0.485 . . . . 61.31 111.15 179.947 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 118' ' ' THR . . . . . 0.92 HG23 ' O ' ' A' ' 114' ' ' ILE . 62.5 p -67.43 -43.38 81.32 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.181 -0.463 . . . . 74.02 111.149 179.978 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 1.7 t -67.83 -32.02 72.27 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.189 -0.459 . . . . 62.44 110.841 -179.867 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 120' ' ' PHE . . . . . 0.904 ' CG ' HD11 ' A' ' 104' ' ' ILE . 0.4 OUTLIER -76.01 -39.64 55.32 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.155 -0.475 . . . . 75.5 110.893 -179.932 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 121' ' ' THR . . . . . 1.027 HG21 HD21 ' A' ' 66' ' ' LEU . 14.8 p -69.36 -41.65 76.29 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.14 -0.482 . . . . 75.51 111.134 -179.933 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 122' ' ' GLN . . . . . 0.442 ' CG ' ' N ' ' A' ' 123' ' ' GLU . 9.0 pt20 -68.25 -46.97 69.01 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.227 -0.442 . . . . 65.15 110.904 -179.976 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 123' ' ' GLU . . . . . 0.442 ' N ' ' CG ' ' A' ' 122' ' ' GLN . 5.7 pt-20 -60.36 -36.61 78.41 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.197 -0.456 . . . . 73.25 110.869 -179.916 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 124' ' ' LYS . . . . . 0.459 ' HA ' ' CE ' ' A' ' 124' ' ' LYS . 0.0 OUTLIER -77.03 -38.54 52.62 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.146 -0.479 . . . . 74.42 110.921 179.969 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 125' ' ' LEU . . . . . 0.816 HD11 ' HB3' ' A' ' 62' ' ' SER . 2.3 tp -67.69 -43.2 80.69 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.203 -0.453 . . . . 64.23 110.938 179.927 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -63.19 -43.13 99.08 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.157 -0.474 . . . . 63.11 110.836 179.875 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 127' ' ' GLU . . . . . 0.446 ' HG3' ' N ' ' A' ' 128' ' ' PHE . 0.0 OUTLIER -67.22 -29.25 68.86 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.208 -0.451 . . . . 73.43 110.915 -179.912 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 128' ' ' PHE . . . . . 0.446 ' N ' ' HG3' ' A' ' 127' ' ' GLU . 0.2 OUTLIER . . . . . 0 C--N 1.329 -0.285 0 CA-C-N 116.117 -0.492 . . . . 73.44 110.916 -179.966 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 36.6 mt . . . . . 0 C--O 1.231 0.083 0 CA-C-O 120.847 0.356 . . . . 73.11 110.965 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 33.6 t70 -54.89 -30.04 57.14 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.191 -0.459 . . . . 72.44 110.819 179.843 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 9.1 mm100 -66.27 -33.81 76.59 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.207 -0.451 . . . . 73.12 110.916 -179.915 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 11' ' ' TYR . . . . . 0.55 ' CE1' ' HD2' ' A' ' 75' ' ' PRO . 14.1 m-85 -64.37 -26.93 68.68 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.211 -0.45 . . . . 74.12 110.904 -179.864 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -59.58 -37.01 77.39 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.15 -0.477 . . . . 75.11 110.899 -179.854 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 2.9 mm-40 -61.45 -45.94 92.17 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.152 -0.476 . . . . 73.41 110.92 179.976 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 14' ' ' ILE . . . . . 0.487 ' H ' HD12 ' A' ' 14' ' ' ILE . 4.9 mp -67.79 -45.05 85.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.141 -0.481 . . . . 73.13 111.163 179.945 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 15' ' ' GLN . . . . . 0.498 ' NE2' ' O ' ' A' ' 71' ' ' THR . 86.8 mt-30 -61.29 -45.36 94.8 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.124 -0.489 . . . . 74.31 110.907 179.966 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 2.8 t -61.18 -41.92 97.64 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.182 -0.463 . . . . 74.12 110.891 -179.941 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 2.5 m-20 -57.63 -33.51 68.34 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.196 -0.456 . . . . 74.1 110.913 -179.919 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 18' ' ' GLU . . . . . 0.571 ' HG2' HD13 ' A' ' 114' ' ' ILE . 2.9 mt-10 -65.51 -41.2 93.45 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.181 -0.463 . . . . 75.41 110.897 179.987 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 8.9 mp -61.74 -51.84 66.72 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.109 -0.496 . . . . 74.15 110.921 -179.958 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -68.85 -37.41 79.11 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.192 -0.458 . . . . 74.25 110.901 179.912 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -61.01 -50.58 72.77 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.162 -0.472 . . . . 32.21 111.109 179.916 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 22' ' ' ILE . . . . . 0.407 HD11 ' HB2' ' A' ' 115' ' ' PHE . 0.6 OUTLIER -75.0 -36.09 37.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.236 -0.438 . . . . 73.3 111.168 179.968 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 18.7 mtp180 -52.63 -34.22 50.3 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.16 -0.473 . . . . 72.22 110.858 179.973 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -66.29 -33.55 75.99 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.219 -0.446 . . . . 65.11 110.847 -179.782 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 25' ' ' ILE . . . . . 0.745 HG21 ' HE1' ' A' ' 115' ' ' PHE . 3.3 mt -81.71 -44.9 20.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.12 -0.491 . . . . 73.22 111.139 179.97 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 21.4 m-85 -109.01 46.03 1.0 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.182 -0.463 . . . . 74.12 110.883 -179.948 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 3.2 mtm -41.7 -59.32 1.69 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.138 -0.483 . . . . 71.55 110.902 179.895 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 1.5 t70 -84.38 -25.12 29.35 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.197 -0.456 . . . . 73.13 110.834 179.968 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -85.38 30.75 0.6 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.234 -0.439 . . . . 73.42 110.851 -179.998 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 30' ' ' PHE . . . . . 0.579 ' HA ' HD13 ' A' ' 50' ' ' ILE . 6.0 t80 -117.14 139.47 50.7 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.205 -0.452 . . . . 72.33 110.835 -179.879 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 60.5 m -118.33 135.12 54.5 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.092 -0.504 . . . . 63.42 111.168 -179.916 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 12.6 t70 -99.92 117.17 33.66 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.256 -0.429 . . . . 75.31 110.891 179.872 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.895 HD21 HG12 ' A' ' 47' ' ' ILE . 1.2 pt? -118.58 -28.69 5.61 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.182 -0.463 . . . . 73.01 110.935 -179.98 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 34' ' ' THR . . . . . 0.651 ' H ' HD23 ' A' ' 33' ' ' LEU . 0.2 OUTLIER . . . . . 0 C--N 1.33 -0.251 0 CA-C-N 116.209 -0.45 . . . . 60.55 111.128 179.957 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 45' ' ' GLN . . . . . 0.657 ' HB3' HG23 ' A' ' 47' ' ' ILE . 11.7 tt0 . . . . . 0 C--O 1.231 0.126 0 CA-C-O 120.758 0.313 . . . . 62.41 110.911 . . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 46' ' ' ILE . . . . . 0.534 HG22 ' O ' ' A' ' 45' ' ' GLN . 0.0 OUTLIER 78.71 -7.87 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.225 -0.443 . . . . 75.13 111.132 179.976 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 47' ' ' ILE . . . . . 0.895 HG12 HD21 ' A' ' 33' ' ' LEU . 0.2 OUTLIER -53.12 147.1 2.27 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.18 -0.464 . . . . 54.03 111.119 179.829 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 48' ' ' PHE . . . . . 0.659 ' HA ' HD22 ' A' ' 33' ' ' LEU . 25.6 p90 -153.06 153.03 32.03 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.178 -0.464 . . . . 63.24 110.878 179.954 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 49' ' ' GLU . . . . . 0.459 ' CG ' HD13 ' A' ' 33' ' ' LEU . 12.4 mt-10 -108.36 150.83 26.82 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.158 -0.474 . . . . 71.45 110.904 -179.954 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 50' ' ' ILE . . . . . 0.579 HD13 ' HA ' ' A' ' 30' ' ' PHE . 11.5 mm -132.43 138.58 51.89 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.127 -0.488 . . . . 73.14 111.145 -179.991 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 96.8 m -85.86 127.36 34.56 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.177 -0.465 . . . . 63.14 111.141 179.984 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 52' ' ' LEU . . . . . 0.619 HD12 HD12 ' A' ' 66' ' ' LEU . 17.7 mt -128.02 164.5 22.22 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.19 -0.459 . . . . 63.13 110.883 179.965 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -178.62 172.21 1.44 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.134 -0.484 . . . . 64.01 110.886 179.933 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -66.53 173.71 3.21 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.187 -0.461 . . . . 74.21 110.836 -179.798 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 29.0 m -85.22 -27.35 6.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.146 -0.479 . . . . 61.32 111.14 179.92 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -114.72 -172.7 2.17 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.13 -0.486 . . . . 73.42 110.859 179.938 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 4.1 mmmm -116.24 -22.4 8.88 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.177 -0.465 . . . . 63.25 110.897 179.979 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 58' ' ' GLU . . . . . 0.541 ' HA ' ' C ' ' A' ' 59' ' ' PRO . 1.5 pt-20 -113.06 143.05 28.41 Favored Pre-proline 0 C--N 1.329 -0.31 0 CA-C-O 121.701 0.762 . . . . 75.45 110.899 179.931 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 59' ' ' PRO . . . . . 0.541 ' C ' ' HA ' ' A' ' 58' ' ' GLU . 53.5 Cg_endo -69.79 -13.2 12.43 Favored 'Cis proline' 0 C--N 1.342 0.189 0 C-N-CA 122.624 -1.823 . . . . 72.44 112.31 0.033 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 60' ' ' VAL . . . . . 0.445 ' HB ' ' CG ' ' A' ' 88' ' ' ASN . 8.5 m -149.49 176.26 0.92 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.263 -0.426 . . . . 71.23 111.076 179.939 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 61' ' ' GLU . . . . . 0.458 ' O ' ' C ' ' A' ' 62' ' ' SER . 0.9 OUTLIER -112.46 -16.24 12.93 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.128 -0.487 . . . . 75.54 110.882 179.994 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 62' ' ' SER . . . . . 0.539 ' CB ' HD21 ' A' ' 125' ' ' LEU . 0.4 OUTLIER 33.67 91.12 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.174 -0.467 . . . . 54.43 110.849 -179.806 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 32.8 t -103.31 122.79 45.53 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.143 -0.48 . . . . 75.34 110.821 -179.803 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 64' ' ' ILE . . . . . 0.732 HD13 HD21 ' A' ' 94' ' ' LEU . 17.7 mt -137.19 143.05 35.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.164 -0.471 . . . . 71.45 111.121 179.937 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 15.4 m -107.84 115.03 29.4 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.207 -0.451 . . . . 75.12 111.13 179.945 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 66' ' ' LEU . . . . . 1.076 HD11 HG21 ' A' ' 121' ' ' THR . 12.3 mt -91.02 110.14 21.4 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.218 -0.446 . . . . 75.42 110.88 179.962 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 8.7 t60 -100.78 114.64 28.6 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.191 -0.459 . . . . 64.52 110.866 179.849 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 68' ' ' PHE . . . . . 0.523 ' HA ' HD13 ' A' ' 81' ' ' ILE . 0.0 OUTLIER -103.66 139.79 38.46 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.254 -0.43 . . . . 75.22 110.909 -179.942 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -120.04 120.81 37.37 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.182 -0.463 . . . . 73.24 111.131 179.933 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 70' ' ' MET . . . . . 0.662 ' HE3' HD11 ' A' ' 114' ' ' ILE . 12.6 mmt -85.45 104.3 15.12 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.241 -0.436 . . . . 72.15 110.875 179.995 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 71' ' ' THR . . . . . 0.498 ' O ' ' NE2' ' A' ' 15' ' ' GLN . 0.7 OUTLIER -59.93 158.12 26.83 Favored Pre-proline 0 C--N 1.329 -0.303 0 CA-C-O 121.593 0.711 . . . . 64.02 111.163 -179.938 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.76 1.05 4.78 Favored 'Trans proline' 0 C--N 1.342 0.213 0 C-N-CA 122.646 2.231 . . . . 55.55 112.356 179.94 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 73' ' ' MET . . . . . 0.479 ' O ' ' CB ' ' A' ' 76' ' ' TYR . 0.5 OUTLIER -116.67 -25.57 7.32 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.248 -0.433 . . . . 74.33 110.894 179.934 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 74' ' ' TYR . . . . . 0.62 ' CD1' ' C ' ' A' ' 74' ' ' TYR . 0.1 OUTLIER -46.6 147.61 2.02 Favored Pre-proline 0 C--N 1.329 -0.324 0 CA-C-O 121.664 0.745 . . . . 73.21 110.956 -179.933 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 75' ' ' PRO . . . . . 0.557 ' C ' ' HA ' ' A' ' 74' ' ' TYR . 53.4 Cg_endo -69.77 -14.86 12.55 Favored 'Cis proline' 0 C--N 1.342 0.184 0 C-N-CA 122.636 -1.818 . . . . 75.2 112.333 -0.049 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 76' ' ' TYR . . . . . 0.479 ' CB ' ' O ' ' A' ' 73' ' ' MET . 9.0 t80 -34.16 -45.33 0.21 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.202 -0.454 . . . . 65.41 110.938 -179.941 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 77' ' ' THR . . . . . 0.473 HG23 ' CB ' ' A' ' 73' ' ' MET . 51.9 p -114.97 163.45 15.56 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.099 -0.5 . . . . 73.32 111.163 -179.976 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -85.7 132.64 43.72 Favored Pre-proline 0 C--N 1.329 -0.326 0 CA-C-O 121.585 0.707 . . . . 72.34 111.09 179.865 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 79' ' ' PRO . . . . . 0.844 ' HG3' HD11 ' A' ' 113' ' ' ILE . 54.0 Cg_endo -69.71 -170.72 0.41 Allowed 'Trans proline' 0 C--N 1.341 0.165 0 C-N-CA 122.714 2.276 . . . . 75.13 112.367 -179.993 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 80' ' ' GLU . . . . . 0.429 ' HG3' ' N ' ' A' ' 81' ' ' ILE . 0.3 OUTLIER -124.36 140.11 53.26 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.242 -0.435 . . . . 72.23 110.924 179.955 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 81' ' ' ILE . . . . . 0.523 HD13 ' HA ' ' A' ' 68' ' ' PHE . 6.4 mm -130.42 137.07 57.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.127 -0.488 . . . . 64.52 111.152 179.957 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 82' ' ' GLU . . . . . 0.48 ' HG3' ' CD ' ' A' ' 84' ' ' LYS . 6.0 pt-20 -140.04 144.09 36.71 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.174 -0.466 . . . . 74.05 110.888 179.942 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 83' ' ' PHE . . . . . 0.692 ' CG ' HD22 ' A' ' 94' ' ' LEU . 58.6 m-85 -94.3 140.63 29.54 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.142 -0.481 . . . . 72.41 110.892 -179.918 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 84' ' ' LYS . . . . . 0.48 ' CD ' ' HG3' ' A' ' 82' ' ' GLU . 10.4 mmmt -124.2 169.62 11.55 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.172 -0.467 . . . . 72.12 110.904 179.932 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 85' ' ' ASN . . . . . 0.424 ' C ' HG22 ' A' ' 86' ' ' VAL . 3.2 m120 61.78 -74.69 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.216 -0.447 . . . . 64.45 110.95 179.982 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 86' ' ' VAL . . . . . 0.497 ' CG1' HD11 ' A' ' 94' ' ' LEU . 3.4 m 41.73 90.87 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.167 -0.469 . . . . 74.43 111.147 179.896 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -104.06 -95.92 0.32 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.167 -0.47 . . . . 74.54 110.989 179.957 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 88' ' ' ASN . . . . . 0.445 ' CG ' ' HB ' ' A' ' 60' ' ' VAL . 32.0 m120 -45.76 -36.04 4.79 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.183 -0.462 . . . . 62.01 110.891 -180.0 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 89' ' ' VAL . . . . . 0.541 HG21 ' HG ' ' A' ' 94' ' ' LEU . 3.2 p -63.94 149.97 10.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.16 -0.473 . . . . 62.14 111.106 179.942 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 90' ' ' MET . . . . . . . . . . . . . 29.8 mtm -98.75 -74.29 0.59 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.194 -0.457 . . . . 74.32 110.887 179.914 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 7.7 p-10 176.4 -32.34 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.276 -0.42 . . . . 71.33 110.85 179.932 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -54.43 -45.86 73.12 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.213 -0.449 . . . . 73.4 110.823 -179.759 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -70.84 -38.97 73.22 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.165 -0.47 . . . . 74.44 110.893 -179.928 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 94' ' ' LEU . . . . . 0.732 HD21 HD13 ' A' ' 64' ' ' ILE . 21.4 mt -58.87 -47.43 84.93 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.208 -0.451 . . . . 70.44 110.912 -179.979 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 26.4 mt-30 -61.06 -34.56 75.08 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.166 -0.47 . . . . 64.25 110.91 179.941 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 96' ' ' MET . . . . . 0.498 ' SD ' ' CE1' ' A' ' 128' ' ' PHE . 9.2 ttp -61.25 -37.94 84.89 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.212 -0.449 . . . . 75.24 110.838 -179.992 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 97' ' ' LEU . . . . . 0.571 ' O ' ' CD1' ' A' ' 101' ' ' PHE . 27.8 mt -64.32 -43.07 95.8 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.224 -0.444 . . . . 64.3 110.93 179.994 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 5.0 mmtp -55.06 -38.51 68.12 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.227 -0.442 . . . . 73.41 110.91 179.82 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -70.19 -42.14 72.8 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.196 -0.456 . . . . 73.13 110.854 -179.903 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 100' ' ' GLU . . . . . 0.566 ' O ' HD12 ' A' ' 104' ' ' ILE . 6.0 mt-10 -66.69 -24.3 66.24 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.149 -0.478 . . . . 61.51 110.899 -179.953 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 101' ' ' PHE . . . . . 0.65 ' CD2' HD11 ' A' ' 117' ' ' ILE . 9.4 m-30 -60.1 -31.12 69.74 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.138 -0.483 . . . . 74.23 110.905 -179.95 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.01 -40.76 87.37 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.148 -0.478 . . . . 71.11 110.877 179.948 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 1.6 mppt? -67.9 -42.95 80.39 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.226 -0.443 . . . . 74.4 110.92 179.853 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 104' ' ' ILE . . . . . 0.566 HD12 ' O ' ' A' ' 100' ' ' GLU . 2.3 mt -62.17 -47.59 92.39 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.218 -0.446 . . . . 72.21 111.1 179.879 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 105' ' ' HIS . . . . . . . . . . . . . 7.7 t-80 -62.93 -42.83 99.93 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.16 -0.473 . . . . 74.44 110.815 179.94 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -56.49 -41.76 77.18 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.218 -0.446 . . . . 64.15 110.927 -179.954 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 9.3 t -81.74 -23.63 36.58 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.147 -0.479 . . . . 74.23 111.157 -179.999 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 108' ' ' SER . . . . . 0.429 ' HB2' HG22 ' A' ' 113' ' ' ILE . 24.2 m -107.93 26.39 10.41 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.236 -0.438 . . . . 74.2 110.883 -179.89 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -65.73 86.04 0.08 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.113 -0.494 . . . . 73.2 110.845 -179.907 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 119.75 38.89 0.68 Allowed Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.779 -0.724 . . . . 62.42 112.464 -179.996 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 111' ' ' GLN . . . . . . . . . . . . . 10.9 pt20 -171.42 -176.43 1.85 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.735 0.302 . . . . 70.45 110.893 -179.914 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 63.1 mt-10 -60.57 131.59 51.2 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.214 -0.448 . . . . 62.13 110.911 -179.966 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 113' ' ' ILE . . . . . 0.844 HD11 ' HG3' ' A' ' 79' ' ' PRO . 7.6 pt -127.02 -5.53 4.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.187 -0.461 . . . . 62.31 111.137 179.969 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 114' ' ' ILE . . . . . 0.852 ' H ' HD12 ' A' ' 114' ' ' ILE . 3.6 mp -68.3 -46.61 80.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.185 -0.461 . . . . 73.24 111.134 179.828 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 115' ' ' PHE . . . . . 0.745 ' HE1' HG21 ' A' ' 25' ' ' ILE . 12.5 t80 -69.13 -33.83 74.07 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.187 -0.46 . . . . 65.12 110.853 179.954 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 51.9 mm-40 -68.06 -44.72 75.72 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.191 -0.459 . . . . 70.53 110.886 -179.949 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 117' ' ' ILE . . . . . 0.65 HD11 ' CD2' ' A' ' 101' ' ' PHE . 0.4 OUTLIER -66.41 -41.2 88.37 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 116.192 -0.458 . . . . 71.25 111.147 179.982 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 118' ' ' THR . . . . . 0.712 HG23 ' O ' ' A' ' 114' ' ' ILE . 69.8 p -67.88 -43.08 80.16 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.162 -0.472 . . . . 73.15 111.177 179.906 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -66.49 -31.59 72.41 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.209 -0.451 . . . . 71.13 110.907 -179.878 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 120' ' ' PHE . . . . . 0.441 ' CG ' HD11 ' A' ' 104' ' ' ILE . 0.3 OUTLIER -77.73 -44.73 26.86 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.091 -0.504 . . . . 75.12 110.912 -179.988 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 121' ' ' THR . . . . . 1.076 HG21 HD11 ' A' ' 66' ' ' LEU . 18.8 p -66.17 -45.42 80.97 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.167 -0.47 . . . . 55.13 111.203 -179.979 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 3.6 pp0? -60.91 -38.12 84.64 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.187 -0.46 . . . . 62.21 110.894 179.978 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 123' ' ' GLU . . . . . 0.497 ' CG ' ' N ' ' A' ' 124' ' ' LYS . 1.6 pt-20 -74.12 -48.26 30.7 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.228 -0.442 . . . . 73.43 110.894 -179.944 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 124' ' ' LYS . . . . . 0.497 ' N ' ' CG ' ' A' ' 123' ' ' GLU . 0.0 OUTLIER -63.5 -28.51 70.0 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.084 -0.507 . . . . 73.4 110.865 179.986 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 125' ' ' LEU . . . . . 0.668 ' O ' HD23 ' A' ' 125' ' ' LEU . 1.4 tt -68.36 -51.64 42.12 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.208 -0.451 . . . . 53.15 110.928 179.947 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 26.8 t70 -60.31 -37.19 79.79 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.208 -0.451 . . . . 50.53 110.882 179.837 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 1.6 mm-40 -60.18 -48.68 80.69 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.185 -0.461 . . . . 73.41 110.838 -179.895 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 128' ' ' PHE . . . . . 0.498 ' CE1' ' SD ' ' A' ' 96' ' ' MET . 7.4 m-85 . . . . . 0 C--N 1.328 -0.333 0 CA-C-N 116.152 -0.477 . . . . 73.51 110.874 -179.907 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 8' ' ' LEU . . . . . 0.409 HD22 ' O ' ' A' ' 72' ' ' PRO . 23.4 mt . . . . . 0 C--O 1.231 0.126 0 CA-C-O 120.771 0.319 . . . . 65.45 110.912 . . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 6.3 m-20 -50.96 -34.59 29.51 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.251 -0.432 . . . . 73.41 110.86 179.827 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 36.6 mm-40 -66.33 -36.38 82.76 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.178 -0.465 . . . . 51.21 110.897 -179.892 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 17.9 m-85 -65.2 -26.05 67.97 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.168 -0.469 . . . . 74.24 110.919 -179.857 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -58.73 -37.59 76.51 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.106 -0.497 . . . . 54.42 110.927 -179.871 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 1.1 mm-40 -58.26 -41.68 84.78 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.104 -0.498 . . . . 70.23 110.898 179.987 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 2.3 mp -68.08 -40.16 82.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.208 -0.451 . . . . 73.22 111.141 179.939 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 15' ' ' GLN . . . . . 0.602 ' OE1' ' CE1' ' A' ' 74' ' ' TYR . 12.6 mm-40 -62.76 -45.04 94.55 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.133 -0.485 . . . . 64.12 110.87 179.989 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 3.2 t -58.52 -44.51 89.57 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.163 -0.471 . . . . 62.13 110.889 -179.925 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 17' ' ' ASN . . . . . 0.4 ' O ' ' HG3' ' A' ' 20' ' ' GLU . 0.6 OUTLIER -57.58 -33.51 68.25 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.217 -0.447 . . . . 71.04 110.911 -179.931 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 2.0 mm-40 -66.05 -37.69 86.47 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.179 -0.464 . . . . 63.3 110.896 -179.979 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.647 HD21 HG13 ' A' ' 46' ' ' ILE . 9.2 mp -65.7 -51.39 59.71 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.128 -0.487 . . . . 53.44 110.929 -179.995 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 20' ' ' GLU . . . . . 0.4 ' HG3' ' O ' ' A' ' 17' ' ' ASN . 2.0 pt-20 -68.25 -32.58 72.87 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.207 -0.452 . . . . 51.33 110.902 179.902 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -66.05 -49.92 65.99 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.143 -0.48 . . . . 73.33 111.103 179.952 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 22' ' ' ILE . . . . . 0.421 ' HA ' HD12 ' A' ' 25' ' ' ILE . 0.7 OUTLIER -77.01 -34.58 22.03 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.226 -0.443 . . . . 72.41 111.153 179.966 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 23' ' ' ARG . . . . . 0.403 ' CG ' ' O ' ' A' ' 19' ' ' LEU . 26.6 mtp180 -52.34 -34.45 47.37 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.184 -0.462 . . . . 75.13 110.913 179.935 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -67.16 -35.02 78.79 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.187 -0.461 . . . . 74.33 110.86 -179.758 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 25' ' ' ILE . . . . . 0.678 HG21 ' HE1' ' A' ' 115' ' ' PHE . 3.2 mt -80.61 -44.4 21.65 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.093 -0.503 . . . . 75.12 111.132 179.895 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 19.9 m-85 -110.73 45.89 1.11 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.208 -0.451 . . . . 62.31 110.92 -179.941 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 3.1 mtm -43.49 -57.23 3.2 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.127 -0.488 . . . . 74.21 110.887 179.884 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 5.4 m-20 -81.84 -35.94 28.85 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.203 -0.453 . . . . 71.41 110.883 179.949 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -80.62 44.03 0.7 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.218 -0.446 . . . . 73.43 110.827 -179.983 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 30' ' ' PHE . . . . . 0.542 ' HA ' HD13 ' A' ' 50' ' ' ILE . 10.1 t80 -129.15 123.72 32.85 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.233 -0.44 . . . . 71.14 110.921 -179.937 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 20.3 m -113.17 135.03 54.26 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.171 -0.468 . . . . 64.53 111.101 -179.882 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -95.94 113.99 25.67 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.216 -0.447 . . . . 52.11 110.868 179.924 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 1.115 HD23 ' N ' ' A' ' 34' ' ' THR . 0.1 OUTLIER -113.36 -18.74 11.96 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.162 -0.472 . . . . 73.22 110.93 -179.935 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 34' ' ' THR . . . . . 1.115 ' N ' HD23 ' A' ' 33' ' ' LEU . 2.5 m . . . . . 0 C--N 1.33 -0.266 0 CA-C-N 116.163 -0.471 . . . . 73.33 111.143 179.94 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 45' ' ' GLN . . . . . 0.997 ' HG2' HG23 ' A' ' 47' ' ' ILE . 0.3 OUTLIER . . . . . 0 C--O 1.232 0.147 0 CA-C-O 120.764 0.316 . . . . 74.24 110.907 . . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 46' ' ' ILE . . . . . 0.661 HG22 ' O ' ' A' ' 45' ' ' GLN . 0.1 OUTLIER 87.52 -18.01 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.214 -0.448 . . . . 73.15 111.184 -179.971 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 47' ' ' ILE . . . . . 0.997 HG23 ' HG2' ' A' ' 45' ' ' GLN . 0.1 OUTLIER -38.28 147.2 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.164 -0.471 . . . . 64.23 111.139 179.811 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 48' ' ' PHE . . . . . 0.86 ' HA ' HD22 ' A' ' 33' ' ' LEU . 1.9 p90 -162.02 160.93 28.19 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.149 -0.478 . . . . 64.12 110.871 179.975 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 49' ' ' GLU . . . . . 0.676 ' CG ' HD13 ' A' ' 33' ' ' LEU . 18.8 mt-10 -110.61 155.61 22.12 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.153 -0.476 . . . . 72.33 110.929 -179.948 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 50' ' ' ILE . . . . . 0.542 HD13 ' HA ' ' A' ' 30' ' ' PHE . 9.2 mm -135.44 142.28 40.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.2 -0.454 . . . . 64.12 111.142 179.935 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 89.7 m -88.12 139.18 30.77 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.168 -0.469 . . . . 74.22 111.167 179.938 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 52' ' ' LEU . . . . . 0.679 HD12 HD12 ' A' ' 66' ' ' LEU . 17.4 mt -141.12 162.63 35.04 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.232 -0.44 . . . . 64.31 110.918 179.957 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 53' ' ' ARG . . . . . 0.491 ' C ' HD21 ' A' ' 125' ' ' LEU . 0.0 OUTLIER -178.27 173.76 1.38 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.179 -0.464 . . . . 74.42 110.817 179.969 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 54' ' ' SER . . . . . 0.535 ' N ' HD21 ' A' ' 125' ' ' LEU . 10.9 p -67.46 -173.6 0.32 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.192 -0.458 . . . . 61.1 110.888 -179.801 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 55' ' ' VAL . . . . . 0.47 HG13 ' OD1' ' A' ' 126' ' ' ASP . 34.0 m -94.13 -28.94 4.21 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.169 -0.468 . . . . 62.02 111.148 179.935 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -113.54 -173.8 2.34 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.123 -0.489 . . . . 62.35 110.861 179.941 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -117.61 -13.56 10.25 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.188 -0.46 . . . . 74.32 110.878 179.986 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 58' ' ' GLU . . . . . 0.556 ' HA ' ' C ' ' A' ' 59' ' ' PRO . 5.9 pt-20 -122.67 144.11 41.69 Favored Pre-proline 0 C--N 1.329 -0.296 0 CA-C-O 121.637 0.732 . . . . 75.31 110.85 -179.975 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 59' ' ' PRO . . . . . 0.556 ' C ' ' HA ' ' A' ' 58' ' ' GLU . 53.9 Cg_endo -69.76 -5.18 8.73 Favored 'Cis proline' 0 C--N 1.342 0.2 0 C-N-CA 122.663 -1.807 . . . . 74.15 112.316 -0.042 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 14.9 m -154.9 -179.5 0.25 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.256 -0.429 . . . . 72.1 111.17 179.912 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 61' ' ' GLU . . . . . 0.429 ' O ' ' C ' ' A' ' 62' ' ' SER . 1.2 pt-20 -118.91 -12.8 9.53 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.193 -0.458 . . . . 71.43 110.843 179.989 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 62' ' ' SER . . . . . 0.919 ' HB3' HD11 ' A' ' 125' ' ' LEU . 7.8 t 35.51 90.78 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.206 -0.452 . . . . 74.31 110.841 -179.811 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 6.4 t -104.87 123.04 47.02 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.117 -0.492 . . . . 75.01 110.85 -179.83 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 64' ' ' ILE . . . . . 0.625 HD11 HG11 ' A' ' 89' ' ' VAL . 20.7 mt -136.2 132.18 49.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.121 -0.491 . . . . 74.52 111.088 179.992 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 87.0 m -95.84 113.96 25.65 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.218 -0.446 . . . . 75.44 111.1 179.95 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 66' ' ' LEU . . . . . 0.774 HD11 HG21 ' A' ' 121' ' ' THR . 11.8 mt -94.54 112.62 24.39 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.236 -0.438 . . . . 75.44 110.913 179.906 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 67' ' ' HIS . . . . . 0.508 ' CE1' HD11 ' A' ' 33' ' ' LEU . 2.6 t60 -108.78 112.0 24.05 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.188 -0.46 . . . . 44.02 110.811 179.864 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 68' ' ' PHE . . . . . 0.556 ' CE1' HG23 ' A' ' 114' ' ' ILE . 0.0 OUTLIER -102.95 145.11 30.34 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.181 -0.463 . . . . 51.35 110.878 -179.946 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 69' ' ' ALA . . . . . 0.628 ' HA ' HG22 ' A' ' 47' ' ' ILE . . . -122.32 110.74 16.05 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.135 -0.484 . . . . 54.32 111.124 179.911 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 70' ' ' MET . . . . . 0.503 ' CE ' HD11 ' A' ' 114' ' ' ILE . 3.9 mmt -76.04 86.46 2.94 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.222 -0.444 . . . . 65.32 110.848 -179.998 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -40.34 156.57 0.18 Allowed Pre-proline 0 C--N 1.33 -0.274 0 CA-C-O 121.579 0.704 . . . . 70.14 111.145 -179.944 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 72' ' ' PRO . . . . . 0.409 ' O ' HD22 ' A' ' 8' ' ' LEU . 54.0 Cg_endo -69.73 1.47 4.38 Favored 'Trans proline' 0 C--N 1.341 0.161 0 C-N-CA 122.687 2.258 . . . . 41.22 112.368 179.923 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 73' ' ' MET . . . . . 0.501 ' O ' ' CB ' ' A' ' 76' ' ' TYR . 0.0 OUTLIER -118.25 -26.14 6.4 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.192 -0.458 . . . . 73.31 110.909 179.908 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 74' ' ' TYR . . . . . 0.656 ' CD1' ' C ' ' A' ' 74' ' ' TYR . 0.0 OUTLIER -48.05 150.65 1.98 Allowed Pre-proline 0 C--N 1.328 -0.346 0 CA-C-O 121.659 0.742 . . . . 75.24 110.91 -179.864 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 75' ' ' PRO . . . . . 0.546 ' C ' ' HA ' ' A' ' 74' ' ' TYR . 54.3 Cg_endo -69.76 -11.12 11.79 Favored 'Cis proline' 0 C--N 1.34 0.129 0 C-N-CA 122.684 -1.798 . . . . 75.23 112.365 -0.09 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 76' ' ' TYR . . . . . 0.501 ' CB ' ' O ' ' A' ' 73' ' ' MET . 16.4 t80 -32.82 -53.9 0.35 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.199 -0.455 . . . . 72.25 110.949 -179.96 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 77' ' ' THR . . . . . 0.427 HG23 ' HB3' ' A' ' 73' ' ' MET . 29.6 p -106.98 171.44 7.37 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.075 -0.511 . . . . 43.42 111.162 -179.947 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -85.09 130.19 53.09 Favored Pre-proline 0 C--N 1.329 -0.325 0 CA-C-O 121.566 0.698 . . . . 43.21 111.107 179.881 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 79' ' ' PRO . . . . . 0.573 ' HG3' HD11 ' A' ' 113' ' ' ILE . 53.4 Cg_endo -69.8 174.13 9.99 Favored 'Trans proline' 0 C--N 1.341 0.168 0 C-N-CA 122.675 2.25 . . . . 43.52 112.338 -179.965 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -120.45 137.69 54.2 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.223 -0.444 . . . . 62.23 110.857 -179.962 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 81' ' ' ILE . . . . . 0.598 HD13 HD13 ' A' ' 117' ' ' ILE . 13.7 mt -143.68 150.13 17.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.136 -0.484 . . . . 62.35 111.163 179.953 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 82' ' ' GLU . . . . . 0.492 ' HG3' ' CD ' ' A' ' 84' ' ' LYS . 9.5 pt-20 -149.0 147.48 28.61 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.21 -0.45 . . . . 75.43 110.915 179.959 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 83' ' ' PHE . . . . . 0.584 ' CG ' HD22 ' A' ' 94' ' ' LEU . 15.2 m-85 -90.51 140.96 29.24 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.154 -0.476 . . . . 74.02 110.851 -179.901 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 84' ' ' LYS . . . . . 0.512 ' O ' ' N ' ' A' ' 86' ' ' VAL . 8.9 mmmt -124.57 174.43 7.83 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.166 -0.47 . . . . 71.04 110.91 179.919 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 85' ' ' ASN . . . . . 0.413 ' O ' ' CG2' ' A' ' 86' ' ' VAL . 6.0 m120 59.3 -75.75 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.215 -0.448 . . . . 73.14 110.915 179.998 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 86' ' ' VAL . . . . . 0.595 HG11 HD11 ' A' ' 94' ' ' LEU . 3.5 m 41.73 92.65 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.19 -0.459 . . . . 72.22 111.104 179.901 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -96.22 -77.82 0.47 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.189 -0.46 . . . . 64.5 110.861 -179.958 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -59.71 -56.82 17.09 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.202 -0.454 . . . . 61.25 110.881 -179.937 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 89' ' ' VAL . . . . . 0.664 HG21 ' HG ' ' A' ' 94' ' ' LEU . 2.1 p -51.07 136.68 9.95 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.19 -0.459 . . . . 74.31 111.158 179.887 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 90' ' ' MET . . . . . . . . . . . . . 6.8 mtm -88.97 -70.37 0.65 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.121 -0.491 . . . . 44.23 110.912 179.906 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 91' ' ' ASP . . . . . 0.433 ' HA ' HD12 ' A' ' 94' ' ' LEU . 10.3 t0 -175.19 -31.62 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.217 -0.447 . . . . 73.31 110.867 179.957 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -53.98 -46.76 71.78 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.191 -0.459 . . . . 71.4 110.85 -179.722 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 93' ' ' GLN . . . . . 0.545 ' HG3' ' CE1' ' A' ' 128' ' ' PHE . 1.7 mp0 -70.24 -37.69 75.01 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.158 -0.474 . . . . 63.23 110.908 -179.978 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 94' ' ' LEU . . . . . 0.664 ' HG ' HG21 ' A' ' 89' ' ' VAL . 48.1 mt -59.2 -47.54 84.94 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.203 -0.453 . . . . 74.33 110.96 179.995 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 1.7 mt-30 -61.42 -35.74 78.39 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.181 -0.463 . . . . 62.34 110.857 179.932 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 96' ' ' MET . . . . . . . . . . . . . 31.7 ttp -61.44 -42.25 98.46 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.21 -0.45 . . . . 74.4 110.827 -179.964 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 97' ' ' LEU . . . . . 0.643 HD22 HG22 ' A' ' 121' ' ' THR . 79.8 mt -60.02 -43.82 95.02 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.243 -0.435 . . . . 71.53 110.965 -179.995 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 98' ' ' LYS . . . . . 0.499 ' HD3' ' CE2' ' A' ' 83' ' ' PHE . 6.0 mmtp -55.49 -39.06 69.96 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.18 -0.464 . . . . 73.32 110.867 179.809 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 57.1 m -64.11 -40.2 95.69 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.25 -0.432 . . . . 60.43 110.862 -179.888 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 100' ' ' GLU . . . . . 0.575 ' OE1' ' CZ ' ' A' ' 120' ' ' PHE . 19.5 mm-40 -71.44 -27.24 63.14 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.116 -0.493 . . . . 73.31 110.91 -179.983 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 101' ' ' PHE . . . . . 0.745 ' CG ' HD11 ' A' ' 117' ' ' ILE . 10.5 m-30 -60.19 -31.12 69.84 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.173 -0.467 . . . . 64.35 110.856 -179.867 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 14.1 ttmt -73.92 -41.54 61.92 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.165 -0.47 . . . . 73.2 110.898 179.958 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 17.4 ttpp -69.82 -41.25 75.24 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.167 -0.469 . . . . 74.12 110.905 179.856 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 104' ' ' ILE . . . . . 0.562 HD12 ' O ' ' A' ' 100' ' ' GLU . 3.9 mt -64.45 -47.59 88.72 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 116.257 -0.429 . . . . 55.25 111.131 179.86 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 105' ' ' HIS . . . . . . . . . . . . . 2.1 t60 -62.82 -43.62 98.33 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.197 -0.456 . . . . 73.42 110.86 179.861 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -56.53 -43.3 79.69 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.196 -0.456 . . . . 72.22 110.872 -179.913 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 107' ' ' THR . . . . . 0.432 HG22 ' O ' ' A' ' 104' ' ' ILE . 9.9 t -77.87 -30.12 50.7 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.166 -0.47 . . . . 61.13 111.161 -179.991 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 108' ' ' SER . . . . . 0.425 ' CB ' HG22 ' A' ' 113' ' ' ILE . 27.0 m -107.05 33.08 4.15 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.221 -0.445 . . . . 71.32 110.846 -179.867 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 34.1 ttt180 -76.57 80.65 3.24 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.149 -0.478 . . . . 71.41 110.859 -179.93 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 151.21 -29.44 0.98 Allowed Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.694 -0.765 . . . . 51.11 112.484 -179.953 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 111' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -111.41 -164.43 0.92 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.784 0.326 . . . . 63.5 110.956 -179.909 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 12.2 mt-10 -67.23 133.87 50.56 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.234 -0.439 . . . . 63.22 110.839 -179.924 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 113' ' ' ILE . . . . . 0.573 HD11 ' HG3' ' A' ' 79' ' ' PRO . 2.8 pt -122.95 -16.94 5.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.096 -0.502 . . . . 44.21 111.121 179.986 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 114' ' ' ILE . . . . . 0.698 ' O ' HG23 ' A' ' 118' ' ' THR . 9.5 mm -57.18 -43.12 81.09 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 116.152 -0.476 . . . . 61.45 111.065 179.879 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 115' ' ' PHE . . . . . 0.678 ' HE1' HG21 ' A' ' 25' ' ' ILE . 20.0 t80 -70.58 -31.94 69.14 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.167 -0.47 . . . . 72.43 110.89 179.991 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 9.1 mm-40 -68.21 -47.79 66.9 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.144 -0.48 . . . . 72.01 110.862 -179.892 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 117' ' ' ILE . . . . . 0.745 HD11 ' CG ' ' A' ' 101' ' ' PHE . 0.7 OUTLIER -66.02 -42.34 91.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.134 -0.484 . . . . 71.03 111.117 -179.999 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 118' ' ' THR . . . . . 0.698 HG23 ' O ' ' A' ' 114' ' ' ILE . 70.8 p -68.01 -41.69 81.85 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.192 -0.458 . . . . 74.31 111.169 179.98 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 29.5 t -67.33 -39.71 85.84 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.199 -0.455 . . . . 71.41 110.858 -179.873 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 120' ' ' PHE . . . . . 0.575 ' CZ ' ' OE1' ' A' ' 100' ' ' GLU . 1.0 OUTLIER -67.13 -47.75 70.17 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.147 -0.479 . . . . 74.41 110.894 -179.923 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 121' ' ' THR . . . . . 0.774 HG21 HD11 ' A' ' 66' ' ' LEU . 34.8 p -65.44 -39.72 92.42 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.141 -0.481 . . . . 74.21 111.133 -179.955 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 37.6 tt0 -65.03 -47.04 78.85 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.223 -0.444 . . . . 75.4 110.907 -180.0 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 123' ' ' GLU . . . . . 0.438 ' CG ' ' N ' ' A' ' 124' ' ' LYS . 3.6 pt-20 -67.05 -44.42 80.19 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.231 -0.44 . . . . 64.45 110.88 -179.949 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 124' ' ' LYS . . . . . 0.59 ' O ' ' CE1' ' A' ' 128' ' ' PHE . 0.0 OUTLIER -70.78 -32.32 69.39 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.141 -0.481 . . . . 74.34 110.848 -180.0 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 125' ' ' LEU . . . . . 0.919 HD11 ' HB3' ' A' ' 62' ' ' SER . 1.9 tp -63.25 -42.42 99.17 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.221 -0.445 . . . . 75.24 110.91 179.933 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 126' ' ' ASP . . . . . 0.47 ' OD1' HG13 ' A' ' 55' ' ' VAL . 9.3 m-20 -59.65 -38.65 81.98 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.186 -0.461 . . . . 62.41 110.855 179.834 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 1.6 mt-10 -62.68 -36.12 81.88 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.142 -0.481 . . . . 74.42 110.862 -179.858 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 128' ' ' PHE . . . . . 0.59 ' CE1' ' O ' ' A' ' 124' ' ' LYS . 7.0 m-30 . . . . . 0 C--N 1.329 -0.308 0 CA-C-N 116.221 -0.445 . . . . 73.44 110.894 -179.93 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 60.5 mt . . . . . 0 C--O 1.231 0.091 0 CA-C-O 120.811 0.339 . . . . 74.1 110.924 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 9' ' ' ASP . . . . . 0.45 ' N ' ' OD1' ' A' ' 9' ' ' ASP . 0.8 OUTLIER -51.82 -35.23 43.63 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.18 -0.463 . . . . 55.11 110.844 179.886 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 71.5 mm-40 -65.23 -40.42 94.03 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.238 -0.437 . . . . 74.44 110.914 -179.952 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 13.6 m-85 -54.69 -23.15 16.21 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.199 -0.455 . . . . 74.12 110.909 -179.862 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER -57.48 -36.39 71.41 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.124 -0.489 . . . . 71.43 110.974 -179.938 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 13' ' ' GLU . . . . . 0.496 ' HG3' ' N ' ' A' ' 14' ' ' ILE . 4.8 pt-20 -62.24 -42.09 99.01 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.084 -0.507 . . . . 72.33 110.898 179.957 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 14' ' ' ILE . . . . . 0.496 ' N ' ' HG3' ' A' ' 13' ' ' GLU . 3.9 mp -68.52 -42.75 83.88 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-N 116.147 -0.478 . . . . 75.11 111.142 179.989 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 15' ' ' GLN . . . . . 0.585 ' OE1' ' CE1' ' A' ' 74' ' ' TYR . 10.8 mm-40 -66.06 -45.9 79.71 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.184 -0.462 . . . . 35.51 110.906 179.931 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 43.2 t -59.56 -41.53 90.33 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.185 -0.461 . . . . 45.34 110.882 -179.929 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -59.71 -33.65 71.89 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.208 -0.451 . . . . 73.13 110.918 -179.925 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 7.6 mt-10 -62.67 -38.09 89.0 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.162 -0.472 . . . . 74.32 110.906 -179.997 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.464 ' CD2' HG13 ' A' ' 46' ' ' ILE . 9.9 mp -66.65 -51.64 53.86 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.122 -0.49 . . . . 53.32 110.887 -179.955 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 3.0 pt-20 -68.74 -32.7 72.67 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.18 -0.464 . . . . 72.33 110.881 179.94 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -66.66 -48.33 69.72 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.186 -0.461 . . . . 53.52 111.113 179.923 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 22' ' ' ILE . . . . . 0.638 HD11 ' HB2' ' A' ' 115' ' ' PHE . 0.9 OUTLIER -75.85 -34.68 28.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.22 -0.446 . . . . 74.41 111.116 179.984 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -55.55 -34.44 64.74 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.169 -0.469 . . . . 65.03 110.833 -179.993 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -64.96 -35.73 82.12 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.254 -0.43 . . . . 61.4 110.861 -179.816 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 25' ' ' ILE . . . . . 0.663 HG21 ' HE1' ' A' ' 115' ' ' PHE . 3.1 mt -82.86 -41.23 17.16 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.125 -0.489 . . . . 63.11 111.139 179.967 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 23.0 m-85 -109.9 45.36 1.1 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.158 -0.474 . . . . 65.34 110.899 -179.97 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 1.8 mtm -43.55 -53.64 5.45 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.144 -0.48 . . . . 54.32 110.891 179.884 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -94.85 -20.86 19.08 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.18 -0.464 . . . . 71.22 110.836 -179.985 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -88.32 19.76 3.62 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.166 -0.47 . . . . 72.04 110.887 -179.984 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 30' ' ' PHE . . . . . 0.66 ' HA ' HD13 ' A' ' 50' ' ' ILE . 1.9 t80 -105.97 145.96 30.66 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.23 -0.441 . . . . 74.53 110.887 -179.887 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 40.1 m -125.71 133.41 52.13 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.121 -0.491 . . . . 52.55 111.077 -179.849 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 1.1 t0 -97.94 115.5 28.27 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.188 -0.46 . . . . 73.54 110.891 179.882 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 1.107 HD23 ' N ' ' A' ' 34' ' ' THR . 0.1 OUTLIER -118.91 -21.21 7.85 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.2 -0.454 . . . . 71.11 110.908 -179.92 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 34' ' ' THR . . . . . 1.107 ' N ' HD23 ' A' ' 33' ' ' LEU . 2.1 m . . . . . 0 C--N 1.33 -0.269 0 CA-C-N 116.183 -0.462 . . . . 53.43 111.158 179.922 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 45' ' ' GLN . . . . . 0.961 ' HG2' HG23 ' A' ' 47' ' ' ILE . 0.1 OUTLIER . . . . . 0 C--O 1.232 0.144 0 CA-C-O 120.791 0.329 . . . . 74.21 110.959 . . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 46' ' ' ILE . . . . . 0.649 HG22 ' O ' ' A' ' 45' ' ' GLN . 0.1 OUTLIER 86.75 -12.55 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.199 -0.455 . . . . 75.45 111.136 179.964 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 47' ' ' ILE . . . . . 0.961 HG23 ' HG2' ' A' ' 45' ' ' GLN . 0.1 OUTLIER -52.41 149.18 1.36 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.157 -0.474 . . . . 72.1 111.143 179.836 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 48' ' ' PHE . . . . . 0.925 ' HA ' HD22 ' A' ' 33' ' ' LEU . 30.2 p90 -161.88 162.8 29.41 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.197 -0.456 . . . . 75.52 110.909 179.945 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 49' ' ' GLU . . . . . 0.768 ' CG ' HD13 ' A' ' 33' ' ' LEU . 5.8 mt-10 -111.91 159.74 18.09 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.146 -0.479 . . . . 74.32 110.908 -179.911 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 50' ' ' ILE . . . . . 0.66 HD13 ' HA ' ' A' ' 30' ' ' PHE . 13.1 mm -135.25 142.7 39.1 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 116.191 -0.459 . . . . 74.13 111.143 179.961 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 83.9 m -84.88 129.58 34.79 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.185 -0.461 . . . . 63.43 111.116 179.984 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 52' ' ' LEU . . . . . 0.464 ' HA ' HD23 ' A' ' 52' ' ' LEU . 12.0 mt -135.74 155.58 50.15 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.18 -0.464 . . . . 71.3 110.916 179.948 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -175.15 165.56 3.4 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.213 -0.449 . . . . 73.31 110.853 179.93 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -54.93 170.65 0.17 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.191 -0.459 . . . . 71.44 110.847 -179.785 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 18.7 m -84.43 -22.65 7.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.133 -0.485 . . . . 74.41 111.105 179.978 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -115.9 -176.99 3.05 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.151 -0.477 . . . . 75.24 110.846 179.995 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 6.1 mmmm -115.63 -7.28 12.17 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.192 -0.458 . . . . 72.43 110.927 179.955 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 58' ' ' GLU . . . . . 0.551 ' HA ' ' C ' ' A' ' 59' ' ' PRO . 44.6 mt-10 -129.01 148.17 67.89 Favored Pre-proline 0 C--N 1.33 -0.269 0 CA-C-O 121.652 0.739 . . . . 74.52 110.867 179.986 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 59' ' ' PRO . . . . . 0.551 ' C ' ' HA ' ' A' ' 58' ' ' GLU . 54.0 Cg_endo -69.73 -3.51 7.7 Favored 'Cis proline' 0 C--N 1.342 0.185 0 C-N-CA 122.686 -1.798 . . . . 63.44 112.369 -0.035 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 60' ' ' VAL . . . . . 0.424 HG21 ' CG ' ' A' ' 88' ' ' ASN . 18.6 m -148.44 179.06 0.74 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.235 -0.439 . . . . 70.32 111.132 179.94 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 61' ' ' GLU . . . . . 0.437 ' O ' ' C ' ' A' ' 62' ' ' SER . 8.7 tt0 -107.28 -17.17 14.21 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.137 -0.483 . . . . 61.54 110.886 -179.988 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 62' ' ' SER . . . . . 0.592 ' CB ' HD21 ' A' ' 125' ' ' LEU . 1.0 OUTLIER 34.15 91.0 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.137 -0.483 . . . . 34.33 110.829 -179.807 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 35.1 t -112.71 122.98 49.26 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.127 -0.488 . . . . 45.13 110.86 -179.856 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 64' ' ' ILE . . . . . 0.799 HD13 HD21 ' A' ' 94' ' ' LEU . 17.8 mt -136.53 138.63 46.36 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.121 -0.49 . . . . 63.44 111.141 179.959 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 90.5 m -104.38 113.89 27.75 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.2 -0.455 . . . . 75.15 111.112 179.974 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 66' ' ' LEU . . . . . 0.98 HD11 HG21 ' A' ' 121' ' ' THR . 7.1 mt -93.06 113.26 25.48 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.197 -0.456 . . . . 71.14 110.883 179.972 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 67' ' ' HIS . . . . . 0.624 ' CE1' HD11 ' A' ' 33' ' ' LEU . 12.6 t60 -105.13 112.56 25.73 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.179 -0.464 . . . . 72.11 110.859 179.872 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 68' ' ' PHE . . . . . 0.598 ' CZ ' HG23 ' A' ' 114' ' ' ILE . 0.0 OUTLIER -103.65 139.88 38.33 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.183 -0.462 . . . . 54.11 110.889 -179.927 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 69' ' ' ALA . . . . . 0.457 ' HA ' HG22 ' A' ' 47' ' ' ILE . . . -114.47 115.67 27.62 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.14 -0.482 . . . . 65.13 111.081 179.949 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 70' ' ' MET . . . . . 0.48 ' HE2' HD11 ' A' ' 114' ' ' ILE . 5.9 mmt -79.11 102.25 8.34 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.229 -0.441 . . . . 62.35 110.84 179.99 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -60.84 153.95 61.49 Favored Pre-proline 0 C--N 1.33 -0.255 0 CA-C-O 121.632 0.729 . . . . 74.32 111.123 -179.956 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_endo -69.73 0.47 5.57 Favored 'Trans proline' 0 C--N 1.341 0.18 0 C-N-CA 122.643 2.229 . . . . 64.15 112.342 179.906 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 73' ' ' MET . . . . . 0.657 ' HB3' HG23 ' A' ' 77' ' ' THR . 0.0 OUTLIER -114.38 -26.92 7.77 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.236 -0.438 . . . . 55.14 110.932 179.858 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 74' ' ' TYR . . . . . 0.639 ' CD1' ' C ' ' A' ' 74' ' ' TYR . 0.0 OUTLIER -47.3 149.38 1.86 Allowed Pre-proline 0 C--N 1.328 -0.349 0 CA-C-O 121.673 0.749 . . . . 74.34 110.881 -179.853 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 75' ' ' PRO . . . . . 0.551 ' C ' ' HA ' ' A' ' 74' ' ' TYR . 53.2 Cg_endo -69.78 -13.12 12.39 Favored 'Cis proline' 0 C--N 1.341 0.175 0 C-N-CA 122.709 -1.788 . . . . 61.02 112.342 -0.031 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 76' ' ' TYR . . . . . 0.476 ' CB ' ' O ' ' A' ' 73' ' ' MET . 3.3 t80 -33.44 -52.4 0.38 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.211 -0.449 . . . . 75.41 110.934 -179.91 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 77' ' ' THR . . . . . 0.657 HG23 ' HB3' ' A' ' 73' ' ' MET . 43.1 p -106.37 -176.6 3.12 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.099 -0.5 . . . . 52.43 111.189 179.99 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -105.88 130.39 23.09 Favored Pre-proline 0 C--N 1.328 -0.338 0 CA-C-O 121.597 0.713 . . . . 53.53 111.113 179.865 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 79' ' ' PRO . . . . . 0.842 ' HG3' HD11 ' A' ' 113' ' ' ILE . 53.6 Cg_endo -69.79 -170.88 0.42 Allowed 'Trans proline' 0 C--N 1.342 0.228 0 C-N-CA 122.66 2.24 . . . . 72.32 112.344 -179.949 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 80' ' ' GLU . . . . . 0.468 ' HG3' ' N ' ' A' ' 81' ' ' ILE . 0.4 OUTLIER -123.88 142.12 51.41 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.246 -0.434 . . . . 71.41 110.922 -179.957 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 81' ' ' ILE . . . . . 0.736 ' CG2' HD22 ' A' ' 66' ' ' LEU . 2.3 mm -131.37 143.25 41.15 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.176 -0.465 . . . . 74.11 111.147 179.972 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 82' ' ' GLU . . . . . 0.481 ' HG3' ' CD ' ' A' ' 84' ' ' LYS . 4.3 pt-20 -148.58 142.07 25.35 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.182 -0.463 . . . . 74.24 110.856 179.973 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 83' ' ' PHE . . . . . 0.792 ' CG ' HD22 ' A' ' 94' ' ' LEU . 36.4 m-85 -95.19 141.37 28.88 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.13 -0.487 . . . . 72.11 110.902 -179.972 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 84' ' ' LYS . . . . . 0.484 ' O ' ' N ' ' A' ' 86' ' ' VAL . 7.7 mmmt -124.17 170.26 10.9 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.116 -0.493 . . . . 73.45 110.896 179.967 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 3.3 m120 60.55 -75.68 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.209 -0.451 . . . . 73.32 110.904 179.954 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 86' ' ' VAL . . . . . 1.125 HG11 HD11 ' A' ' 94' ' ' LEU . 2.5 m 40.3 93.42 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-N 116.21 -0.45 . . . . 64.24 111.146 179.91 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -93.72 -93.61 0.17 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.1 -0.5 . . . . 63.03 110.923 -179.992 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 88' ' ' ASN . . . . . 0.424 ' CG ' HG21 ' A' ' 60' ' ' VAL . 1.3 t30 -44.44 -48.45 9.96 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.197 -0.456 . . . . 75.03 110.907 -179.931 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 89' ' ' VAL . . . . . 0.675 HG11 HD11 ' A' ' 64' ' ' ILE . 2.0 p -60.1 141.11 17.16 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.171 -0.468 . . . . 72.24 111.119 179.908 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 90' ' ' MET . . . . . . . . . . . . . 5.5 mtm -92.55 -63.98 1.16 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.182 -0.463 . . . . 72.32 110.883 179.911 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 1.4 t0 173.88 -27.44 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.231 -0.441 . . . . 74.54 110.907 -179.997 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -54.38 -47.05 73.12 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.194 -0.457 . . . . 70.22 110.859 -179.745 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 93' ' ' GLN . . . . . 0.435 ' HB2' ' CD2' ' A' ' 128' ' ' PHE . 0.8 OUTLIER -71.08 -36.94 72.44 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.14 -0.482 . . . . 75.24 110.934 179.999 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 94' ' ' LEU . . . . . 1.125 HD11 HG11 ' A' ' 86' ' ' VAL . 21.9 mt -57.95 -44.21 86.87 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.198 -0.456 . . . . 72.31 110.922 -179.983 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 2.9 mm-40 -63.76 -35.26 80.0 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.203 -0.453 . . . . 72.51 110.873 179.954 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 96' ' ' MET . . . . . . . . . . . . . 23.1 ttp -59.99 -44.35 94.58 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.226 -0.443 . . . . 75.13 110.918 179.935 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 97' ' ' LEU . . . . . 0.525 HD22 ' HA ' ' A' ' 121' ' ' THR . 34.5 mt -57.79 -41.95 83.13 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.246 -0.434 . . . . 54.34 110.903 179.987 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 98' ' ' LYS . . . . . 0.436 ' HD3' ' CE2' ' A' ' 83' ' ' PHE . 12.9 mmtm -54.64 -37.09 65.26 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.151 -0.477 . . . . 62.44 110.927 179.819 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -68.81 -41.97 77.92 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.249 -0.432 . . . . 73.21 110.877 -179.894 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -69.17 -26.01 64.64 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.105 -0.498 . . . . 62.41 110.869 -179.98 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 101' ' ' PHE . . . . . 0.796 ' CD2' HD11 ' A' ' 117' ' ' ILE . 10.6 m-30 -59.7 -33.12 71.19 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.161 -0.472 . . . . 72.23 110.895 -179.92 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -63.99 -44.13 93.62 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.155 -0.475 . . . . 73.33 110.899 179.948 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.86 -36.17 77.79 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.238 -0.437 . . . . 73.01 110.934 179.846 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 104' ' ' ILE . . . . . 0.429 ' O ' HG22 ' A' ' 107' ' ' THR . 5.2 mt -63.22 -47.65 91.25 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.216 -0.447 . . . . 64.42 111.128 179.865 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 105' ' ' HIS . . . . . . . . . . . . . 5.9 t60 -62.96 -41.8 99.64 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.209 -0.45 . . . . 75.43 110.872 179.86 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -58.91 -43.6 91.1 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.231 -0.44 . . . . 72.31 110.896 -179.958 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 107' ' ' THR . . . . . 0.429 HG22 ' O ' ' A' ' 104' ' ' ILE . 10.2 t -76.75 -27.9 55.54 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.144 -0.48 . . . . 74.33 111.152 -179.973 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 60.2 m -114.37 37.44 3.37 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.188 -0.46 . . . . 71.44 110.883 -179.83 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 18.7 ttt180 -81.6 77.44 8.45 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.088 -0.506 . . . . 64.04 110.88 -179.949 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 154.1 -15.12 0.58 Allowed Glycine 0 N--CA 1.451 -0.334 0 C-N-CA 120.757 -0.735 . . . . 51.22 112.493 -179.97 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 111' ' ' GLN . . . . . . . . . . . . . 14.3 pt20 -130.0 -166.21 1.64 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.754 0.311 . . . . 74.41 110.901 -179.886 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 66.1 mt-10 -61.4 131.87 51.65 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.158 -0.474 . . . . 65.4 110.918 -179.921 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 113' ' ' ILE . . . . . 0.842 HD11 ' HG3' ' A' ' 79' ' ' PRO . 20.6 pt -121.25 -8.11 9.91 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-N 116.163 -0.472 . . . . 73.15 111.128 179.966 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 114' ' ' ILE . . . . . 0.603 ' O ' HG23 ' A' ' 118' ' ' THR . 27.7 mm -66.52 -44.77 90.05 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-N 116.153 -0.476 . . . . 75.44 111.175 179.867 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 115' ' ' PHE . . . . . 0.663 ' HE1' HG21 ' A' ' 25' ' ' ILE . 28.8 t80 -68.04 -33.47 74.64 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.195 -0.457 . . . . 73.24 110.856 179.894 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 -67.79 -47.02 70.32 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.195 -0.457 . . . . 42.52 110.937 -179.928 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 117' ' ' ILE . . . . . 0.796 HD11 ' CD2' ' A' ' 101' ' ' PHE . 0.4 OUTLIER -64.18 -39.4 85.35 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.103 -0.499 . . . . 74.23 111.151 179.946 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 118' ' ' THR . . . . . 0.603 HG23 ' O ' ' A' ' 114' ' ' ILE . 74.2 p -68.19 -43.38 78.23 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.158 -0.474 . . . . 73.2 111.144 179.956 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -63.0 -44.09 96.99 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.258 -0.428 . . . . 72.32 110.906 -179.88 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -68.29 -46.62 69.83 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.103 -0.498 . . . . 72.13 110.883 -179.964 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 121' ' ' THR . . . . . 0.98 HG21 HD11 ' A' ' 66' ' ' LEU . 14.7 p -62.97 -39.18 93.91 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.089 -0.505 . . . . 75.41 111.148 -179.905 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 7.2 tp-100 -65.71 -45.14 83.87 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.218 -0.446 . . . . 64.14 110.958 179.999 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 6.4 pt-20 -74.0 -29.89 62.19 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.148 -0.478 . . . . 72.14 110.881 -179.952 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 124' ' ' LYS . . . . . 0.501 ' HA ' ' CE ' ' A' ' 124' ' ' LYS . 0.0 OUTLIER -75.51 -45.48 37.95 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.165 -0.47 . . . . 74.53 110.894 179.971 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 125' ' ' LEU . . . . . 0.98 HD13 ' N ' ' A' ' 126' ' ' ASP . 0.0 OUTLIER -69.5 -42.84 74.22 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.205 -0.452 . . . . 73.44 110.957 179.917 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 126' ' ' ASP . . . . . 0.98 ' N ' HD13 ' A' ' 125' ' ' LEU . 14.3 t0 -60.25 -45.69 92.39 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.181 -0.463 . . . . 73.02 110.893 179.804 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 127' ' ' GLU . . . . . 0.489 ' HG3' ' N ' ' A' ' 128' ' ' PHE . 0.3 OUTLIER -60.94 -27.86 68.53 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.227 -0.442 . . . . 72.53 110.87 -179.922 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 128' ' ' PHE . . . . . 0.489 ' N ' ' HG3' ' A' ' 127' ' ' GLU . 0.1 OUTLIER . . . . . 0 C--N 1.328 -0.335 0 CA-C-N 116.194 -0.457 . . . . 55.1 110.922 -179.95 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 8' ' ' LEU . . . . . 0.636 HD13 ' O ' ' A' ' 72' ' ' PRO . 19.3 mt . . . . . 0 C--O 1.232 0.146 0 CA-C-O 120.815 0.34 . . . . 75.32 110.917 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 9' ' ' ASP . . . . . 0.42 ' OD1' ' N ' ' A' ' 9' ' ' ASP . 0.4 OUTLIER -55.63 -28.0 52.84 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.188 -0.46 . . . . 75.44 110.903 179.842 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 75.1 mm-40 -68.05 -36.79 80.45 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.227 -0.442 . . . . 45.4 110.895 -179.931 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 23.8 m-85 -63.94 -25.78 68.29 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.206 -0.452 . . . . 73.13 110.927 -179.879 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -59.4 -37.55 78.28 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.144 -0.48 . . . . 73.55 110.913 -179.916 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 2.2 mm-40 -60.23 -45.42 93.28 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.149 -0.478 . . . . 60.02 110.898 -179.985 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 3.7 mp -68.03 -41.06 84.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.098 -0.501 . . . . 70.22 111.166 179.954 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 15' ' ' GLN . . . . . 0.427 ' HG2' ' CB ' ' A' ' 70' ' ' MET . 0.8 OUTLIER -63.16 -47.87 80.84 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.207 -0.451 . . . . 72.41 110.961 179.895 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 3.8 t -58.83 -43.17 90.62 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.179 -0.464 . . . . 71.43 110.859 -179.938 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 1.1 t30 -57.79 -33.65 68.77 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.192 -0.458 . . . . 74.31 110.898 -179.854 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 4.9 mt-10 -66.1 -37.7 86.4 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.155 -0.475 . . . . 70.32 110.87 179.99 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.446 ' CD2' HG13 ' A' ' 46' ' ' ILE . 9.7 mp -64.99 -51.53 61.18 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.199 -0.455 . . . . 75.4 110.897 -179.939 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 1.5 pt-20 -68.58 -33.49 74.16 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.2 -0.455 . . . . 65.11 110.837 179.977 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -65.89 -49.63 67.37 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.214 -0.448 . . . . 74.12 111.116 179.967 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 22' ' ' ILE . . . . . 0.73 HD11 ' HB2' ' A' ' 115' ' ' PHE . 0.6 OUTLIER -74.9 -34.41 32.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.2 -0.455 . . . . 60.41 111.172 179.928 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 4.1 mtp180 -52.32 -36.61 53.74 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.126 -0.488 . . . . 74.02 110.88 179.957 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -63.5 -34.14 77.12 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.188 -0.46 . . . . 64.44 110.837 -179.777 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 25' ' ' ILE . . . . . 0.763 HD13 ' CE1' ' A' ' 115' ' ' PHE . 3.3 mt -82.73 -43.52 18.8 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.145 -0.48 . . . . 71.11 111.155 179.922 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 26.6 m-85 -108.82 46.62 0.96 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.156 -0.475 . . . . 75.04 110.929 -179.972 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 1.2 mtm -46.02 -58.35 3.66 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.099 -0.5 . . . . 73.13 110.846 179.948 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 20.2 m-20 -92.06 -5.65 52.47 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.259 -0.428 . . . . 74.11 110.881 179.952 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 29' ' ' ASP . . . . . 0.448 ' O ' HG23 ' A' ' 50' ' ' ILE . 1.7 m-20 -102.96 30.28 4.9 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.213 -0.449 . . . . 72.33 110.865 179.991 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 30' ' ' PHE . . . . . 0.556 ' CE2' ' HB2' ' A' ' 48' ' ' PHE . 8.8 t80 -117.72 144.09 45.6 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.216 -0.447 . . . . 65.4 110.901 -179.93 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 21.9 m -123.52 133.07 54.05 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.152 -0.477 . . . . 71.44 111.115 -179.905 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -94.36 114.23 26.25 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.197 -0.456 . . . . 73.13 110.879 179.907 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.8 HD21 HG12 ' A' ' 47' ' ' ILE . 1.7 pt? -113.52 -14.49 12.69 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.231 -0.44 . . . . 74.43 110.92 -179.947 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 34' ' ' THR . . . . . 0.407 ' O ' ' O ' ' A' ' 33' ' ' LEU . 0.2 OUTLIER . . . . . 0 C--N 1.329 -0.286 0 CA-C-N 116.148 -0.478 . . . . 42.44 111.147 179.966 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 45' ' ' GLN . . . . . 0.573 ' O ' HG22 ' A' ' 46' ' ' ILE . 31.5 tt0 . . . . . 0 C--O 1.232 0.14 0 CA-C-O 120.762 0.315 . . . . 75.45 110.918 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 46' ' ' ILE . . . . . 0.638 ' O ' HG23 ' A' ' 46' ' ' ILE . 0.0 OUTLIER 84.63 5.65 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.247 -0.433 . . . . 65.03 111.125 179.951 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 47' ' ' ILE . . . . . 0.8 HG12 HD21 ' A' ' 33' ' ' LEU . 0.2 OUTLIER -63.54 141.57 17.97 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.159 -0.473 . . . . 64.45 111.15 179.82 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 48' ' ' PHE . . . . . 0.556 ' HB2' ' CE2' ' A' ' 30' ' ' PHE . 8.5 p90 -147.44 150.53 34.8 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.126 -0.488 . . . . 64.52 110.882 179.964 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 49' ' ' GLU . . . . . 0.537 ' CG ' HD13 ' A' ' 33' ' ' LEU . 11.5 mt-10 -108.46 157.15 18.7 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.15 -0.477 . . . . 71.43 110.866 -179.903 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 50' ' ' ILE . . . . . 0.538 HD13 ' HA ' ' A' ' 30' ' ' PHE . 26.0 mm -136.15 141.87 40.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.159 -0.473 . . . . 74.43 111.126 179.969 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 52.8 m -89.39 126.36 35.51 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.197 -0.456 . . . . 71.02 111.125 179.949 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 52' ' ' LEU . . . . . 0.661 HD12 HD12 ' A' ' 66' ' ' LEU . 23.7 mt -130.34 162.05 29.93 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.212 -0.449 . . . . 73.11 110.921 179.95 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -179.26 173.88 1.08 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.207 -0.452 . . . . 72.24 110.859 179.919 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -64.69 166.66 8.42 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.207 -0.451 . . . . 73.32 110.857 -179.78 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 16.4 m -77.73 -28.56 15.74 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.11 -0.495 . . . . 74.12 111.099 179.988 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 3.1 t0 -118.78 -168.16 1.5 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.191 -0.459 . . . . 71.51 110.88 179.878 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 1.3 mmmp? -118.04 -16.81 9.79 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.208 -0.451 . . . . 73.41 110.877 -179.953 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 58' ' ' GLU . . . . . 0.563 ' HA ' ' C ' ' A' ' 59' ' ' PRO . 43.0 mt-10 -118.27 143.05 32.26 Favored Pre-proline 0 C--N 1.329 -0.31 0 CA-C-O 121.597 0.713 . . . . 71.13 110.921 179.969 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 59' ' ' PRO . . . . . 0.563 ' C ' ' HA ' ' A' ' 58' ' ' GLU . 53.6 Cg_endo -69.83 -10.89 11.87 Favored 'Cis proline' 0 C--O 1.232 0.191 0 C-N-CA 122.701 -1.791 . . . . 60.25 112.324 0.095 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 60' ' ' VAL . . . . . 0.445 ' HB ' ' CG ' ' A' ' 88' ' ' ASN . 9.4 m -149.41 172.11 1.68 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.236 -0.438 . . . . 65.22 111.128 179.91 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 61' ' ' GLU . . . . . 0.447 ' O ' ' C ' ' A' ' 62' ' ' SER . 1.0 OUTLIER -109.23 -16.64 14.02 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.155 -0.475 . . . . 54.02 110.879 -179.929 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 62' ' ' SER . . . . . 0.484 ' HB3' HD11 ' A' ' 125' ' ' LEU . 0.3 OUTLIER 34.2 88.54 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.137 -0.483 . . . . 61.24 110.888 -179.802 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 15.6 t -105.93 123.44 47.99 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.131 -0.486 . . . . 70.02 110.842 -179.799 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 64' ' ' ILE . . . . . 0.529 HD13 HD11 ' A' ' 94' ' ' LEU . 50.3 mt -141.01 137.88 34.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.124 -0.489 . . . . 73.51 111.172 179.937 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 62.5 m -97.68 114.75 26.78 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.173 -0.467 . . . . 71.43 111.206 179.918 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 66' ' ' LEU . . . . . 0.661 HD12 HD12 ' A' ' 52' ' ' LEU . 11.0 mt -91.46 111.85 23.52 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.221 -0.445 . . . . 44.31 110.96 179.951 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 1.1 t60 -107.72 112.29 24.9 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.209 -0.451 . . . . 73.32 110.839 179.899 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 68' ' ' PHE . . . . . 0.593 ' CZ ' HG23 ' A' ' 114' ' ' ILE . 0.0 OUTLIER -103.19 141.06 36.52 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.18 -0.464 . . . . 72.11 110.857 -179.91 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -122.43 128.72 51.26 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.161 -0.472 . . . . 74.33 111.101 179.893 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 70' ' ' MET . . . . . 0.427 ' CB ' ' HG2' ' A' ' 15' ' ' GLN . 0.1 OUTLIER -94.6 110.08 21.93 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.222 -0.445 . . . . 75.12 110.905 179.959 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -62.38 157.98 51.37 Favored Pre-proline 0 C--N 1.33 -0.257 0 CA-C-O 121.61 0.719 . . . . 62.33 111.157 -179.931 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 72' ' ' PRO . . . . . 0.636 ' O ' HD13 ' A' ' 8' ' ' LEU . 53.8 Cg_endo -69.78 2.52 3.47 Favored 'Trans proline' 0 C--N 1.342 0.2 0 C-N-CA 122.695 2.264 . . . . 71.03 112.318 179.989 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 73' ' ' MET . . . . . 0.507 ' O ' ' CB ' ' A' ' 76' ' ' TYR . 1.3 mtp -120.01 -25.39 5.8 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.23 -0.441 . . . . 52.23 110.854 179.952 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 74' ' ' TYR . . . . . 0.648 ' CD1' ' C ' ' A' ' 74' ' ' TYR . 0.1 OUTLIER -47.89 148.65 2.72 Favored Pre-proline 0 C--N 1.329 -0.325 0 CA-C-O 121.699 0.762 . . . . 62.42 110.885 -179.84 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 75' ' ' PRO . . . . . 0.553 ' C ' ' HA ' ' A' ' 74' ' ' TYR . 53.7 Cg_endo -69.8 -14.41 12.56 Favored 'Cis proline' 0 C--N 1.342 0.207 0 C-N-CA 122.631 -1.82 . . . . 75.32 112.348 -0.051 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 76' ' ' TYR . . . . . 0.507 ' CB ' ' O ' ' A' ' 73' ' ' MET . 10.3 t80 -33.36 -45.14 0.15 Allowed 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.215 -0.448 . . . . 75.41 110.928 -179.926 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 77' ' ' THR . . . . . 0.482 HG23 ' CB ' ' A' ' 73' ' ' MET . 59.7 p -110.82 178.12 4.46 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.077 -0.51 . . . . 73.02 111.147 -179.957 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -94.81 133.22 26.9 Favored Pre-proline 0 C--N 1.329 -0.301 0 CA-C-O 121.571 0.7 . . . . 54.2 111.091 179.856 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 79' ' ' PRO . . . . . 0.488 ' HG3' ' CD1' ' A' ' 113' ' ' ILE . 53.9 Cg_endo -69.74 -163.74 0.11 Allowed 'Trans proline' 0 C--N 1.341 0.138 0 C-N-CA 122.687 2.258 . . . . 54.44 112.32 -179.985 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 80' ' ' GLU . . . . . 0.4 ' O ' HG13 ' A' ' 81' ' ' ILE . 3.3 tt0 -148.52 136.61 21.0 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.192 -0.458 . . . . 24.33 110.884 -179.996 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 81' ' ' ILE . . . . . 0.533 HD13 HD13 ' A' ' 117' ' ' ILE . 12.4 mt -143.51 150.53 17.3 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.147 -0.479 . . . . 63.13 111.101 179.995 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 82' ' ' GLU . . . . . 0.494 ' HG3' ' CD ' ' A' ' 84' ' ' LYS . 10.1 pt-20 -147.69 148.25 30.83 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.156 -0.474 . . . . 72.41 110.871 179.956 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 83' ' ' PHE . . . . . 0.508 ' CZ ' ' HD3' ' A' ' 98' ' ' LYS . 8.0 m-85 -88.28 140.84 29.06 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.149 -0.478 . . . . 75.02 110.871 -179.92 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 84' ' ' LYS . . . . . 0.494 ' CD ' ' HG3' ' A' ' 82' ' ' GLU . 7.8 mmmt -125.68 174.57 8.2 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.179 -0.464 . . . . 72.33 110.91 179.927 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 85' ' ' ASN . . . . . 0.419 ' C ' HG22 ' A' ' 86' ' ' VAL . 3.8 m120 61.99 -74.32 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.214 -0.448 . . . . 64.41 110.882 179.938 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 86' ' ' VAL . . . . . 0.867 HG11 HD21 ' A' ' 94' ' ' LEU . 3.5 m 41.42 90.53 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.227 -0.442 . . . . 63.03 111.132 179.924 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -102.89 -67.8 0.86 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.141 -0.481 . . . . 73.21 110.962 -179.992 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 88' ' ' ASN . . . . . 0.445 ' CG ' ' HB ' ' A' ' 60' ' ' VAL . 13.3 m120 -88.24 55.46 3.44 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.212 -0.449 . . . . 74.13 110.857 -179.958 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 89' ' ' VAL . . . . . 0.723 HG21 HD13 ' A' ' 94' ' ' LEU . 1.6 p -156.21 138.48 6.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.171 -0.468 . . . . 73.34 111.102 179.891 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 90' ' ' MET . . . . . . . . . . . . . 11.2 mtm -83.95 -71.17 0.52 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.146 -0.479 . . . . 73.02 110.863 179.949 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 1.1 p30 176.9 -28.67 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.2 -0.454 . . . . 52.34 110.874 179.923 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -53.85 -44.11 70.07 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.228 -0.442 . . . . 74.14 110.824 -179.791 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 93' ' ' GLN . . . . . 0.527 ' HG3' ' CE2' ' A' ' 128' ' ' PHE . 0.1 OUTLIER -70.55 -38.55 74.17 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.129 -0.487 . . . . 73.14 110.892 -179.922 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 94' ' ' LEU . . . . . 0.867 HD21 HG11 ' A' ' 86' ' ' VAL . 0.1 OUTLIER -58.99 -49.2 78.78 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.192 -0.458 . . . . 73.4 110.891 -179.972 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 26.6 mt-30 -62.84 -34.69 77.86 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.203 -0.453 . . . . 65.25 110.938 179.911 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 96' ' ' MET . . . . . . . . . . . . . 24.2 ttp -61.12 -37.7 83.74 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.2 -0.454 . . . . 53.51 110.861 179.949 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 97' ' ' LEU . . . . . 0.945 HD22 HG22 ' A' ' 121' ' ' THR . 83.5 mt -65.33 -43.13 91.93 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.264 -0.425 . . . . 75.11 110.94 179.992 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 98' ' ' LYS . . . . . 0.508 ' HD3' ' CZ ' ' A' ' 83' ' ' PHE . 6.7 mmtp -58.67 -36.68 74.54 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.164 -0.471 . . . . 54.41 110.922 179.853 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -64.2 -44.93 90.46 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.187 -0.46 . . . . 75.23 110.817 -179.899 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 100' ' ' GLU . . . . . 0.511 ' HG2' ' CE1' ' A' ' 120' ' ' PHE . 2.5 mp0 -69.62 -25.39 63.92 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.137 -0.483 . . . . 71.54 110.868 -179.9 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 101' ' ' PHE . . . . . 0.793 ' CG ' HD11 ' A' ' 117' ' ' ILE . 11.9 m-30 -60.06 -34.98 74.16 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.185 -0.461 . . . . 74.34 110.896 -179.927 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 4.2 tppp? -70.79 -38.78 73.39 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.187 -0.461 . . . . 73.51 110.877 179.954 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 25.2 mtmm -70.39 -42.9 71.11 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.187 -0.461 . . . . 72.42 110.881 179.92 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 104' ' ' ILE . . . . . 0.491 HD12 ' O ' ' A' ' 100' ' ' GLU . 3.9 mt -62.19 -47.38 93.39 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.224 -0.444 . . . . 72.12 111.133 179.883 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 105' ' ' HIS . . . . . . . . . . . . . 7.7 t60 -62.65 -42.63 99.71 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.17 -0.468 . . . . 74.21 110.815 179.887 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 1.2 m-20 -59.4 -43.52 92.97 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.195 -0.457 . . . . 75.55 110.888 -179.875 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 107' ' ' THR . . . . . 0.41 HG22 ' O ' ' A' ' 104' ' ' ILE . 8.9 t -76.84 -27.64 55.18 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.192 -0.458 . . . . 62.22 111.12 -179.995 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 108' ' ' SER . . . . . 0.502 ' HB3' HG22 ' A' ' 113' ' ' ILE . 0.4 OUTLIER -114.84 36.21 3.95 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.267 -0.424 . . . . 70.43 110.813 -179.83 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -78.38 75.38 4.9 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.185 -0.461 . . . . 73.24 110.877 -179.972 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 162.06 -27.34 0.26 Allowed Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.765 -0.731 . . . . 73.31 112.504 -179.986 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 111' ' ' GLN . . . . . . . . . . . . . 2.6 pt20 -120.06 -168.38 1.6 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.779 0.323 . . . . 73.21 110.94 -179.917 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 28.4 mt-10 -53.71 135.32 41.33 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.198 -0.456 . . . . 73.22 110.898 -179.961 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 113' ' ' ILE . . . . . 0.502 HG22 ' HB3' ' A' ' 108' ' ' SER . 1.2 pt -126.5 -25.74 1.48 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 116.125 -0.488 . . . . 74.05 111.11 179.981 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 114' ' ' ILE . . . . . 0.654 ' O ' HG23 ' A' ' 118' ' ' THR . 1.1 mp -57.07 -44.46 83.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.188 -0.46 . . . . 73.03 111.129 179.865 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 115' ' ' PHE . . . . . 0.763 ' CE1' HD13 ' A' ' 25' ' ' ILE . 39.8 t80 -64.35 -35.33 80.52 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.155 -0.475 . . . . 73.11 110.875 179.926 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 37.1 mm-40 -67.89 -44.87 76.0 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.13 -0.486 . . . . 75.52 110.903 -179.92 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 117' ' ' ILE . . . . . 0.793 HD11 ' CG ' ' A' ' 101' ' ' PHE . 0.3 OUTLIER -65.94 -40.83 88.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.153 -0.476 . . . . 61.12 111.114 179.987 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 118' ' ' THR . . . . . 0.654 HG23 ' O ' ' A' ' 114' ' ' ILE . 66.6 p -67.6 -43.86 79.46 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.177 -0.465 . . . . 73.53 111.175 179.911 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 45.2 t -68.32 -39.39 81.98 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.218 -0.446 . . . . 72.04 110.829 -179.814 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 120' ' ' PHE . . . . . 0.511 ' CE1' ' HG2' ' A' ' 100' ' ' GLU . 4.1 t80 -68.98 -48.13 63.9 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.115 -0.493 . . . . 63.11 110.904 -179.956 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 121' ' ' THR . . . . . 0.945 HG22 HD22 ' A' ' 97' ' ' LEU . 75.6 p -63.7 -39.98 95.66 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.129 -0.487 . . . . 74.13 111.108 -179.909 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -64.63 -50.66 66.25 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.213 -0.449 . . . . 64.12 110.895 -179.981 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 123' ' ' GLU . . . . . 0.43 ' CG ' ' N ' ' A' ' 124' ' ' LYS . 5.7 pt-20 -65.87 -43.82 87.22 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.191 -0.459 . . . . 62.24 110.929 -179.97 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 124' ' ' LYS . . . . . 0.468 ' HA ' ' CE ' ' A' ' 124' ' ' LYS . 0.1 OUTLIER -68.77 -31.74 70.99 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.167 -0.47 . . . . 65.11 110.917 179.949 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 125' ' ' LEU . . . . . 0.846 ' O ' HD12 ' A' ' 125' ' ' LEU . 1.1 tp -71.47 -43.47 66.56 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.194 -0.457 . . . . 74.11 110.913 179.933 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 6.3 t0 -68.88 -46.6 68.0 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.168 -0.469 . . . . 75.44 110.881 179.843 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 127' ' ' GLU . . . . . 0.445 ' CG ' ' HA ' ' A' ' 124' ' ' LYS . 1.0 OUTLIER -60.26 -27.85 67.58 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.164 -0.471 . . . . 64.04 110.886 -179.901 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 128' ' ' PHE . . . . . 0.527 ' CE2' ' HG3' ' A' ' 93' ' ' GLN . 0.2 OUTLIER . . . . . 0 C--N 1.33 -0.265 0 CA-C-N 116.132 -0.485 . . . . 75.54 110.893 -179.909 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 8' ' ' LEU . . . . . 0.623 HD13 ' O ' ' A' ' 72' ' ' PRO . 18.3 mt . . . . . 0 C--O 1.23 0.071 0 CA-C-O 120.838 0.351 . . . . 73.22 110.905 . . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 9.8 t70 -53.59 -28.47 32.43 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.157 -0.474 . . . . 42.44 110.891 179.823 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 10' ' ' GLN . . . . . 0.432 ' O ' ' HG2' ' A' ' 13' ' ' GLU . 7.5 mm100 -68.13 -38.65 82.43 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.208 -0.451 . . . . 71.51 110.93 -179.944 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 25.9 m-85 -70.37 -21.85 62.83 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.189 -0.46 . . . . 71.44 110.893 -179.867 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -57.23 -41.17 79.01 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.133 -0.485 . . . . 75.43 110.939 -179.952 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 13' ' ' GLU . . . . . 0.493 ' HG2' HD12 ' A' ' 14' ' ' ILE . 4.1 pt-20 -66.32 -40.23 89.8 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.12 -0.491 . . . . 73.13 110.908 179.995 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 14' ' ' ILE . . . . . 0.493 HD12 ' HG2' ' A' ' 13' ' ' GLU . 3.4 mp -67.76 -39.86 82.76 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-N 116.12 -0.491 . . . . 73.42 111.136 179.961 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 93.5 mt-30 -64.09 -48.37 76.41 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.206 -0.452 . . . . 73.41 110.915 179.933 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -63.9 -36.86 85.33 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.144 -0.48 . . . . 62.33 110.862 -179.918 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -58.05 -33.92 69.53 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.159 -0.473 . . . . 75.31 110.906 -179.872 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 1.2 mp0 -66.04 -38.17 87.73 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.182 -0.463 . . . . 74.13 110.891 179.996 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.405 ' CD1' ' CE1' ' A' ' 48' ' ' PHE . 8.7 mp -65.6 -51.28 60.9 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.117 -0.492 . . . . 71.34 110.923 -179.954 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -68.64 -35.55 77.42 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.201 -0.454 . . . . 73.13 110.879 179.944 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -66.57 -50.53 62.79 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.182 -0.463 . . . . 51.42 111.127 179.884 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 22' ' ' ILE . . . . . 0.771 ' HA ' HD12 ' A' ' 25' ' ' ILE . 0.7 OUTLIER -73.84 -34.19 39.46 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.239 -0.437 . . . . 62.41 111.117 179.971 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 34.4 mtp180 -52.25 -35.58 50.16 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.178 -0.464 . . . . 74.0 110.865 179.973 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -67.18 -35.05 78.83 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.173 -0.467 . . . . 73.35 110.863 -179.78 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 25' ' ' ILE . . . . . 0.811 HD13 ' CE1' ' A' ' 115' ' ' PHE . 3.9 mt -78.11 -45.23 27.33 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.129 -0.487 . . . . 72.11 111.165 179.933 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 30.2 m-85 -109.9 43.32 1.36 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.148 -0.478 . . . . 73.23 110.924 -179.915 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 1.8 mtm -40.72 -55.63 2.35 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.094 -0.503 . . . . 75.44 110.877 179.926 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -86.85 -25.76 24.35 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.249 -0.432 . . . . 72.23 110.812 -179.979 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -92.77 31.21 1.42 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.183 -0.462 . . . . 73.51 110.882 179.989 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 30' ' ' PHE . . . . . 0.615 ' HA ' HD13 ' A' ' 50' ' ' ILE . 10.1 t80 -115.59 130.55 56.91 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.155 -0.475 . . . . 71.32 110.882 -179.913 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 53.8 m -117.46 126.39 52.54 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.131 -0.486 . . . . 61.22 111.133 -179.916 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 4.6 t0 -101.04 114.81 29.09 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.201 -0.454 . . . . 63.23 110.868 179.913 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.854 HD21 ' CE1' ' A' ' 67' ' ' HIS . 0.2 OUTLIER -119.24 5.88 11.23 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.209 -0.451 . . . . 75.41 110.912 -179.943 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 34' ' ' THR . . . . . 0.562 ' N ' HD12 ' A' ' 33' ' ' LEU . 2.1 m . . . . . 0 C--N 1.33 -0.278 0 CA-C-N 116.18 -0.463 . . . . 61.42 111.14 179.934 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 45' ' ' GLN . . . . . 0.703 ' HB3' HD12 ' A' ' 47' ' ' ILE . 12.8 tt0 . . . . . 0 C--O 1.232 0.133 0 CA-C-O 120.787 0.327 . . . . 74.55 110.911 . . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 46' ' ' ILE . . . . . 0.464 ' O ' ' C ' ' A' ' 47' ' ' ILE . 0.0 OUTLIER 81.89 -29.76 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.175 -0.466 . . . . 75.24 111.149 179.966 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 47' ' ' ILE . . . . . 0.703 HD12 ' HB3' ' A' ' 45' ' ' GLN . 0.2 OUTLIER -31.33 147.05 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 116.158 -0.474 . . . . 75.32 111.147 179.815 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 48' ' ' PHE . . . . . 0.478 ' HA ' ' CD1' ' A' ' 33' ' ' LEU . 2.0 p90 -158.9 166.35 32.05 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.207 -0.451 . . . . 74.11 110.843 179.968 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 49' ' ' GLU . . . . . 0.766 ' CD ' HD23 ' A' ' 33' ' ' LEU . 6.3 mt-10 -108.87 161.08 15.47 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.125 -0.489 . . . . 74.23 110.856 -179.926 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 50' ' ' ILE . . . . . 0.615 HD13 ' HA ' ' A' ' 30' ' ' PHE . 8.6 mm -142.92 138.32 27.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-N 116.138 -0.483 . . . . 70.21 111.103 179.972 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 78.2 m -91.05 128.99 37.08 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.201 -0.454 . . . . 73.54 111.137 179.963 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 52' ' ' LEU . . . . . 0.87 HD12 HD22 ' A' ' 66' ' ' LEU . 16.9 mt -130.32 166.02 21.27 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.254 -0.43 . . . . 74.35 110.934 179.946 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 53' ' ' ARG . . . . . 0.436 ' CB ' ' O ' ' A' ' 62' ' ' SER . 5.4 ptt180 -177.48 171.18 1.98 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.2 -0.454 . . . . 72.44 110.876 179.963 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 54' ' ' SER . . . . . 0.492 ' H ' ' HG ' ' A' ' 62' ' ' SER . 6.4 p -63.23 -175.8 0.12 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.196 -0.456 . . . . 73.0 110.829 -179.822 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 22.0 m -91.51 -22.96 5.96 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.118 -0.492 . . . . 71.04 111.13 179.936 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 3.2 t0 -118.55 -172.96 2.38 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.164 -0.471 . . . . 72.43 110.873 179.904 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -118.83 -4.05 10.72 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.166 -0.47 . . . . 73.54 110.886 -179.999 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 58' ' ' GLU . . . . . 0.54 ' HA ' ' C ' ' A' ' 59' ' ' PRO . 5.1 mm-40 -136.33 150.29 70.31 Favored Pre-proline 0 C--N 1.329 -0.287 0 CA-C-O 121.649 0.738 . . . . 73.22 110.911 179.937 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 59' ' ' PRO . . . . . 0.54 ' C ' ' HA ' ' A' ' 58' ' ' GLU . 54.1 Cg_endo -69.73 -1.85 6.81 Favored 'Cis proline' 0 C--N 1.341 0.162 0 C-N-CA 122.707 -1.789 . . . . 65.22 112.361 -0.038 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 60' ' ' VAL . . . . . 0.438 ' N ' ' HA ' ' A' ' 58' ' ' GLU . 34.5 m -144.86 168.6 9.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.231 -0.44 . . . . 42.11 111.162 179.883 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 61' ' ' GLU . . . . . 0.41 ' O ' ' O ' ' A' ' 62' ' ' SER . 22.3 tt0 -100.03 -29.14 12.7 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.168 -0.469 . . . . 65.42 110.909 -179.966 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 62' ' ' SER . . . . . 0.492 ' HG ' ' H ' ' A' ' 54' ' ' SER . 20.1 p 50.69 102.86 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.155 -0.475 . . . . 74.34 110.852 -179.81 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 49.7 p -129.55 122.93 30.18 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.133 -0.485 . . . . 72.23 110.831 -179.8 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 64' ' ' ILE . . . . . 1.027 HD11 HG21 ' A' ' 89' ' ' VAL . 52.8 mt -143.93 132.03 18.34 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.163 -0.472 . . . . 70.51 111.179 179.9 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 91.7 m -92.93 119.33 32.11 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.228 -0.442 . . . . 74.54 111.168 179.954 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 66' ' ' LEU . . . . . 0.87 HD22 HD12 ' A' ' 52' ' ' LEU . 1.5 mp -97.39 109.82 22.5 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.188 -0.46 . . . . 62.52 110.917 179.989 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 67' ' ' HIS . . . . . 0.854 ' CE1' HD21 ' A' ' 33' ' ' LEU . 39.9 t60 -102.05 109.69 21.47 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.152 -0.476 . . . . 73.41 110.841 179.873 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 68' ' ' PHE . . . . . 0.513 ' CE2' ' HB3' ' A' ' 66' ' ' LEU . 0.0 OUTLIER -104.08 139.91 38.51 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.184 -0.462 . . . . 73.24 110.873 -179.919 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 69' ' ' ALA . . . . . 0.443 ' O ' ' CB ' ' A' ' 79' ' ' PRO . . . -121.23 120.6 35.65 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.168 -0.469 . . . . 65.23 111.116 179.912 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 1.7 mmt -85.34 89.95 7.8 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.241 -0.436 . . . . 61.51 110.875 179.998 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -41.26 160.33 0.15 Allowed Pre-proline 0 C--N 1.33 -0.277 0 CA-C-O 121.595 0.712 . . . . 53.24 111.13 -179.913 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 72' ' ' PRO . . . . . 0.623 ' O ' HD13 ' A' ' 8' ' ' LEU . 53.4 Cg_endo -69.78 2.97 3.06 Favored 'Trans proline' 0 C--N 1.341 0.162 0 C-N-CA 122.704 2.269 . . . . 71.51 112.34 179.953 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 73' ' ' MET . . . . . 0.501 ' O ' ' CB ' ' A' ' 76' ' ' TYR . 0.1 OUTLIER -121.44 -25.24 5.21 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.216 -0.447 . . . . 73.15 110.911 179.869 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 74' ' ' TYR . . . . . 0.632 ' CD1' ' C ' ' A' ' 74' ' ' TYR . 0.0 OUTLIER -46.95 149.86 1.47 Allowed Pre-proline 0 C--N 1.329 -0.315 0 CA-C-O 121.684 0.754 . . . . 70.05 110.945 -179.904 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 75' ' ' PRO . . . . . 0.551 ' C ' ' HA ' ' A' ' 74' ' ' TYR . 53.7 Cg_endo -69.75 -10.79 11.65 Favored 'Cis proline' 0 C--O 1.232 0.186 0 C-N-CA 122.673 -1.803 . . . . 61.45 112.338 -0.103 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 76' ' ' TYR . . . . . 0.501 ' CB ' ' O ' ' A' ' 73' ' ' MET . 20.9 t80 -33.81 -45.46 0.19 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.262 -0.427 . . . . 74.22 110.937 -179.924 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 77' ' ' THR . . . . . 0.404 HG23 ' CB ' ' A' ' 73' ' ' MET . 16.8 p -114.86 -175.03 2.6 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.118 -0.492 . . . . 74.21 111.152 179.998 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -99.94 132.96 22.01 Favored Pre-proline 0 C--N 1.329 -0.291 0 CA-C-O 121.566 0.698 . . . . 72.31 111.123 179.863 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 79' ' ' PRO . . . . . 0.735 ' HG3' HD11 ' A' ' 113' ' ' ILE . 54.0 Cg_endo -69.75 -164.21 0.12 Allowed 'Trans proline' 0 C--N 1.341 0.175 0 C-N-CA 122.71 2.273 . . . . 73.1 112.336 180.0 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 9.4 tt0 -131.73 129.2 40.33 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.171 -0.468 . . . . 63.35 110.857 -179.944 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 81' ' ' ILE . . . . . 0.42 HD13 ' HA ' ' A' ' 68' ' ' PHE . 5.1 mm -120.64 145.58 26.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.157 -0.474 . . . . 74.32 111.085 179.994 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 82' ' ' GLU . . . . . 0.504 ' HG3' ' CD ' ' A' ' 84' ' ' LYS . 4.2 pt-20 -149.01 136.44 20.24 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.162 -0.472 . . . . 64.32 110.898 179.944 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 83' ' ' PHE . . . . . 0.613 ' CB ' HD22 ' A' ' 94' ' ' LEU . 38.5 m-85 -93.08 138.63 31.36 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.156 -0.474 . . . . 75.32 110.836 -179.888 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 84' ' ' LYS . . . . . 0.504 ' CD ' ' HG3' ' A' ' 82' ' ' GLU . 9.7 mmmt -124.93 171.88 9.84 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.113 -0.494 . . . . 63.13 110.915 179.942 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 85' ' ' ASN . . . . . 0.414 ' C ' ' CG2' ' A' ' 86' ' ' VAL . 7.8 m-80 61.24 -74.47 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.2 -0.455 . . . . 63.22 110.923 179.978 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 86' ' ' VAL . . . . . 0.737 HG11 HD11 ' A' ' 94' ' ' LEU . 2.8 m 41.61 84.59 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.179 -0.464 . . . . 61.25 111.092 179.864 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -93.06 -79.66 0.4 Allowed 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.18 -0.464 . . . . 65.13 110.923 -179.984 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -54.41 -44.16 72.12 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.194 -0.457 . . . . 71.0 110.887 -179.988 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 89' ' ' VAL . . . . . 1.027 HG21 HD11 ' A' ' 64' ' ' ILE . 1.7 t -62.21 151.74 7.36 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.163 -0.472 . . . . 42.55 111.136 179.932 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 90' ' ' MET . . . . . . . . . . . . . 14.8 mtm -102.25 -70.35 0.75 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.192 -0.458 . . . . 70.51 110.864 179.897 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 91' ' ' ASP . . . . . 0.432 ' HA ' HD12 ' A' ' 94' ' ' LEU . 3.0 p-10 -172.26 -36.95 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.255 -0.429 . . . . 70.41 110.898 179.989 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -54.28 -41.51 68.95 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.179 -0.464 . . . . 64.13 110.843 -179.802 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 93' ' ' GLN . . . . . 0.478 ' CD ' ' CD2' ' A' ' 128' ' ' PHE . 0.8 OUTLIER -69.03 -42.03 76.91 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.16 -0.473 . . . . 75.02 110.95 -179.965 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 94' ' ' LEU . . . . . 0.737 HD11 HG11 ' A' ' 86' ' ' VAL . 50.8 mt -59.36 -49.03 79.38 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.137 -0.483 . . . . 65.53 110.931 -179.993 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 1.8 mm100 -65.98 -36.13 82.48 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.148 -0.478 . . . . 74.15 110.905 179.921 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 96' ' ' MET . . . . . 0.453 ' SD ' ' CE1' ' A' ' 128' ' ' PHE . 49.8 ttp -60.89 -38.58 86.15 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.168 -0.469 . . . . 71.41 110.851 179.99 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 97' ' ' LEU . . . . . 0.978 HD22 HG22 ' A' ' 121' ' ' THR . 98.4 mt -60.62 -46.8 88.92 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.238 -0.437 . . . . 71.42 110.959 -179.984 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 12.8 mmtm -55.8 -34.66 65.53 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.148 -0.478 . . . . 61.41 110.878 179.822 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 67.1 m -68.7 -45.74 70.82 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.25 -0.432 . . . . 42.32 110.861 -179.87 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 100' ' ' GLU . . . . . 0.47 ' O ' HD12 ' A' ' 104' ' ' ILE . 8.6 pt-20 -75.16 -23.47 57.77 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.106 -0.497 . . . . 72.15 110.885 -179.958 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 101' ' ' PHE . . . . . 0.651 ' CD2' HD11 ' A' ' 117' ' ' ILE . 8.0 m-30 -59.09 -34.37 71.92 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.175 -0.466 . . . . 63.12 110.877 -179.933 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.34 -42.83 98.97 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.114 -0.494 . . . . 63.11 110.929 179.989 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 21.0 mtmm -64.91 -37.81 88.89 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.2 -0.455 . . . . 65.54 110.916 179.818 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 104' ' ' ILE . . . . . 0.621 HD11 ' CD2' ' A' ' 120' ' ' PHE . 3.0 mt -65.01 -47.55 87.58 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 116.236 -0.438 . . . . 51.34 111.132 179.853 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 105' ' ' HIS . . . . . . . . . . . . . 4.3 t60 -62.97 -41.49 99.55 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.172 -0.467 . . . . 74.33 110.868 179.901 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -60.63 -43.3 97.67 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.188 -0.46 . . . . 64.44 110.887 -179.952 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 9.2 t -78.95 -28.74 43.73 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.194 -0.457 . . . . 72.52 111.172 179.986 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 12.5 m -114.77 40.4 2.61 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.239 -0.437 . . . . 63.45 110.845 -179.839 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 34.5 ttt180 -84.8 90.32 7.73 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.14 -0.482 . . . . 74.42 110.837 -179.927 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 110' ' ' GLY . . . . . 0.444 ' HA2' ' CB ' ' A' ' 75' ' ' PRO . . . 110.59 45.33 0.91 Allowed Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.725 -0.75 . . . . 62.32 112.49 -179.973 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 111' ' ' GLN . . . . . 0.422 ' O ' ' CB ' ' A' ' 112' ' ' GLU . 5.1 pt20 -174.33 28.52 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.745 0.307 . . . . 72.42 110.897 -179.918 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 112' ' ' GLU . . . . . 0.422 ' CB ' ' O ' ' A' ' 111' ' ' GLN . 0.2 OUTLIER 78.07 135.73 0.06 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.207 -0.451 . . . . 62.4 110.87 -179.989 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 113' ' ' ILE . . . . . 0.735 HD11 ' HG3' ' A' ' 79' ' ' PRO . 31.9 pt -133.46 -0.31 1.43 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.183 -0.462 . . . . 73.11 111.136 179.968 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 114' ' ' ILE . . . . . 0.831 ' O ' HG23 ' A' ' 118' ' ' THR . 25.6 mm -63.34 -45.43 98.15 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.2 -0.454 . . . . 60.34 111.132 179.876 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 115' ' ' PHE . . . . . 0.811 ' CE1' HD13 ' A' ' 25' ' ' ILE . 26.6 t80 -72.65 -34.63 67.4 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.188 -0.46 . . . . 75.41 110.874 179.93 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 4.3 mm-40 -67.8 -47.63 68.57 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.144 -0.48 . . . . 62.23 110.893 -179.928 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 117' ' ' ILE . . . . . 0.651 HD11 ' CD2' ' A' ' 101' ' ' PHE . 0.9 OUTLIER -63.47 -40.61 89.69 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.14 -0.482 . . . . 73.53 111.103 179.976 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 118' ' ' THR . . . . . 0.831 HG23 ' O ' ' A' ' 114' ' ' ILE . 64.5 p -68.07 -42.77 79.91 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.169 -0.469 . . . . 53.41 111.108 -179.955 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 67.6 m -67.89 -44.25 77.43 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.225 -0.443 . . . . 71.33 110.853 -179.843 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 120' ' ' PHE . . . . . 0.621 ' CD2' HD11 ' A' ' 104' ' ' ILE . 0.2 OUTLIER -60.74 -50.27 74.15 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.139 -0.482 . . . . 74.33 110.888 -179.959 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 121' ' ' THR . . . . . 0.978 HG22 HD22 ' A' ' 97' ' ' LEU . 81.4 p -65.54 -40.71 93.22 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.171 -0.468 . . . . 65.23 111.146 -179.95 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 8.4 tm0? -64.23 -38.85 92.52 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.191 -0.459 . . . . 71.33 110.911 -179.985 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 4.4 pt-20 -77.5 -40.48 42.69 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.216 -0.447 . . . . 72.15 110.916 -179.976 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 124' ' ' LYS . . . . . 0.472 ' HA ' ' CE ' ' A' ' 124' ' ' LYS . 0.0 OUTLIER -68.57 -41.06 80.27 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.128 -0.487 . . . . 74.12 110.815 -179.982 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 125' ' ' LEU . . . . . 0.57 ' O ' HD23 ' A' ' 125' ' ' LEU . 0.5 OUTLIER -68.39 -38.26 81.15 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.253 -0.43 . . . . 74.21 110.926 179.945 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 126' ' ' ASP . . . . . 0.433 ' C ' ' OD1' ' A' ' 126' ' ' ASP . 1.2 t0 -61.78 -45.59 93.22 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.202 -0.454 . . . . 54.33 110.886 179.817 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 127' ' ' GLU . . . . . 0.447 ' HG3' ' N ' ' A' ' 128' ' ' PHE . 7.4 pt-20 -69.68 -31.17 69.06 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.202 -0.454 . . . . 72.45 110.899 -179.892 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 128' ' ' PHE . . . . . 0.478 ' CD2' ' CD ' ' A' ' 93' ' ' GLN . 0.3 OUTLIER . . . . . 0 C--N 1.329 -0.302 0 CA-C-N 116.138 -0.483 . . . . 74.42 110.836 -179.886 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 76.0 mt . . . . . 0 C--O 1.231 0.119 0 CA-C-O 120.813 0.339 . . . . 74.42 110.955 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -51.62 -34.64 38.43 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.169 -0.469 . . . . 70.31 110.828 179.883 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 10' ' ' GLN . . . . . 0.408 ' O ' HD12 ' A' ' 14' ' ' ILE . 16.1 mm-40 -67.95 -35.11 77.83 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.212 -0.449 . . . . 74.35 110.883 -179.863 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 11' ' ' TYR . . . . . 0.441 ' CD1' ' HD2' ' A' ' 75' ' ' PRO . 15.1 m-85 -65.77 -25.06 67.09 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.2 -0.455 . . . . 64.15 110.916 -179.852 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -64.59 -37.85 88.99 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.105 -0.498 . . . . 72.33 110.911 -179.884 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 2.5 mm-40 -61.56 -44.15 97.56 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.144 -0.48 . . . . 73.12 110.885 179.985 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 14' ' ' ILE . . . . . 0.545 ' H ' HD12 ' A' ' 14' ' ' ILE . 5.2 mp -68.03 -40.12 82.63 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.125 -0.489 . . . . 71.13 111.135 179.971 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 15' ' ' GLN . . . . . 0.419 ' HB3' HG21 ' A' ' 46' ' ' ILE . 59.1 mt-30 -65.22 -46.33 81.09 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.159 -0.473 . . . . 60.34 110.881 179.946 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 7.0 t -63.19 -36.56 84.05 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.254 -0.43 . . . . 73.44 110.881 -179.946 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 17' ' ' ASN . . . . . 0.432 ' OD1' ' N ' ' A' ' 18' ' ' GLU . 0.2 OUTLIER -58.36 -33.72 69.89 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.154 -0.476 . . . . 73.24 110.889 -179.907 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 18' ' ' GLU . . . . . 0.432 ' N ' ' OD1' ' A' ' 17' ' ' ASN . 1.3 mp0 -66.33 -37.78 86.15 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.18 -0.464 . . . . 61.11 110.886 -179.985 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.459 ' CD2' HG13 ' A' ' 46' ' ' ILE . 8.8 mp -64.44 -51.51 62.75 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.18 -0.464 . . . . 75.05 110.908 -179.976 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 1.4 pt-20 -68.5 -35.86 78.1 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.202 -0.454 . . . . 73.43 110.933 179.918 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -66.66 -47.1 73.59 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.124 -0.489 . . . . 74.54 111.068 179.944 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 22' ' ' ILE . . . . . 0.621 ' HA ' HD12 ' A' ' 25' ' ' ILE . 0.7 OUTLIER -76.21 -34.27 25.66 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-N 116.261 -0.427 . . . . 52.32 111.167 179.955 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -52.32 -34.18 45.84 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.144 -0.48 . . . . 73.12 110.87 179.973 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -66.37 -32.15 73.36 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.219 -0.446 . . . . 70.43 110.879 -179.823 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 25' ' ' ILE . . . . . 0.854 HD13 ' CE1' ' A' ' 115' ' ' PHE . 3.3 mt -84.77 -43.84 17.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.118 -0.492 . . . . 62.33 111.121 179.95 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 19.5 m-85 -107.5 45.36 1.0 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.176 -0.465 . . . . 73.45 110.903 -179.95 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 4.1 mtm -46.26 -47.82 18.07 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.132 -0.485 . . . . 73.54 110.869 179.887 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 7.1 m-20 -98.74 -27.2 14.07 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.219 -0.446 . . . . 64.45 110.859 179.952 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 84.6 m-20 -86.11 34.4 0.62 Allowed 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.214 -0.448 . . . . 73.42 110.862 -179.995 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 30' ' ' PHE . . . . . 0.612 ' CD1' ' C ' ' A' ' 30' ' ' PHE . 0.1 OUTLIER -117.46 144.12 45.35 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.176 -0.465 . . . . 71.31 110.923 -179.935 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 24.4 m -127.08 135.07 50.25 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.141 -0.481 . . . . 55.44 111.18 -179.926 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -97.82 114.81 26.94 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.227 -0.442 . . . . 70.14 110.83 179.948 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.941 HD23 ' N ' ' A' ' 34' ' ' THR . 0.1 OUTLIER -121.81 -9.65 8.8 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.216 -0.447 . . . . 74.43 110.95 -179.979 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 34' ' ' THR . . . . . 0.941 ' N ' HD23 ' A' ' 33' ' ' LEU . 0.2 OUTLIER . . . . . 0 C--N 1.33 -0.262 0 CA-C-N 116.174 -0.466 . . . . 75.2 111.163 179.933 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 45' ' ' GLN . . . . . 0.879 ' HG2' HG23 ' A' ' 47' ' ' ILE . 15.1 pt20 . . . . . 0 C--O 1.231 0.11 0 CA-C-O 120.79 0.328 . . . . 74.05 110.929 . . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 46' ' ' ILE . . . . . 0.643 HG22 ' O ' ' A' ' 45' ' ' GLN . 0.2 OUTLIER 87.16 -21.88 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.174 -0.466 . . . . 54.4 111.142 -180.0 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 47' ' ' ILE . . . . . 0.879 HG23 ' HG2' ' A' ' 45' ' ' GLN . 0.2 OUTLIER -36.5 144.54 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.205 -0.452 . . . . 65.33 111.171 179.849 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 48' ' ' PHE . . . . . 0.759 ' HA ' HD22 ' A' ' 33' ' ' LEU . 0.9 OUTLIER -161.59 158.37 26.15 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.183 -0.462 . . . . 74.24 110.896 -179.994 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 49' ' ' GLU . . . . . 0.914 ' CG ' HD13 ' A' ' 33' ' ' LEU . 20.4 mt-10 -108.76 160.99 15.52 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.137 -0.483 . . . . 72.53 110.866 -179.922 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 50' ' ' ILE . . . . . 0.547 HD13 ' HA ' ' A' ' 30' ' ' PHE . 15.4 mm -141.66 135.55 30.44 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.151 -0.477 . . . . 64.42 111.131 179.975 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 90.2 m -83.73 137.08 33.92 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.136 -0.484 . . . . 72.52 111.195 179.946 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 52' ' ' LEU . . . . . 0.45 HD12 HD12 ' A' ' 66' ' ' LEU . 14.2 mt -136.69 160.23 39.46 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.216 -0.447 . . . . 74.23 110.92 179.943 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 7.4 ptt85 -176.14 161.6 2.38 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.18 -0.464 . . . . 72.12 110.829 179.965 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -53.63 -176.68 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.154 -0.475 . . . . 75.02 110.886 -179.823 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 15.9 m -94.41 -25.69 4.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.169 -0.469 . . . . 72.43 111.084 179.984 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -124.47 -165.99 1.45 Allowed 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.179 -0.464 . . . . 74.31 110.881 179.92 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -114.76 -14.58 11.97 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.191 -0.458 . . . . 62.25 110.854 -179.954 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 58' ' ' GLU . . . . . 0.554 ' HA ' ' C ' ' A' ' 59' ' ' PRO . 7.5 pt-20 -119.49 143.22 34.15 Favored Pre-proline 0 C--N 1.329 -0.294 0 CA-C-O 121.644 0.735 . . . . 44.23 110.859 -179.995 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 59' ' ' PRO . . . . . 0.554 ' C ' ' HA ' ' A' ' 58' ' ' GLU . 54.3 Cg_endo -69.81 -9.2 10.99 Favored 'Cis proline' 0 C--O 1.232 0.188 0 C-N-CA 122.632 -1.82 . . . . 71.44 112.364 0.025 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 60' ' ' VAL . . . . . 0.459 ' HB ' ' CG ' ' A' ' 88' ' ' ASN . 12.0 m -153.89 176.54 0.48 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.242 -0.436 . . . . 42.33 111.164 179.903 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 61' ' ' GLU . . . . . 0.461 ' O ' ' C ' ' A' ' 62' ' ' SER . 6.0 tt0 -107.93 -18.0 13.91 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.203 -0.453 . . . . 72.52 110.917 179.963 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 62' ' ' SER . . . . . 0.721 ' HB3' HD11 ' A' ' 125' ' ' LEU . 0.1 OUTLIER 33.7 90.05 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.191 -0.459 . . . . 73.52 110.845 -179.846 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -103.66 122.85 45.87 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.151 -0.477 . . . . 74.21 110.866 -179.801 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 64' ' ' ILE . . . . . 0.775 HD13 HD11 ' A' ' 94' ' ' LEU . 12.5 mt -141.37 150.42 19.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.156 -0.475 . . . . 71.22 111.113 179.972 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 84.0 m -118.96 117.34 28.55 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.153 -0.476 . . . . 64.34 111.135 179.972 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 66' ' ' LEU . . . . . 0.802 HD11 HG21 ' A' ' 121' ' ' THR . 11.4 mt -95.04 111.9 23.66 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.217 -0.447 . . . . 73.53 110.912 179.979 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 67' ' ' HIS . . . . . 0.552 ' CE1' HD11 ' A' ' 33' ' ' LEU . 0.9 OUTLIER -102.11 111.88 24.33 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.152 -0.476 . . . . 61.22 110.843 179.855 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 68' ' ' PHE . . . . . 0.536 ' CE1' HG23 ' A' ' 114' ' ' ILE . 0.0 OUTLIER -103.83 139.95 38.33 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.195 -0.457 . . . . 72.04 110.889 -179.959 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -119.67 118.4 30.83 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.123 -0.49 . . . . 63.23 111.096 179.897 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 70' ' ' MET . . . . . 0.445 ' CE ' HD11 ' A' ' 114' ' ' ILE . 2.3 mmt -84.08 99.13 10.27 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.238 -0.437 . . . . 70.21 110.883 179.942 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -53.25 159.86 1.94 Allowed Pre-proline 0 C--N 1.33 -0.275 0 CA-C-O 121.553 0.692 . . . . 71.04 111.14 -179.912 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.73 -2.22 9.79 Favored 'Trans proline' 0 C--N 1.341 0.167 0 C-N-CA 122.69 2.26 . . . . 71.22 112.376 179.887 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 73' ' ' MET . . . . . 0.496 ' O ' ' CB ' ' A' ' 76' ' ' TYR . 0.1 OUTLIER -115.83 -23.33 8.67 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.234 -0.439 . . . . 73.44 110.914 179.902 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 74' ' ' TYR . . . . . 0.665 ' CD1' ' C ' ' A' ' 74' ' ' TYR . 0.0 OUTLIER -48.49 151.53 1.93 Allowed Pre-proline 0 C--N 1.328 -0.353 0 CA-C-O 121.69 0.757 . . . . 73.13 110.924 -179.907 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 75' ' ' PRO . . . . . 0.544 ' HA ' ' CD2' ' A' ' 74' ' ' TYR . 53.7 Cg_endo -69.73 -9.99 11.23 Favored 'Cis proline' 0 C--N 1.341 0.184 0 C-N-CA 122.633 -1.819 . . . . 75.51 112.386 -0.109 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 76' ' ' TYR . . . . . 0.496 ' CB ' ' O ' ' A' ' 73' ' ' MET . 16.3 t80 -34.41 -52.3 0.48 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.172 -0.467 . . . . 70.42 110.916 -179.911 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 62.1 p -101.41 -171.56 2.01 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.094 -0.503 . . . . 71.44 111.158 -179.956 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -108.65 131.31 21.85 Favored Pre-proline 0 C--N 1.328 -0.335 0 CA-C-O 121.57 0.7 . . . . 70.44 111.142 179.842 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 79' ' ' PRO . . . . . 0.685 ' HG3' HD11 ' A' ' 113' ' ' ILE . 53.5 Cg_endo -69.82 -170.14 0.38 Allowed 'Trans proline' 0 C--N 1.342 0.192 0 C-N-CA 122.688 2.259 . . . . 71.13 112.344 -179.964 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 80' ' ' GLU . . . . . 0.428 ' O ' HD13 ' A' ' 81' ' ' ILE . 0.3 OUTLIER -127.37 127.36 44.08 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.242 -0.436 . . . . 60.2 110.854 -179.963 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 81' ' ' ILE . . . . . 0.722 ' CG2' HD22 ' A' ' 66' ' ' LEU . 10.2 mm -120.4 139.13 48.65 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.156 -0.475 . . . . 73.22 111.102 179.956 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 82' ' ' GLU . . . . . 0.487 ' HG3' ' CD ' ' A' ' 84' ' ' LYS . 7.2 pt-20 -148.34 144.04 27.28 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.144 -0.48 . . . . 63.43 110.866 179.948 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 83' ' ' PHE . . . . . 0.57 ' CG ' HD12 ' A' ' 94' ' ' LEU . 22.5 m-85 -93.76 141.14 28.84 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.132 -0.486 . . . . 74.35 110.895 -179.963 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 84' ' ' LYS . . . . . 0.487 ' CD ' ' HG3' ' A' ' 82' ' ' GLU . 9.6 mmmt -124.89 171.05 10.49 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.124 -0.489 . . . . 65.25 110.903 179.968 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 85' ' ' ASN . . . . . 0.413 ' O ' ' CG2' ' A' ' 86' ' ' VAL . 5.0 m120 62.81 -74.22 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.216 -0.447 . . . . 72.0 110.918 179.977 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 86' ' ' VAL . . . . . 0.465 ' N ' ' O ' ' A' ' 84' ' ' LYS . 3.2 m 41.5 92.08 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.144 -0.48 . . . . 73.24 111.144 179.901 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -102.54 -69.59 0.78 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.21 -0.45 . . . . 73.0 110.868 -179.945 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 88' ' ' ASN . . . . . 0.459 ' CG ' ' HB ' ' A' ' 60' ' ' VAL . 14.6 m-80 -83.31 53.11 2.38 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.191 -0.459 . . . . 73.33 110.851 -179.909 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 89' ' ' VAL . . . . . 0.687 HG21 HD22 ' A' ' 94' ' ' LEU . 2.1 p -165.27 133.85 0.63 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.173 -0.467 . . . . 75.13 111.1 179.904 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 90' ' ' MET . . . . . . . . . . . . . 1.4 mtm -78.36 -70.43 0.49 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.123 -0.49 . . . . 62.21 110.885 179.888 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 91' ' ' ASP . . . . . 0.5 ' HA ' HD23 ' A' ' 94' ' ' LEU . 5.1 p-10 -176.34 -30.95 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.195 -0.457 . . . . 55.41 110.857 179.981 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -53.65 -37.65 63.32 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.185 -0.461 . . . . 70.32 110.906 -179.792 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 93' ' ' GLN . . . . . 0.534 ' HG2' ' CZ ' ' A' ' 128' ' ' PHE . 1.4 mp0 -71.03 -38.37 72.58 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.108 -0.496 . . . . 73.2 110.917 -179.945 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 94' ' ' LEU . . . . . 0.775 HD11 HD13 ' A' ' 64' ' ' ILE . 1.1 mm? -64.78 -47.21 78.95 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.166 -0.47 . . . . 72.23 110.907 -179.964 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 44.6 mt-30 -65.17 -34.0 77.35 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.16 -0.473 . . . . 72.34 110.905 179.952 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 96' ' ' MET . . . . . . . . . . . . . 32.0 ttp -59.85 -37.88 80.52 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.184 -0.462 . . . . 73.21 110.913 179.951 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 97' ' ' LEU . . . . . 0.477 ' O ' ' CD1' ' A' ' 101' ' ' PHE . 17.1 mt -71.97 -38.9 69.66 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.188 -0.46 . . . . 70.24 110.902 179.961 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 98' ' ' LYS . . . . . 0.449 ' HZ1' ' HA ' ' A' ' 82' ' ' GLU . 7.0 mmtt -54.64 -37.11 65.28 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.206 -0.452 . . . . 62.54 110.903 179.847 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -64.45 -38.69 91.9 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.217 -0.447 . . . . 73.33 110.864 -179.861 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 100' ' ' GLU . . . . . 0.498 ' O ' HD12 ' A' ' 104' ' ' ILE . 1.4 mp0 -72.94 -24.1 60.77 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.145 -0.48 . . . . 70.55 110.905 179.995 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 101' ' ' PHE . . . . . 0.477 ' CD1' ' O ' ' A' ' 97' ' ' LEU . 8.9 m-30 -59.75 -35.19 74.1 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.117 -0.492 . . . . 74.1 110.935 -179.951 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.51 -38.29 84.07 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.143 -0.48 . . . . 53.53 110.881 179.959 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 21.8 mtmt -70.04 -43.19 71.76 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.264 -0.426 . . . . 73.11 110.927 179.846 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 104' ' ' ILE . . . . . 0.498 HD12 ' O ' ' A' ' 100' ' ' GLU . 3.0 mt -62.16 -47.45 93.06 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.185 -0.461 . . . . 71.32 111.102 179.901 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 105' ' ' HIS . . . . . 0.465 ' O ' ' N ' ' A' ' 109' ' ' ARG . 1.8 t60 -62.87 -41.09 99.26 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.163 -0.471 . . . . 75.14 110.832 179.932 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 1.3 m-80 -58.14 -39.25 78.3 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.246 -0.434 . . . . 63.52 110.834 -179.901 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 9.4 t -90.12 -13.18 36.28 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.195 -0.457 . . . . 75.1 111.091 -179.921 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 108' ' ' SER . . . . . 0.578 ' HB3' HG22 ' A' ' 113' ' ' ILE . 58.8 m -116.78 17.5 15.12 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.241 -0.436 . . . . 72.02 110.863 -179.845 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 109' ' ' ARG . . . . . 0.465 ' N ' ' O ' ' A' ' 105' ' ' HIS . 21.4 ttp180 -67.17 76.16 0.14 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.098 -0.501 . . . . 71.01 110.884 -179.98 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 149.05 -21.63 1.25 Allowed Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.77 -0.728 . . . . 72.31 112.505 -179.954 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 111' ' ' GLN . . . . . . . . . . . . . 10.6 pt20 -116.84 -165.48 1.07 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.765 0.317 . . . . 72.11 110.894 -179.891 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 23.4 mt-10 -67.05 134.29 51.6 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.189 -0.46 . . . . 63.02 110.871 -179.943 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 113' ' ' ILE . . . . . 0.685 HD11 ' HG3' ' A' ' 79' ' ' PRO . 22.4 pt -124.5 -14.66 5.07 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 116.131 -0.486 . . . . 75.11 111.117 179.984 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 114' ' ' ILE . . . . . 0.716 ' O ' HG23 ' A' ' 118' ' ' THR . 14.5 mm -63.03 -43.83 99.26 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.157 -0.474 . . . . 74.33 111.15 179.81 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 115' ' ' PHE . . . . . 0.854 ' CE1' HD13 ' A' ' 25' ' ' ILE . 16.2 t80 -72.52 -35.97 68.21 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.145 -0.48 . . . . 72.35 110.91 179.944 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 5.2 mm-40 -66.02 -46.77 76.69 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.189 -0.459 . . . . 62.54 110.922 -179.954 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 117' ' ' ILE . . . . . 0.49 ' CG2' ' N ' ' A' ' 118' ' ' THR . 0.7 OUTLIER -64.37 -43.06 97.03 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.159 -0.473 . . . . 74.51 111.137 179.93 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 118' ' ' THR . . . . . 0.716 HG23 ' O ' ' A' ' 114' ' ' ILE . 72.7 p -67.83 -43.03 80.49 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.192 -0.458 . . . . 52.22 111.127 179.972 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 4.0 m -63.86 -44.48 92.99 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.245 -0.434 . . . . 61.22 110.843 -179.835 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 120' ' ' PHE . . . . . 0.405 ' O ' ' HG2' ' A' ' 123' ' ' GLU . 0.2 OUTLIER -65.41 -48.74 71.77 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.176 -0.465 . . . . 74.43 110.906 -179.984 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 121' ' ' THR . . . . . 0.802 HG21 HD11 ' A' ' 66' ' ' LEU . 25.3 p -63.7 -38.62 91.8 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.154 -0.475 . . . . 72.52 111.137 -179.912 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 27.7 tt0 -63.23 -41.44 99.11 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.202 -0.453 . . . . 64.44 110.903 -179.963 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 123' ' ' GLU . . . . . 0.497 ' O ' ' CG ' ' A' ' 127' ' ' GLU . 4.2 pt-20 -75.95 -35.61 59.64 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.245 -0.434 . . . . 74.35 110.861 -179.946 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 124' ' ' LYS . . . . . 0.491 ' HA ' ' CG ' ' A' ' 127' ' ' GLU . 0.0 OUTLIER -68.61 -35.22 77.03 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.14 -0.482 . . . . 74.42 110.901 179.966 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 125' ' ' LEU . . . . . 0.811 ' O ' HD23 ' A' ' 125' ' ' LEU . 4.0 tt -72.93 -43.67 62.1 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.274 -0.421 . . . . 73.43 110.925 179.912 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 4.5 t70 -65.7 -46.93 77.14 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.219 -0.446 . . . . 75.11 110.836 179.843 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 127' ' ' GLU . . . . . 0.497 ' CG ' ' O ' ' A' ' 123' ' ' GLU . 0.0 OUTLIER -59.52 -50.35 74.23 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.248 -0.433 . . . . 72.04 110.868 -179.908 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 128' ' ' PHE . . . . . 0.667 ' CD1' ' C ' ' A' ' 128' ' ' PHE . 0.0 OUTLIER . . . . . 0 C--N 1.329 -0.284 0 CA-C-N 116.161 -0.472 . . . . 74.45 110.865 -179.906 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 8' ' ' LEU . . . . . 0.614 HD13 ' O ' ' A' ' 72' ' ' PRO . 17.4 mt . . . . . 0 C--O 1.231 0.112 0 CA-C-O 120.838 0.351 . . . . 72.21 110.948 . . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 9' ' ' ASP . . . . . 0.411 ' OD1' ' N ' ' A' ' 9' ' ' ASP . 1.2 m-20 -53.38 -32.58 50.03 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.179 -0.464 . . . . 64.32 110.852 179.863 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 9.8 mm100 -66.99 -38.93 86.93 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.205 -0.452 . . . . 73.33 110.922 -179.969 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 11' ' ' TYR . . . . . 0.53 ' CD1' ' HD2' ' A' ' 75' ' ' PRO . 18.9 m-85 -61.65 -25.08 67.15 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.187 -0.46 . . . . 64.14 110.92 -179.89 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -59.05 -41.69 88.47 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.164 -0.471 . . . . 74.32 110.962 -179.917 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 1.5 mm-40 -62.43 -45.23 94.04 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.085 -0.507 . . . . 74.43 110.897 179.952 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 14' ' ' ILE . . . . . 0.402 HD12 ' H ' ' A' ' 14' ' ' ILE . 4.4 mp -67.21 -39.89 83.95 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.146 -0.479 . . . . 50.51 111.148 -179.999 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 15' ' ' GLN . . . . . 0.521 ' O ' HD13 ' A' ' 19' ' ' LEU . 55.9 mt-30 -62.62 -49.43 75.24 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.171 -0.468 . . . . 64.21 110.889 179.913 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -63.45 -40.67 97.75 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.206 -0.452 . . . . 74.12 110.878 -179.924 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 17' ' ' ASN . . . . . 0.419 ' O ' ' HG3' ' A' ' 20' ' ' GLU . 0.8 OUTLIER -57.71 -33.28 68.23 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.197 -0.456 . . . . 34.41 110.916 -179.91 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 18' ' ' GLU . . . . . 0.527 ' OE1' ' HE1' ' A' ' 70' ' ' MET . 1.4 tt0 -68.42 -37.82 80.65 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.143 -0.481 . . . . 72.41 110.895 -179.992 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.521 HD13 ' O ' ' A' ' 15' ' ' GLN . 10.9 mp -56.65 -52.26 65.56 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.189 -0.459 . . . . 63.13 110.926 -179.98 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 20' ' ' GLU . . . . . 0.419 ' HG3' ' O ' ' A' ' 17' ' ' ASN . 3.6 pt-20 -68.92 -31.97 71.25 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.204 -0.453 . . . . 73.21 110.901 179.952 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -63.59 -48.66 76.45 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.15 -0.477 . . . . 71.41 111.086 179.898 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 22' ' ' ILE . . . . . 0.721 HD11 ' HB2' ' A' ' 115' ' ' PHE . 0.5 OUTLIER -77.22 -34.29 21.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.161 -0.472 . . . . 61.41 111.122 -179.995 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 42.5 mtt180 -52.52 -35.44 53.22 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.208 -0.451 . . . . 72.03 110.874 179.971 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 24.8 p -62.66 -31.19 72.02 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.199 -0.455 . . . . 73.43 110.9 -179.8 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 25' ' ' ILE . . . . . 0.75 HD13 ' CE1' ' A' ' 115' ' ' PHE . 3.9 mt -84.76 -45.44 17.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.08 -0.509 . . . . 75.34 111.154 179.952 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 24.2 m-85 -105.82 44.63 1.03 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.142 -0.481 . . . . 74.41 110.948 179.991 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 2.2 mtm -43.53 -52.38 6.21 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.104 -0.498 . . . . 62.4 110.853 179.918 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 -93.68 -27.32 16.62 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.224 -0.443 . . . . 74.31 110.889 179.93 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 10.5 m-20 -87.62 27.66 1.09 Allowed 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.177 -0.465 . . . . 64.44 110.884 -179.982 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 30' ' ' PHE . . . . . 0.539 ' HA ' HD13 ' A' ' 50' ' ' ILE . 5.4 t80 -106.21 138.7 41.93 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.161 -0.472 . . . . 75.15 110.888 -179.904 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 55.3 m -122.91 133.07 54.42 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.128 -0.487 . . . . 53.04 111.132 -179.909 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 2.8 t70 -105.04 114.9 29.37 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.21 -0.45 . . . . 75.32 110.875 179.911 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.754 HD21 ' CE1' ' A' ' 67' ' ' HIS . 0.2 OUTLIER -115.51 -7.15 12.25 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.147 -0.479 . . . . 63.3 110.935 -179.953 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 34' ' ' THR . . . . . 0.686 ' N ' HD12 ' A' ' 33' ' ' LEU . 0.2 OUTLIER . . . . . 0 C--N 1.329 -0.303 0 CA-C-N 116.231 -0.44 . . . . 64.44 111.164 179.933 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 45' ' ' GLN . . . . . 0.964 ' HG2' HG23 ' A' ' 47' ' ' ILE . 0.0 OUTLIER . . . . . 0 C--O 1.232 0.15 0 CA-C-O 120.716 0.294 . . . . 65.04 110.881 . . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 46' ' ' ILE . . . . . 0.68 HG22 ' O ' ' A' ' 45' ' ' GLN . 0.1 OUTLIER 86.87 -21.09 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.217 -0.447 . . . . 75.13 111.121 179.988 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 47' ' ' ILE . . . . . 0.964 HG23 ' HG2' ' A' ' 45' ' ' GLN . 0.1 OUTLIER -34.99 152.5 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 116.22 -0.445 . . . . 41.34 111.137 179.841 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 48' ' ' PHE . . . . . 0.713 ' HZ ' HG21 ' A' ' 114' ' ' ILE . 1.7 p90 -161.68 168.21 23.76 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.174 -0.466 . . . . 73.51 110.876 179.965 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 49' ' ' GLU . . . . . 0.457 ' CG ' ' HB2' ' A' ' 67' ' ' HIS . 7.6 mt-10 -121.19 160.98 22.68 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.114 -0.494 . . . . 61.11 110.809 -179.892 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 50' ' ' ILE . . . . . 0.539 HD13 ' HA ' ' A' ' 30' ' ' PHE . 11.5 mm -139.2 134.83 41.3 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.144 -0.48 . . . . 65.24 111.14 179.951 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 93.6 m -88.53 118.33 28.11 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.146 -0.479 . . . . 34.3 111.14 179.997 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 52' ' ' LEU . . . . . 0.927 HD12 HD12 ' A' ' 66' ' ' LEU . 21.2 mt -119.63 165.3 14.64 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.202 -0.453 . . . . 70.24 110.916 179.958 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -175.96 166.53 3.02 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.182 -0.463 . . . . 75.05 110.828 179.985 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -59.3 177.25 0.19 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.177 -0.465 . . . . 64.42 110.859 -179.801 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 16.2 m -90.89 -26.37 5.18 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.147 -0.479 . . . . 71.24 111.096 179.959 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -115.31 -169.79 1.64 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.205 -0.452 . . . . 71.44 110.894 179.924 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -116.27 -23.58 8.33 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.2 -0.455 . . . . 72.31 110.903 -179.996 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 58' ' ' GLU . . . . . 0.551 ' HA ' ' C ' ' A' ' 59' ' ' PRO . 7.9 pt-20 -114.51 146.32 35.67 Favored Pre-proline 0 C--N 1.329 -0.289 0 CA-C-O 121.574 0.702 . . . . 71.4 110.939 179.933 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 59' ' ' PRO . . . . . 0.551 ' C ' ' HA ' ' A' ' 58' ' ' GLU . 54.0 Cg_endo -69.75 -12.54 12.21 Favored 'Cis proline' 0 C--O 1.232 0.194 0 C-N-CA 122.69 -1.796 . . . . 64.32 112.334 -0.025 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 60' ' ' VAL . . . . . 0.427 ' HB ' ' CG ' ' A' ' 88' ' ' ASN . 12.2 m -147.44 167.61 5.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.25 -0.432 . . . . 63.4 111.138 179.902 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 5.9 tt0 -94.26 -22.64 18.26 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.138 -0.483 . . . . 73.04 110.873 -179.967 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 62' ' ' SER . . . . . 0.626 ' CB ' HD21 ' A' ' 125' ' ' LEU . 1.7 m 42.68 94.66 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.166 -0.47 . . . . 70.33 110.834 -179.819 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 25.5 t -118.97 123.1 43.75 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.141 -0.481 . . . . 75.53 110.878 -179.85 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 64' ' ' ILE . . . . . 0.728 HD11 HG21 ' A' ' 89' ' ' VAL . 52.9 mt -138.08 147.14 26.05 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.092 -0.503 . . . . 44.33 111.126 179.956 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 29.0 m -111.62 113.79 26.42 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.189 -0.46 . . . . 74.43 111.124 179.987 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 66' ' ' LEU . . . . . 1.017 HD21 ' CE1' ' A' ' 83' ' ' PHE . 15.9 mt -91.97 109.95 21.3 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.247 -0.433 . . . . 33.33 110.927 179.928 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 67' ' ' HIS . . . . . 0.754 ' CE1' HD21 ' A' ' 33' ' ' LEU . 1.2 t60 -95.64 109.89 22.08 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.19 -0.459 . . . . 75.22 110.839 179.884 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 68' ' ' PHE . . . . . 0.498 ' HA ' HD13 ' A' ' 81' ' ' ILE . 0.0 OUTLIER -104.02 139.93 38.45 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.219 -0.446 . . . . 53.3 110.874 -179.917 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 69' ' ' ALA . . . . . 0.563 ' HA ' HG22 ' A' ' 47' ' ' ILE . . . -124.44 120.07 30.99 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.165 -0.47 . . . . 34.13 111.087 179.93 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 70' ' ' MET . . . . . 0.527 ' HE1' ' OE1' ' A' ' 18' ' ' GLU . 9.2 mmt -79.63 95.51 5.93 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.199 -0.455 . . . . 75.32 110.864 179.98 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -49.78 160.16 0.65 Allowed Pre-proline 0 C--N 1.33 -0.263 0 CA-C-O 121.639 0.733 . . . . 74.35 111.135 -179.923 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 72' ' ' PRO . . . . . 0.614 ' O ' HD13 ' A' ' 8' ' ' LEU . 53.9 Cg_endo -69.78 3.1 2.98 Favored 'Trans proline' 0 C--N 1.342 0.189 0 C-N-CA 122.691 2.261 . . . . 61.33 112.349 179.963 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 73' ' ' MET . . . . . 0.694 ' HB3' HG23 ' A' ' 77' ' ' THR . 0.0 OUTLIER -120.36 -25.55 5.61 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.194 -0.457 . . . . 74.23 110.881 179.908 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 74' ' ' TYR . . . . . 0.653 ' CD1' ' C ' ' A' ' 74' ' ' TYR . 0.0 OUTLIER -50.52 150.75 4.51 Favored Pre-proline 0 C--N 1.328 -0.337 0 CA-C-O 121.648 0.737 . . . . 74.55 110.916 -179.854 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 75' ' ' PRO . . . . . 0.542 ' C ' ' HA ' ' A' ' 74' ' ' TYR . 53.7 Cg_endo -69.76 -14.12 12.45 Favored 'Cis proline' 0 C--N 1.341 0.183 0 C-N-CA 122.65 -1.813 . . . . 75.43 112.325 -0.089 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 76' ' ' TYR . . . . . 0.502 ' CB ' ' O ' ' A' ' 73' ' ' MET . 6.2 t80 -33.93 -52.64 0.44 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.236 -0.438 . . . . 74.01 110.883 -179.912 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 77' ' ' THR . . . . . 0.694 HG23 ' HB3' ' A' ' 73' ' ' MET . 39.0 p -105.86 -178.88 3.78 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.141 -0.481 . . . . 63.15 111.179 -179.989 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -98.62 129.36 30.32 Favored Pre-proline 0 C--N 1.329 -0.287 0 CA-C-O 121.595 0.712 . . . . 55.25 111.135 179.859 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 79' ' ' PRO . . . . . 0.778 ' HG3' HD11 ' A' ' 113' ' ' ILE . 53.9 Cg_endo -69.74 -170.89 0.42 Allowed 'Trans proline' 0 C--O 1.231 0.152 0 C-N-CA 122.717 2.278 . . . . 51.04 112.366 -179.992 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 80' ' ' GLU . . . . . 0.402 ' O ' HD13 ' A' ' 81' ' ' ILE . 2.1 tt0 -119.77 125.17 47.94 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.224 -0.443 . . . . 73.34 110.878 -179.982 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 81' ' ' ILE . . . . . 0.498 HD13 ' HA ' ' A' ' 68' ' ' PHE . 13.0 mm -121.37 142.38 37.83 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.107 -0.497 . . . . 71.33 111.109 -179.985 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 82' ' ' GLU . . . . . 0.485 ' HG3' ' CD ' ' A' ' 84' ' ' LYS . 11.8 pt-20 -148.61 147.2 28.7 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.162 -0.472 . . . . 64.14 110.886 179.903 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 83' ' ' PHE . . . . . 1.017 ' CE1' HD21 ' A' ' 66' ' ' LEU . 91.2 m-85 -95.79 139.97 31.25 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.12 -0.491 . . . . 73.11 110.893 -179.934 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 84' ' ' LYS . . . . . 0.485 ' CD ' ' HG3' ' A' ' 82' ' ' GLU . 6.0 mmmt -126.25 170.8 11.49 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.159 -0.473 . . . . 74.32 110.918 -179.998 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 85' ' ' ASN . . . . . 0.412 ' O ' ' C ' ' A' ' 86' ' ' VAL . 2.5 m120 63.53 -73.35 0.05 OUTLIER 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.258 -0.428 . . . . 72.2 110.892 179.946 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 86' ' ' VAL . . . . . 0.503 HG11 HD11 ' A' ' 94' ' ' LEU . 4.2 m 36.12 91.0 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 116.162 -0.472 . . . . 63.52 111.182 179.952 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -94.93 -72.49 0.62 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.18 -0.464 . . . . 74.01 110.881 -179.94 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 88' ' ' ASN . . . . . 0.427 ' CG ' ' HB ' ' A' ' 60' ' ' VAL . 24.5 m120 -81.28 47.1 0.99 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.184 -0.462 . . . . 72.52 110.897 -179.954 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 89' ' ' VAL . . . . . 0.728 HG21 HD11 ' A' ' 64' ' ' ILE . 48.1 t -141.71 145.27 24.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.138 -0.483 . . . . 72.34 111.118 179.897 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 90' ' ' MET . . . . . . . . . . . . . 21.3 mtm -92.04 -71.11 0.66 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.15 -0.477 . . . . 73.55 110.871 179.941 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER 178.28 -37.21 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.249 -0.432 . . . . 73.52 110.901 179.951 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -55.97 -45.78 78.82 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.196 -0.456 . . . . 54.11 110.891 -179.805 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 93' ' ' GLN . . . . . 0.581 ' HG2' ' CD2' ' A' ' 128' ' ' PHE . 2.4 mp0 -61.19 -44.38 97.38 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.152 -0.476 . . . . 73.43 110.874 -179.969 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 94' ' ' LEU . . . . . 0.503 HD11 HG11 ' A' ' 86' ' ' VAL . 78.6 mt -59.08 -48.85 80.1 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.188 -0.46 . . . . 64.14 110.92 -179.974 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 2.2 mm-40 -65.1 -33.7 76.64 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.166 -0.47 . . . . 54.42 110.877 179.959 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 96' ' ' MET . . . . . . . . . . . . . 30.5 ttp -59.9 -38.64 82.86 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.212 -0.449 . . . . 75.11 110.852 179.997 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 97' ' ' LEU . . . . . 0.581 ' HB3' ' CZ ' ' A' ' 101' ' ' PHE . 24.9 mt -65.64 -41.09 93.02 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.199 -0.455 . . . . 75.41 110.922 -179.997 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 98' ' ' LYS . . . . . 0.515 ' HA ' ' CD2' ' A' ' 101' ' ' PHE . 13.2 mmtm -55.47 -43.62 75.67 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.17 -0.468 . . . . 73.51 110.867 179.871 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 4.2 t -57.28 -38.2 73.56 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.246 -0.433 . . . . 75.55 110.87 -179.936 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 6.8 mt-10 -74.69 -29.97 61.4 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.12 -0.491 . . . . 73.54 110.887 -179.965 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 101' ' ' PHE . . . . . 0.647 ' CZ ' HD11 ' A' ' 117' ' ' ILE . 14.0 m-30 -61.74 -27.77 68.95 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.164 -0.471 . . . . 74.52 110.896 -179.93 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -65.37 -44.92 86.1 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.106 -0.497 . . . . 75.43 110.927 179.953 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.53 -37.51 74.11 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.199 -0.455 . . . . 62.01 110.912 179.846 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 104' ' ' ILE . . . . . 0.569 HD11 ' CD2' ' A' ' 120' ' ' PHE . 5.0 mt -61.93 -47.54 92.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.257 -0.429 . . . . 71.32 111.104 179.886 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 105' ' ' HIS . . . . . . . . . . . . . 1.6 t60 -62.86 -42.15 99.64 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.19 -0.459 . . . . 74.3 110.844 179.886 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -56.94 -43.37 81.44 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.242 -0.435 . . . . 64.45 110.924 -179.945 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 6.9 t -77.84 -30.71 51.14 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.127 -0.488 . . . . 65.42 111.136 -179.986 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 21.0 m -102.96 24.23 11.04 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.229 -0.441 . . . . 60.02 110.835 -179.866 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 17.9 ttt180 -67.16 77.69 0.14 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.142 -0.481 . . . . 71.21 110.901 -179.993 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 110' ' ' GLY . . . . . 0.472 ' HA2' ' CG ' ' A' ' 75' ' ' PRO . . . 145.64 -18.46 1.83 Allowed Glycine 0 N--CA 1.452 -0.266 0 C-N-CA 120.71 -0.757 . . . . 44.32 112.477 -179.949 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 111' ' ' GLN . . . . . . . . . . . . . 10.0 pt20 -117.49 -165.1 1.05 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.735 0.302 . . . . 72.31 110.928 -179.88 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 53.3 mt-10 -69.08 135.6 51.02 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.215 -0.448 . . . . 74.55 110.88 -179.944 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 113' ' ' ILE . . . . . 0.778 HD11 ' HG3' ' A' ' 79' ' ' PRO . 28.0 pt -123.8 -16.32 4.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.122 -0.49 . . . . 65.23 111.125 179.993 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 114' ' ' ILE . . . . . 0.883 ' O ' HG23 ' A' ' 118' ' ' THR . 29.7 mm -61.19 -38.7 80.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.155 -0.475 . . . . 33.34 111.115 179.878 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 115' ' ' PHE . . . . . 0.75 ' CE1' HD13 ' A' ' 25' ' ' ILE . 43.0 t80 -72.82 -36.16 67.46 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.183 -0.462 . . . . 75.43 110.883 179.969 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 8.3 mm-40 -68.3 -46.66 69.72 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.14 -0.482 . . . . 73.41 110.897 -179.958 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 117' ' ' ILE . . . . . 0.647 HD11 ' CZ ' ' A' ' 101' ' ' PHE . 0.0 OUTLIER -65.79 -41.94 91.29 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 116.161 -0.472 . . . . 74.31 111.111 179.984 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 118' ' ' THR . . . . . 0.883 HG23 ' O ' ' A' ' 114' ' ' ILE . 57.4 p -68.8 -42.95 76.63 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.179 -0.464 . . . . 54.11 111.15 179.943 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 36.6 t -65.13 -44.34 89.0 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.198 -0.455 . . . . 74.42 110.87 -179.867 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 120' ' ' PHE . . . . . 0.569 ' CD2' HD11 ' A' ' 104' ' ' ILE . 0.7 OUTLIER -60.87 -48.08 83.45 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.161 -0.472 . . . . 73.13 110.878 -179.963 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 121' ' ' THR . . . . . 0.957 HG21 HD11 ' A' ' 66' ' ' LEU . 18.9 p -58.77 -38.98 79.68 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.13 -0.486 . . . . 72.12 111.182 -179.94 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 9.1 tt0 -61.46 -40.89 96.14 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.197 -0.456 . . . . 75.45 110.929 179.972 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 123' ' ' GLU . . . . . 0.453 ' HG2' ' N ' ' A' ' 124' ' ' LYS . 1.0 OUTLIER -75.46 -45.0 41.21 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.231 -0.441 . . . . 74.43 110.901 -179.965 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 124' ' ' LYS . . . . . 0.453 ' N ' ' HG2' ' A' ' 123' ' ' GLU . 8.4 mmmt -64.43 -37.83 88.91 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.167 -0.469 . . . . 71.53 110.907 179.957 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 125' ' ' LEU . . . . . 0.789 ' O ' HD23 ' A' ' 125' ' ' LEU . 3.6 tt -69.65 -44.59 70.23 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.18 -0.464 . . . . 73.41 110.919 179.909 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 126' ' ' ASP . . . . . 0.424 ' OD1' ' C ' ' A' ' 126' ' ' ASP . 0.0 OUTLIER -68.61 -39.89 80.65 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.183 -0.462 . . . . 73.52 110.833 179.858 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 127' ' ' GLU . . . . . 0.491 ' HG3' ' N ' ' A' ' 128' ' ' PHE . 3.2 pt-20 -65.62 -42.77 91.17 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.225 -0.443 . . . . 63.4 110.882 -179.889 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 128' ' ' PHE . . . . . 0.659 ' CD1' ' C ' ' A' ' 128' ' ' PHE . 0.0 OUTLIER . . . . . 0 C--N 1.329 -0.301 0 CA-C-N 116.165 -0.47 . . . . 74.3 110.911 -179.926 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 8' ' ' LEU . . . . . 0.71 HD13 ' O ' ' A' ' 72' ' ' PRO . 20.1 mt . . . . . 0 C--O 1.231 0.107 0 CA-C-O 120.816 0.341 . . . . 71.22 110.926 . . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -51.52 -31.67 24.87 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.211 -0.45 . . . . 74.13 110.85 179.856 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 8.7 mm100 -67.85 -35.49 78.66 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.178 -0.464 . . . . 73.45 110.88 -179.87 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 11' ' ' TYR . . . . . 0.402 ' CD1' ' HD2' ' A' ' 75' ' ' PRO . 13.6 m-85 -67.61 -24.98 65.53 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.208 -0.451 . . . . 74.11 110.933 -179.893 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -59.26 -38.08 79.18 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.146 -0.479 . . . . 64.1 110.925 -179.917 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 2.7 mm-40 -58.86 -46.0 88.8 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.126 -0.488 . . . . 44.34 110.903 179.979 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 14' ' ' ILE . . . . . 0.541 HG22 ' OE1' ' A' ' 18' ' ' GLU . 4.2 mp -68.05 -46.64 81.27 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.179 -0.464 . . . . 74.23 111.115 179.961 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 84.5 mt-30 -57.21 -48.22 79.33 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.202 -0.453 . . . . 74.32 110.89 179.966 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -62.22 -42.27 99.15 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.263 -0.426 . . . . 74.05 110.886 -179.945 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 2.5 m-20 -58.1 -33.64 69.33 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.168 -0.469 . . . . 74.41 110.876 -179.879 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 18' ' ' GLU . . . . . 0.541 ' OE1' HG22 ' A' ' 14' ' ' ILE . 2.4 mp0 -65.44 -38.85 91.1 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.163 -0.471 . . . . 74.23 110.93 179.986 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 8.5 mp -63.7 -51.7 63.84 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.103 -0.499 . . . . 74.12 110.909 -179.972 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 1.9 pt-20 -68.9 -32.72 72.55 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.163 -0.472 . . . . 73.32 110.888 179.925 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -62.06 -50.56 71.51 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.175 -0.466 . . . . 75.54 111.07 179.95 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 22' ' ' ILE . . . . . 0.716 ' HA ' HD12 ' A' ' 25' ' ' ILE . 0.6 OUTLIER -77.23 -34.36 21.2 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 116.249 -0.432 . . . . 72.54 111.112 179.985 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 44.4 mtp180 -52.54 -35.02 52.6 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.187 -0.46 . . . . 53.42 110.89 179.973 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -66.98 -31.43 72.0 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.191 -0.459 . . . . 51.42 110.828 -179.812 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 25' ' ' ILE . . . . . 0.722 HG21 ' HE1' ' A' ' 115' ' ' PHE . 3.9 mt -82.89 -44.41 18.96 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.159 -0.473 . . . . 74.5 111.137 179.967 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 26.6 m-85 -106.6 41.16 1.49 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.193 -0.458 . . . . 73.34 110.964 -179.994 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER -40.4 -49.38 2.82 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.099 -0.501 . . . . 71.42 110.895 179.91 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -98.39 -9.02 25.88 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.196 -0.456 . . . . 43.42 110.872 179.981 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -104.67 32.65 3.98 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.218 -0.446 . . . . 72.24 110.819 -179.999 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 30' ' ' PHE . . . . . 0.627 ' HA ' HD13 ' A' ' 50' ' ' ILE . 1.7 t80 -116.55 138.39 51.45 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.234 -0.439 . . . . 73.11 110.89 -179.95 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 52.3 m -111.71 129.79 55.99 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.147 -0.479 . . . . 71.34 111.089 -179.857 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 32' ' ' ASP . . . . . 0.452 ' O ' ' CG ' ' A' ' 32' ' ' ASP . 0.0 OUTLIER -99.36 115.62 29.64 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.215 -0.448 . . . . 53.1 110.864 179.861 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.854 HD21 HG12 ' A' ' 47' ' ' ILE . 0.4 OUTLIER -123.48 -17.04 6.62 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.138 -0.483 . . . . 63.34 110.943 -179.976 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 34' ' ' THR . . . . . 0.81 ' N ' HD23 ' A' ' 33' ' ' LEU . 1.2 m . . . . . 0 C--N 1.329 -0.295 0 CA-C-N 116.187 -0.46 . . . . 75.33 111.098 180.0 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 45' ' ' GLN . . . . . 0.559 ' O ' HG22 ' A' ' 46' ' ' ILE . 16.2 tt0 . . . . . 0 C--O 1.231 0.101 0 CA-C-O 120.778 0.323 . . . . 73.44 110.931 . . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 46' ' ' ILE . . . . . 0.559 HG22 ' O ' ' A' ' 45' ' ' GLN . 0.0 OUTLIER 82.02 -3.99 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.179 -0.464 . . . . 74.23 111.146 179.979 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 47' ' ' ILE . . . . . 0.854 HG12 HD21 ' A' ' 33' ' ' LEU . 0.2 OUTLIER -59.83 143.37 14.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.162 -0.472 . . . . 71.44 111.117 179.844 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 48' ' ' PHE . . . . . 0.767 ' HA ' HD22 ' A' ' 33' ' ' LEU . 4.2 p90 -155.54 154.73 32.19 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.218 -0.447 . . . . 73.51 110.884 179.955 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 49' ' ' GLU . . . . . 0.69 ' CG ' HD13 ' A' ' 33' ' ' LEU . 6.0 mt-10 -108.93 159.17 17.02 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.178 -0.465 . . . . 64.1 110.928 -179.971 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 50' ' ' ILE . . . . . 0.627 HD13 ' HA ' ' A' ' 30' ' ' PHE . 7.3 mm -133.95 140.6 46.0 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 116.174 -0.466 . . . . 71.43 111.179 179.962 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 88.9 m -85.21 118.58 24.84 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.208 -0.451 . . . . 73.11 111.153 179.99 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 52' ' ' LEU . . . . . 0.474 HD12 HD22 ' A' ' 66' ' ' LEU . 17.0 mt -123.3 163.23 21.13 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.286 -0.415 . . . . 74.12 110.925 179.962 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -178.43 175.54 1.14 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.211 -0.45 . . . . 73.22 110.905 179.979 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -70.12 -156.08 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.16 -0.473 . . . . 64.2 110.873 -179.811 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 18.0 m -117.72 -20.08 5.62 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.138 -0.483 . . . . 63.22 111.156 179.926 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -112.44 174.73 5.75 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.171 -0.468 . . . . 54.03 110.89 179.916 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -111.8 -22.38 11.16 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.173 -0.467 . . . . 73.12 110.895 179.989 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 58' ' ' GLU . . . . . 0.543 ' HA ' ' C ' ' A' ' 59' ' ' PRO . 3.4 pt-20 -126.32 148.91 65.6 Favored Pre-proline 0 C--N 1.33 -0.26 0 CA-C-O 121.692 0.758 . . . . 55.33 110.84 179.956 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 59' ' ' PRO . . . . . 0.543 ' C ' ' HA ' ' A' ' 58' ' ' GLU . 54.0 Cg_endo -69.72 -8.58 10.5 Favored 'Cis proline' 0 C--N 1.342 0.186 0 C-N-CA 122.737 -1.776 . . . . 74.34 112.33 0.012 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 29.2 m -139.5 172.27 13.08 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.193 -0.458 . . . . 64.42 111.131 179.923 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 5.1 tt0 -108.35 -17.15 14.07 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.143 -0.48 . . . . 74.32 110.882 179.99 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 62' ' ' SER . . . . . 0.805 ' CB ' HD11 ' A' ' 125' ' ' LEU . 0.3 OUTLIER 41.4 93.43 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.193 -0.458 . . . . 41.55 110.86 -179.773 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 16.1 t -124.5 124.02 41.38 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.112 -0.495 . . . . 73.14 110.835 -179.831 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 64' ' ' ILE . . . . . . . . . . . . . 14.5 mt -138.34 146.06 27.37 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 116.124 -0.489 . . . . 73.0 111.155 179.889 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 62.1 m -110.32 113.69 26.55 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.162 -0.472 . . . . 73.44 111.159 179.996 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 66' ' ' LEU . . . . . 0.636 HD21 HG21 ' A' ' 121' ' ' THR . 0.4 OUTLIER -91.75 112.24 24.08 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.267 -0.424 . . . . 63.03 110.92 179.955 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 1.9 t-80 -105.27 109.87 22.02 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.203 -0.453 . . . . 74.53 110.872 179.841 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 68' ' ' PHE . . . . . 0.501 ' HA ' HD13 ' A' ' 81' ' ' ILE . 0.0 OUTLIER -103.75 140.12 38.05 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.208 -0.451 . . . . 71.43 110.871 -179.916 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -119.3 129.36 54.84 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.159 -0.473 . . . . 43.32 111.093 179.921 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 70' ' ' MET . . . . . 0.794 ' HE3' HD11 ' A' ' 114' ' ' ILE . 17.8 mmt -91.35 95.7 10.14 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.22 -0.445 . . . . 61.43 110.845 -179.993 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -51.61 159.96 1.14 Allowed Pre-proline 0 C--N 1.329 -0.295 0 CA-C-O 121.578 0.704 . . . . 63.03 111.129 -179.91 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 72' ' ' PRO . . . . . 0.71 ' O ' HD13 ' A' ' 8' ' ' LEU . 53.8 Cg_endo -69.8 3.29 2.88 Favored 'Trans proline' 0 C--N 1.341 0.163 0 C-N-CA 122.705 2.27 . . . . 75.32 112.362 179.944 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 73' ' ' MET . . . . . 0.514 ' HB3' HG23 ' A' ' 77' ' ' THR . 0.1 OUTLIER -119.73 -25.78 5.83 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.182 -0.463 . . . . 72.44 110.921 179.911 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 74' ' ' TYR . . . . . 0.651 ' CD1' ' C ' ' A' ' 74' ' ' TYR . 0.0 OUTLIER -48.37 149.59 2.69 Favored Pre-proline 0 C--N 1.329 -0.305 0 CA-C-O 121.692 0.758 . . . . 65.44 110.987 -179.909 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 75' ' ' PRO . . . . . 0.536 ' C ' ' HA ' ' A' ' 74' ' ' TYR . 53.6 Cg_endo -69.84 -13.0 12.51 Favored 'Cis proline' 0 C--O 1.232 0.184 0 C-N-CA 122.688 -1.797 . . . . 43.54 112.341 0.059 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 76' ' ' TYR . . . . . 0.489 ' CB ' ' O ' ' A' ' 73' ' ' MET . 1.5 t80 -34.89 -48.48 0.4 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.232 -0.44 . . . . 73.41 110.91 -179.917 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 77' ' ' THR . . . . . 0.514 HG23 ' HB3' ' A' ' 73' ' ' MET . 69.6 p -108.2 169.92 8.33 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.119 -0.491 . . . . 75.12 111.168 -179.985 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -89.59 129.81 45.64 Favored Pre-proline 0 C--N 1.33 -0.282 0 CA-C-O 121.57 0.7 . . . . 44.54 111.121 179.858 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 79' ' ' PRO . . . . . 0.778 ' HG3' HD11 ' A' ' 113' ' ' ILE . 53.6 Cg_endo -69.77 179.38 3.74 Favored 'Trans proline' 0 C--N 1.341 0.163 0 C-N-CA 122.643 2.229 . . . . 63.11 112.355 -179.989 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -117.1 137.13 52.49 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.219 -0.446 . . . . 73.04 110.846 -179.921 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 81' ' ' ILE . . . . . 0.501 HD13 ' HA ' ' A' ' 68' ' ' PHE . 5.2 mm -125.45 144.21 36.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.164 -0.471 . . . . 74.31 111.139 179.964 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 82' ' ' GLU . . . . . 0.473 ' HG3' ' CD ' ' A' ' 84' ' ' LYS . 3.0 pt-20 -145.48 141.25 28.16 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.175 -0.466 . . . . 75.04 110.901 179.985 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 83' ' ' PHE . . . . . 0.636 ' CG ' HD22 ' A' ' 94' ' ' LEU . 7.5 m-85 -96.97 141.02 30.64 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.196 -0.456 . . . . 65.1 110.886 -179.916 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 84' ' ' LYS . . . . . 0.473 ' CD ' ' HG3' ' A' ' 82' ' ' GLU . 5.1 mmmt -125.45 172.22 9.84 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.124 -0.489 . . . . 72.11 110.9 179.952 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 85' ' ' ASN . . . . . 0.4 ' C ' ' CG2' ' A' ' 86' ' ' VAL . 5.7 m120 61.48 -75.24 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.222 -0.445 . . . . 65.32 110.865 179.939 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 86' ' ' VAL . . . . . 1.012 HG11 HD11 ' A' ' 94' ' ' LEU . 2.4 m 39.96 92.63 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.233 -0.44 . . . . 74.41 111.125 179.916 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -97.06 -87.43 0.31 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.147 -0.478 . . . . 63.04 110.938 -179.992 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -47.93 -51.25 24.15 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.199 -0.455 . . . . 74.43 110.897 -179.985 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 89' ' ' VAL . . . . . 0.694 HG21 ' HG ' ' A' ' 94' ' ' LEU . 1.2 p -59.53 135.2 24.34 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.187 -0.461 . . . . 75.11 111.123 179.903 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 90' ' ' MET . . . . . . . . . . . . . 4.7 mtm -86.87 -60.82 1.88 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.168 -0.469 . . . . 73.22 110.882 179.925 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 3.5 p-10 179.41 -32.1 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.198 -0.455 . . . . 74.14 110.858 179.961 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 99.8 p -54.6 -45.35 73.63 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.2 -0.455 . . . . 75.33 110.832 -179.773 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 93' ' ' GLN . . . . . 0.645 ' CD ' ' CD1' ' A' ' 128' ' ' PHE . 1.2 mt-30 -70.2 -38.09 75.25 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.14 -0.482 . . . . 70.34 110.894 -179.947 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 94' ' ' LEU . . . . . 1.012 HD11 HG11 ' A' ' 86' ' ' VAL . 29.2 mt -58.84 -47.77 83.68 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.217 -0.447 . . . . 72.51 110.91 -179.986 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 28.4 mt-30 -62.78 -34.1 76.56 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.168 -0.469 . . . . 74.31 110.952 179.919 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 96' ' ' MET . . . . . . . . . . . . . 43.5 ttp -60.47 -37.27 80.48 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.199 -0.455 . . . . 63.43 110.86 179.941 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 97' ' ' LEU . . . . . 0.984 HD22 HG22 ' A' ' 121' ' ' THR . 80.4 mt -61.41 -46.57 89.57 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.223 -0.444 . . . . 73.23 110.891 -179.97 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 98' ' ' LYS . . . . . 0.528 ' HD3' ' CZ ' ' A' ' 83' ' ' PHE . 3.9 mmtp -58.12 -34.16 69.92 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.204 -0.453 . . . . 70.24 110.87 179.896 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 1.4 t -69.68 -46.29 66.4 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.207 -0.452 . . . . 71.0 110.822 -179.887 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 100' ' ' GLU . . . . . 0.67 ' O ' HD12 ' A' ' 104' ' ' ILE . 7.7 pt-20 -72.38 -23.88 61.18 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.145 -0.48 . . . . 71.32 110.926 -179.973 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 101' ' ' PHE . . . . . 0.611 ' CD1' ' O ' ' A' ' 97' ' ' LEU . 10.1 m-30 -59.42 -22.9 62.14 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.121 -0.49 . . . . 63.3 110.886 -179.93 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.46 -45.38 59.78 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.155 -0.475 . . . . 74.03 110.858 -179.999 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 24.6 mtmm -63.24 -38.8 92.57 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.189 -0.46 . . . . 55.13 110.869 179.922 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 104' ' ' ILE . . . . . 0.716 HD11 ' CD2' ' A' ' 120' ' ' PHE . 1.6 mp -63.08 -47.63 91.66 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.218 -0.446 . . . . 73.54 111.108 179.876 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 105' ' ' HIS . . . . . . . . . . . . . 9.3 t-80 -63.12 -41.88 99.43 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.201 -0.454 . . . . 73.44 110.866 179.867 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -56.73 -43.39 80.6 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.21 -0.45 . . . . 72.21 110.9 -179.929 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 107' ' ' THR . . . . . 0.411 HG22 ' O ' ' A' ' 104' ' ' ILE . 7.6 t -77.73 -22.39 50.44 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.185 -0.461 . . . . 71.01 111.162 -179.983 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 108' ' ' SER . . . . . 0.584 ' HB3' HG22 ' A' ' 113' ' ' ILE . 1.7 m -118.3 35.46 4.75 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.197 -0.456 . . . . 73.43 110.862 -179.851 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 14.4 ttt180 -75.87 88.41 2.88 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.163 -0.471 . . . . 70.1 110.85 -179.919 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 123.33 32.85 0.87 Allowed Glycine 0 N--CA 1.45 -0.369 0 C-N-CA 120.754 -0.736 . . . . 51.41 112.49 179.987 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 111' ' ' GLN . . . . . . . . . . . . . 3.4 pt20 -169.28 -162.98 0.38 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.794 0.331 . . . . 71.42 110.878 -179.888 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 35.3 mt-10 -65.9 127.1 30.7 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.162 -0.472 . . . . 74.13 110.833 -179.896 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 113' ' ' ILE . . . . . 0.778 HD11 ' HG3' ' A' ' 79' ' ' PRO . 7.4 pt -126.35 -8.35 5.1 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 116.122 -0.49 . . . . 61.24 111.13 179.947 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 114' ' ' ILE . . . . . 0.883 ' H ' HD12 ' A' ' 114' ' ' ILE . 3.6 mp -67.73 -46.77 81.92 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.174 -0.466 . . . . 73.23 111.114 179.873 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 115' ' ' PHE . . . . . 0.722 ' HE1' HG21 ' A' ' 25' ' ' ILE . 28.1 t80 -68.28 -36.42 79.37 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.157 -0.474 . . . . 72.42 110.852 -179.979 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 53.4 mm-40 -67.54 -45.79 74.68 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.139 -0.482 . . . . 71.54 110.911 -179.945 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 117' ' ' ILE . . . . . 0.532 HD11 ' CG ' ' A' ' 101' ' ' PHE . 0.4 OUTLIER -67.15 -40.41 85.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.111 -0.495 . . . . 74.2 111.141 179.983 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 118' ' ' THR . . . . . 0.802 HG23 ' O ' ' A' ' 114' ' ' ILE . 62.1 p -68.35 -43.43 77.49 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.156 -0.475 . . . . 44.14 111.114 179.956 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -64.9 -43.89 91.39 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.26 -0.427 . . . . 51.01 110.829 -179.824 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 120' ' ' PHE . . . . . 0.716 ' CD2' HD11 ' A' ' 104' ' ' ILE . 0.1 OUTLIER -60.86 -48.58 81.15 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.13 -0.486 . . . . 74.24 110.904 -179.961 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 121' ' ' THR . . . . . 0.984 HG22 HD22 ' A' ' 97' ' ' LEU . 29.5 p -64.52 -40.31 95.39 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.128 -0.487 . . . . 63.23 111.145 -179.949 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 16.1 tt0 -60.17 -38.14 82.28 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.211 -0.449 . . . . 71.23 110.955 179.985 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 123' ' ' GLU . . . . . 0.515 ' C ' ' CD ' ' A' ' 123' ' ' GLU . 0.1 OUTLIER -77.87 -46.38 21.55 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.156 -0.475 . . . . 74.32 110.947 179.986 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.4 -34.1 77.39 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.127 -0.488 . . . . 74.32 110.889 179.96 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 125' ' ' LEU . . . . . 0.805 HD11 ' CB ' ' A' ' 62' ' ' SER . 1.8 tp -68.96 -43.37 75.14 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.236 -0.438 . . . . 63.43 110.925 179.926 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -68.12 -36.95 80.55 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.139 -0.482 . . . . 74.53 110.885 179.863 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 127' ' ' GLU . . . . . 0.42 ' HG3' ' N ' ' A' ' 128' ' ' PHE . 0.0 OUTLIER -62.39 -28.76 70.0 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.155 -0.475 . . . . 70.14 110.906 -179.947 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 128' ' ' PHE . . . . . 0.645 ' CD1' ' CD ' ' A' ' 93' ' ' GLN . 0.2 OUTLIER . . . . . 0 C--N 1.329 -0.324 0 CA-C-N 116.143 -0.48 . . . . 65.54 110.907 -179.918 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 8' ' ' LEU . . . . . 0.416 HD13 ' O ' ' A' ' 72' ' ' PRO . 16.6 mt . . . . . 0 C--O 1.231 0.08 0 CA-C-O 120.874 0.369 . . . . 74.53 110.926 . . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -51.4 -32.02 24.8 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.181 -0.463 . . . . 73.54 110.885 179.802 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 11.4 mm-40 -68.4 -40.32 81.35 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.185 -0.462 . . . . 72.45 110.896 -179.906 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 10.4 m-85 -49.37 -23.32 1.42 Allowed 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.229 -0.441 . . . . 74.25 110.896 -179.85 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 9.1 m-85 -57.72 -36.34 71.88 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.158 -0.474 . . . . 73.12 110.958 -179.919 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 13' ' ' GLU . . . . . 0.601 ' CG ' HD12 ' A' ' 14' ' ' ILE . 11.9 pt-20 -60.97 -43.55 98.6 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.068 -0.514 . . . . 74.23 110.868 -179.965 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 14' ' ' ILE . . . . . 0.601 HD12 ' CG ' ' A' ' 13' ' ' GLU . 2.8 mp -68.15 -43.32 85.11 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.179 -0.464 . . . . 74.05 111.19 179.932 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 15' ' ' GLN . . . . . 0.473 ' HG2' ' CB ' ' A' ' 70' ' ' MET . 20.4 mt-30 -63.16 -45.74 90.44 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.118 -0.492 . . . . 54.34 110.931 179.928 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 16.1 t -58.86 -41.59 87.38 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.224 -0.444 . . . . 64.22 110.869 -179.934 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 4.8 m-20 -63.15 -34.02 76.71 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.191 -0.459 . . . . 73.04 110.87 -179.917 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 18' ' ' GLU . . . . . 0.415 ' N ' ' OE1' ' A' ' 18' ' ' GLU . 0.0 OUTLIER -66.22 -38.99 89.25 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.193 -0.458 . . . . 61.1 110.89 -179.994 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.726 HD11 HG13 ' A' ' 46' ' ' ILE . 6.0 mt -60.79 -51.64 68.48 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.18 -0.463 . . . . 61.13 110.883 -179.968 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 4.8 pt-20 -68.74 -38.15 79.93 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.227 -0.442 . . . . 52.42 110.863 179.943 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -58.63 -50.54 73.47 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.154 -0.475 . . . . 62.13 111.084 179.977 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 22' ' ' ILE . . . . . 0.577 ' HA ' HD12 ' A' ' 25' ' ' ILE . 0.7 OUTLIER -75.49 -35.83 33.45 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.218 -0.446 . . . . 74.21 111.115 179.984 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 7.2 mtp180 -52.55 -34.25 49.28 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.178 -0.464 . . . . 72.45 110.873 179.981 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -66.39 -34.55 78.21 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.183 -0.462 . . . . 74.05 110.831 -179.816 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 25' ' ' ILE . . . . . 0.9 HD13 ' CE1' ' A' ' 115' ' ' PHE . 3.7 mt -79.92 -45.34 22.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.178 -0.465 . . . . 61.11 111.117 179.977 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 34.9 m-85 -109.78 45.38 1.1 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.177 -0.465 . . . . 63.41 110.974 -179.989 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 27' ' ' MET . . . . . 0.417 ' H ' ' HE2' ' A' ' 27' ' ' MET . 0.4 OUTLIER -39.68 -55.6 1.86 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.103 -0.499 . . . . 72.32 110.882 179.921 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -95.28 -14.69 23.76 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.252 -0.431 . . . . 72.32 110.88 179.945 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 4.4 m-20 -92.75 31.01 1.44 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.185 -0.461 . . . . 72.41 110.897 179.997 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 30' ' ' PHE . . . . . 0.519 ' CD1' ' C ' ' A' ' 30' ' ' PHE . 2.0 t80 -120.39 142.26 49.35 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.163 -0.471 . . . . 74.51 110.846 -179.881 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 31' ' ' THR . . . . . 0.45 ' N ' ' CD1' ' A' ' 30' ' ' PHE . 18.2 m -119.01 129.38 55.1 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.16 -0.473 . . . . 74.44 111.148 -179.925 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 10.2 t0 -89.27 113.6 24.87 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.206 -0.452 . . . . 70.12 110.883 179.902 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.991 HD21 HG12 ' A' ' 47' ' ' ILE . 0.4 OUTLIER -120.19 -28.92 4.98 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.159 -0.473 . . . . 63.34 110.891 -179.962 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 34' ' ' THR . . . . . 0.934 ' N ' HD23 ' A' ' 33' ' ' LEU . 5.2 m . . . . . 0 C--N 1.329 -0.306 0 CA-C-N 116.231 -0.441 . . . . 72.53 111.166 179.957 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 45' ' ' GLN . . . . . 0.519 ' CG ' ' O ' ' A' ' 45' ' ' GLN . 7.3 tt0 . . . . . 0 C--O 1.232 0.163 0 CA-C-O 120.775 0.321 . . . . 62.15 110.921 . . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 46' ' ' ILE . . . . . 0.726 HG13 HD11 ' A' ' 19' ' ' LEU . 0.0 OUTLIER 82.81 -28.1 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.215 -0.448 . . . . 72.05 111.118 179.952 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 47' ' ' ILE . . . . . 0.991 HG12 HD21 ' A' ' 33' ' ' LEU . 0.2 OUTLIER -37.97 150.42 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.147 -0.479 . . . . 54.21 111.129 179.877 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 48' ' ' PHE . . . . . 0.733 ' HA ' HD22 ' A' ' 33' ' ' LEU . 1.6 p90 -152.35 157.93 41.99 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.187 -0.46 . . . . 64.42 110.902 179.967 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 49' ' ' GLU . . . . . 0.678 ' HG3' HD13 ' A' ' 33' ' ' LEU . 7.1 mt-10 -108.76 147.43 32.03 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.164 -0.471 . . . . 55.44 110.886 -179.939 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 50' ' ' ILE . . . . . 0.417 HD13 ' HA ' ' A' ' 30' ' ' PHE . 10.8 mm -129.32 135.23 62.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.172 -0.467 . . . . 71.52 111.132 179.955 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 98.4 m -84.27 132.16 34.66 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.174 -0.466 . . . . 62.21 111.134 179.945 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 52' ' ' LEU . . . . . 0.717 HD12 HD12 ' A' ' 66' ' ' LEU . 19.8 mt -132.83 157.04 46.01 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.18 -0.464 . . . . 63.41 110.88 179.983 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 53' ' ' ARG . . . . . 0.741 ' C ' HD21 ' A' ' 125' ' ' LEU . 0.0 OUTLIER -178.64 166.02 1.71 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.219 -0.446 . . . . 74.51 110.921 179.952 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 54' ' ' SER . . . . . 0.853 ' CA ' HD11 ' A' ' 125' ' ' LEU . 0.4 OUTLIER -62.63 -176.53 0.11 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.223 -0.444 . . . . 53.44 110.859 -179.765 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 18.5 m -99.08 -24.08 4.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.147 -0.479 . . . . 61.45 111.096 -179.991 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -112.92 -171.03 1.79 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.196 -0.456 . . . . 54.51 110.925 179.902 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 6.0 mmmm -119.33 -18.92 8.46 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.234 -0.439 . . . . 73.12 110.874 179.989 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 58' ' ' GLU . . . . . 0.56 ' HA ' ' C ' ' A' ' 59' ' ' PRO . 11.2 pt-20 -115.97 143.27 30.53 Favored Pre-proline 0 C--N 1.329 -0.315 0 CA-C-O 121.599 0.714 . . . . 73.41 110.898 179.939 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 59' ' ' PRO . . . . . 0.56 ' C ' ' HA ' ' A' ' 58' ' ' GLU . 54.0 Cg_endo -69.67 -9.23 10.74 Favored 'Cis proline' 0 C--O 1.232 0.205 0 C-N-CA 122.746 -1.772 . . . . 73.12 112.355 -0.051 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 60' ' ' VAL . . . . . 0.479 ' HB ' ' ND2' ' A' ' 88' ' ' ASN . 11.9 m -152.13 -176.29 0.25 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.215 -0.448 . . . . 51.03 111.129 179.945 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 61' ' ' GLU . . . . . 0.457 ' O ' ' C ' ' A' ' 62' ' ' SER . 11.7 tt0 -113.24 -11.95 13.16 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.166 -0.47 . . . . 74.44 110.898 -179.977 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 62' ' ' SER . . . . . 0.836 ' HB3' HD13 ' A' ' 125' ' ' LEU . 0.1 OUTLIER 33.16 90.56 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.122 -0.49 . . . . 70.4 110.846 -179.794 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 32.3 t -109.53 124.73 51.58 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.11 -0.495 . . . . 63.25 110.876 -179.849 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 64' ' ' ILE . . . . . 0.513 HD11 HG21 ' A' ' 89' ' ' VAL . 14.5 mt -139.71 150.72 22.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.144 -0.48 . . . . 73.51 111.115 179.998 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 90.7 m -120.9 114.47 21.62 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.182 -0.463 . . . . 53.24 111.123 179.957 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 66' ' ' LEU . . . . . 0.992 HD11 HG21 ' A' ' 121' ' ' THR . 17.5 mt -93.81 116.49 28.96 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.224 -0.444 . . . . 72.35 110.923 179.914 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 7.2 t60 -103.98 115.44 30.45 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.223 -0.444 . . . . 73.54 110.817 179.883 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 68' ' ' PHE . . . . . 0.614 ' HA ' HD13 ' A' ' 81' ' ' ILE . 0.0 OUTLIER -103.86 139.75 38.62 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.183 -0.462 . . . . 74.44 110.889 -179.923 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 69' ' ' ALA . . . . . 0.597 ' HA ' HG22 ' A' ' 47' ' ' ILE . . . -120.44 114.93 22.53 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.125 -0.489 . . . . 62.44 111.108 179.906 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 70' ' ' MET . . . . . 0.473 ' CB ' ' HG2' ' A' ' 15' ' ' GLN . 1.0 OUTLIER -81.59 95.38 7.14 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.203 -0.453 . . . . 72.34 110.929 179.929 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -51.36 161.49 0.78 Allowed Pre-proline 0 C--N 1.329 -0.295 0 CA-C-O 121.602 0.715 . . . . 61.51 111.134 -179.89 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 72' ' ' PRO . . . . . 0.416 ' O ' HD13 ' A' ' 8' ' ' LEU . 53.0 Cg_endo -69.75 -15.09 36.97 Favored 'Trans proline' 0 C--N 1.341 0.158 0 C-N-CA 122.694 2.263 . . . . 63.35 112.316 179.991 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 73' ' ' MET . . . . . 0.57 ' HB3' HG23 ' A' ' 77' ' ' THR . 0.0 OUTLIER -101.38 -20.68 15.07 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.211 -0.45 . . . . 71.22 110.889 179.876 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 74' ' ' TYR . . . . . 0.668 ' CD1' ' C ' ' A' ' 74' ' ' TYR . 0.0 OUTLIER -50.72 152.42 3.5 Favored Pre-proline 0 C--N 1.328 -0.356 0 CA-C-O 121.654 0.74 . . . . 62.51 110.913 -179.899 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 75' ' ' PRO . . . . . 0.548 ' C ' ' HA ' ' A' ' 74' ' ' TYR . 54.1 Cg_endo -69.75 -11.37 11.87 Favored 'Cis proline' 0 C--O 1.231 0.169 0 C-N-CA 122.684 -1.798 . . . . 62.23 112.334 -0.033 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 76' ' ' TYR . . . . . 0.501 ' CB ' ' O ' ' A' ' 73' ' ' MET . 2.3 t80 -34.06 -56.77 0.48 Allowed 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.175 -0.466 . . . . 61.5 110.927 -179.895 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 77' ' ' THR . . . . . 0.57 HG23 ' HB3' ' A' ' 73' ' ' MET . 37.6 p -99.46 167.48 10.59 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.117 -0.492 . . . . 75.5 111.14 -179.969 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -89.03 129.93 46.36 Favored Pre-proline 0 C--N 1.329 -0.288 0 CA-C-O 121.576 0.703 . . . . 71.02 111.096 179.864 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 79' ' ' PRO . . . . . 0.765 ' HG3' HD11 ' A' ' 113' ' ' ILE . 53.4 Cg_endo -69.75 -176.59 1.53 Allowed 'Trans proline' 0 C--N 1.341 0.172 0 C-N-CA 122.695 2.263 . . . . 73.22 112.365 179.984 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 80' ' ' GLU . . . . . 0.585 ' O ' HD13 ' A' ' 81' ' ' ILE . 2.8 tt0 -114.55 141.16 48.1 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.223 -0.444 . . . . 51.41 110.912 -179.974 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 81' ' ' ILE . . . . . 0.614 HD13 ' HA ' ' A' ' 68' ' ' PHE . 17.4 mm -133.44 140.88 45.86 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.17 -0.468 . . . . 73.5 111.111 -179.979 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 82' ' ' GLU . . . . . 0.478 ' HG3' ' CD ' ' A' ' 84' ' ' LYS . 5.9 pt-20 -149.08 145.76 27.39 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.185 -0.461 . . . . 72.42 110.883 179.95 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 83' ' ' PHE . . . . . 0.917 ' CE1' HD21 ' A' ' 66' ' ' LEU . 26.5 m-85 -97.65 142.14 29.82 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.196 -0.457 . . . . 60.53 110.896 -179.946 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 84' ' ' LYS . . . . . 0.478 ' CD ' ' HG3' ' A' ' 82' ' ' GLU . 5.1 mmmt -126.92 173.65 9.44 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.167 -0.469 . . . . 75.51 110.872 179.975 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 85' ' ' ASN . . . . . 0.464 ' O ' ' C ' ' A' ' 86' ' ' VAL . 4.1 m120 63.29 -72.67 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.175 -0.466 . . . . 72.2 110.857 179.942 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 86' ' ' VAL . . . . . 0.568 ' O ' HG23 ' A' ' 86' ' ' VAL . 16.6 m 32.13 90.99 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.192 -0.458 . . . . 71.11 111.125 179.924 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -95.51 -74.14 0.56 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.167 -0.469 . . . . 50.22 110.91 -179.988 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 88' ' ' ASN . . . . . 0.479 ' ND2' ' HB ' ' A' ' 60' ' ' VAL . 62.4 m-80 -78.61 45.48 0.59 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.204 -0.453 . . . . 53.15 110.881 -179.974 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 89' ' ' VAL . . . . . 0.716 HG11 ' HG ' ' A' ' 94' ' ' LEU . 42.2 t -135.28 140.12 45.55 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.17 -0.468 . . . . 74.14 111.134 179.914 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 90' ' ' MET . . . . . 0.457 ' O ' ' CB ' ' A' ' 91' ' ' ASP . 22.0 mtm -92.1 -62.0 1.5 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.167 -0.469 . . . . 41.12 110.839 179.968 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 91' ' ' ASP . . . . . 0.457 ' CB ' ' O ' ' A' ' 90' ' ' MET . 0.4 OUTLIER 163.0 -22.15 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.226 -0.443 . . . . 75.14 110.857 179.968 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -62.9 -47.18 84.42 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.199 -0.455 . . . . 74.23 110.887 -179.789 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 93' ' ' GLN . . . . . 0.516 ' CG ' HG13 ' A' ' 89' ' ' VAL . 3.8 pm0 -71.26 -36.41 71.75 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.132 -0.485 . . . . 65.13 110.896 -179.945 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 94' ' ' LEU . . . . . 0.716 ' HG ' HG11 ' A' ' 89' ' ' VAL . 31.7 mt -58.0 -48.96 78.47 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.191 -0.458 . . . . 74.22 110.887 -179.97 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 2.4 mm-40 -65.79 -33.57 76.16 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.204 -0.453 . . . . 74.05 110.871 179.972 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 96' ' ' MET . . . . . . . . . . . . . 6.1 ttp -59.61 -36.65 76.74 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.222 -0.444 . . . . 73.25 110.898 179.954 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 97' ' ' LEU . . . . . 0.997 HD13 HG22 ' A' ' 121' ' ' THR . 61.2 mt -66.5 -43.63 84.82 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.201 -0.454 . . . . 73.11 110.899 -179.99 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 98' ' ' LYS . . . . . 0.431 ' HA ' ' CD2' ' A' ' 101' ' ' PHE . 8.5 mmtp -55.44 -37.1 67.26 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.239 -0.437 . . . . 72.41 110.897 179.823 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 8.9 m -62.4 -43.61 98.41 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.198 -0.455 . . . . 75.11 110.872 -179.873 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 100' ' ' GLU . . . . . 0.559 ' O ' HD12 ' A' ' 104' ' ' ILE . 5.7 mm-40 -71.01 -24.95 62.47 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.11 -0.496 . . . . 63.12 110.863 -179.96 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 101' ' ' PHE . . . . . 0.593 ' CD1' ' O ' ' A' ' 97' ' ' LEU . 9.0 m-30 -59.62 -40.84 88.92 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.167 -0.469 . . . . 74.44 110.912 -179.909 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -63.11 -40.26 97.1 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.122 -0.49 . . . . 63.33 110.882 179.992 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 14.7 ttpt -67.94 -36.5 80.22 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.25 -0.432 . . . . 55.11 110.901 179.847 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 104' ' ' ILE . . . . . 0.559 HD12 ' O ' ' A' ' 100' ' ' GLU . 3.8 mt -67.35 -47.6 80.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.208 -0.451 . . . . 74.34 111.115 179.895 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 105' ' ' HIS . . . . . . . . . . . . . 14.8 t60 -62.92 -42.19 99.71 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.161 -0.472 . . . . 73.35 110.881 179.868 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -57.96 -38.28 75.71 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.206 -0.452 . . . . 72.13 110.94 -179.966 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 8.9 t -88.15 -23.25 23.69 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.161 -0.472 . . . . 70.42 111.166 -179.992 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 108' ' ' SER . . . . . 0.638 ' HB3' HG22 ' A' ' 113' ' ' ILE . 13.4 m -114.59 41.01 2.43 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.174 -0.466 . . . . 55.24 110.898 -179.897 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 13.7 ttt180 -88.8 90.73 8.54 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.124 -0.489 . . . . 72.32 110.856 -179.914 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 140.09 -6.16 2.8 Favored Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.754 -0.736 . . . . 74.23 112.495 -179.966 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 111' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -136.11 -152.59 0.46 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.757 0.313 . . . . 74.13 110.919 -179.944 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 112' ' ' GLU . . . . . 0.405 ' HG2' ' CD ' ' A' ' 18' ' ' GLU . 11.9 mt-10 -79.8 132.3 36.1 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.197 -0.456 . . . . 65.13 110.921 -179.956 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 113' ' ' ILE . . . . . 0.765 HD11 ' HG3' ' A' ' 79' ' ' PRO . 9.8 pt -126.27 -12.33 4.54 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 116.157 -0.474 . . . . 53.11 111.127 179.99 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 114' ' ' ILE . . . . . 0.778 ' O ' HG23 ' A' ' 118' ' ' THR . 1.3 mp -63.05 -39.66 86.06 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.195 -0.457 . . . . 74.14 111.14 179.85 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 115' ' ' PHE . . . . . 0.9 ' CE1' HD13 ' A' ' 25' ' ' ILE . 40.9 t80 -70.96 -38.72 72.81 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.179 -0.464 . . . . 75.31 110.848 179.976 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 54.9 mm-40 -65.41 -44.04 88.65 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.128 -0.487 . . . . 63.14 110.849 -179.867 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 117' ' ' ILE . . . . . 0.467 HD11 ' CG ' ' A' ' 101' ' ' PHE . 0.4 OUTLIER -65.14 -40.15 87.89 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.172 -0.467 . . . . 65.14 111.142 179.965 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 118' ' ' THR . . . . . 0.778 HG23 ' O ' ' A' ' 114' ' ' ILE . 58.7 p -67.62 -42.9 81.62 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.176 -0.465 . . . . 74.54 111.157 179.974 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 119' ' ' SER . . . . . 0.417 ' HA ' ' CG ' ' A' ' 122' ' ' GLN . 0.7 OUTLIER -67.44 -31.41 71.57 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.238 -0.437 . . . . 72.33 110.864 -179.891 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 120' ' ' PHE . . . . . 0.447 ' O ' ' HG2' ' A' ' 123' ' ' GLU . 0.3 OUTLIER -77.65 -38.74 47.12 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.128 -0.487 . . . . 64.51 110.888 -179.941 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 121' ' ' THR . . . . . 0.997 HG22 HD13 ' A' ' 97' ' ' LEU . 9.7 p -71.64 -42.21 67.86 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.154 -0.476 . . . . 72.15 111.173 -179.948 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 122' ' ' GLN . . . . . 0.417 ' CG ' ' HA ' ' A' ' 119' ' ' SER . 1.1 pp0? -66.21 -41.08 90.62 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.229 -0.441 . . . . 72.54 110.93 179.953 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 123' ' ' GLU . . . . . 0.447 ' HG2' ' O ' ' A' ' 120' ' ' PHE . 11.9 pt-20 -68.37 -35.33 77.55 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.214 -0.448 . . . . 74.12 110.895 -179.915 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 124' ' ' LYS . . . . . 0.44 ' HA ' ' CE ' ' A' ' 124' ' ' LYS . 0.0 OUTLIER -72.16 -44.35 63.2 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.141 -0.481 . . . . 61.44 110.908 179.958 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 125' ' ' LEU . . . . . 0.853 HD11 ' CA ' ' A' ' 54' ' ' SER . 0.2 OUTLIER -65.18 -40.41 94.24 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.248 -0.433 . . . . 62.34 110.886 179.918 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -63.63 -45.43 90.28 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.223 -0.444 . . . . 65.25 110.893 179.835 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 127' ' ' GLU . . . . . 0.442 ' HG3' ' N ' ' A' ' 128' ' ' PHE . 0.0 OUTLIER -66.17 -29.3 69.56 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.158 -0.474 . . . . 72.22 110.896 -179.905 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 128' ' ' PHE . . . . . 0.49 ' CE1' ' HB3' ' A' ' 93' ' ' GLN . 1.8 t80 . . . . . 0 C--N 1.329 -0.319 0 CA-C-N 116.131 -0.486 . . . . 75.25 110.889 -179.901 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 8' ' ' LEU . . . . . 0.411 HD13 ' O ' ' A' ' 72' ' ' PRO . 20.2 mt . . . . . 0 C--O 1.231 0.121 0 CA-C-O 120.781 0.324 . . . . 71.21 110.888 . . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -51.25 -25.58 5.88 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.215 -0.448 . . . . 74.3 110.881 179.847 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 10' ' ' GLN . . . . . 0.417 ' O ' ' HG2' ' A' ' 13' ' ' GLU . 10.3 mm-40 -67.77 -38.99 84.16 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.221 -0.445 . . . . 75.41 110.913 -179.941 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 23.9 m-85 -64.51 -22.2 66.9 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.205 -0.452 . . . . 74.04 110.889 -179.834 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -57.43 -36.25 71.13 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.143 -0.48 . . . . 72.53 110.871 -179.842 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 13' ' ' GLU . . . . . 0.481 ' HG3' ' N ' ' A' ' 14' ' ' ILE . 5.6 pt-20 -59.82 -39.91 86.67 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.112 -0.494 . . . . 63.42 110.888 -179.981 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 14' ' ' ILE . . . . . 0.481 ' N ' ' HG3' ' A' ' 13' ' ' GLU . 3.7 mp -67.62 -47.47 80.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.178 -0.465 . . . . 73.45 111.109 179.967 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 46.4 mt-30 -64.56 -44.53 90.44 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.211 -0.45 . . . . 73.53 110.888 179.988 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 6.3 t -63.61 -41.47 98.3 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.218 -0.446 . . . . 73.31 110.865 -179.93 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 1.2 m-20 -57.98 -34.7 70.24 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.214 -0.448 . . . . 62.15 110.918 -179.936 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -67.23 -38.6 85.51 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.188 -0.46 . . . . 60.5 110.898 179.973 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.903 HD11 ' CG1' ' A' ' 46' ' ' ILE . 6.1 mt -60.91 -51.52 68.93 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.148 -0.478 . . . . 54.43 110.936 -179.994 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 4.7 pt-20 -68.62 -37.9 80.11 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.198 -0.455 . . . . 73.21 110.905 179.917 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -63.83 -50.64 68.09 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.126 -0.488 . . . . 54.04 111.089 179.924 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 22' ' ' ILE . . . . . 0.423 ' HA ' HD12 ' A' ' 25' ' ' ILE . 0.8 OUTLIER -71.4 -36.58 61.61 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 116.226 -0.443 . . . . 74.11 111.137 179.983 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -52.48 -34.45 49.32 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.177 -0.465 . . . . 71.12 110.889 179.963 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -67.23 -36.25 81.27 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.174 -0.466 . . . . 71.15 110.85 -179.77 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 25' ' ' ILE . . . . . 0.644 HD13 ' CE1' ' A' ' 115' ' ' PHE . 3.3 mt -79.33 -45.23 23.88 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.153 -0.476 . . . . 64.22 111.138 179.915 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 29.0 m-85 -109.04 46.35 0.98 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.155 -0.475 . . . . 74.22 110.936 -179.977 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 1.2 mtm -42.67 -57.4 2.74 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.081 -0.509 . . . . 72.13 110.9 179.903 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 6.2 p-10 -106.08 32.98 4.04 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.229 -0.441 . . . . 62.54 110.874 179.937 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -135.01 13.15 3.61 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.187 -0.46 . . . . 70.14 110.891 179.976 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 30' ' ' PHE . . . . . 0.611 ' CD1' ' C ' ' A' ' 30' ' ' PHE . 0.2 OUTLIER -111.89 139.92 46.98 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.195 -0.457 . . . . 71.23 110.854 -179.899 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 20.2 m -110.85 128.11 55.66 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.097 -0.501 . . . . 72.41 111.143 -179.928 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -87.61 113.71 23.55 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.218 -0.446 . . . . 63.12 110.891 179.918 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 1.065 HD23 ' N ' ' A' ' 34' ' ' THR . 0.1 OUTLIER -121.73 -16.68 7.63 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.193 -0.458 . . . . 71.04 110.899 -179.946 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 34' ' ' THR . . . . . 1.065 ' N ' HD23 ' A' ' 33' ' ' LEU . 15.8 m . . . . . 0 C--N 1.329 -0.293 0 CA-C-N 116.204 -0.453 . . . . 73.23 111.146 179.933 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 45' ' ' GLN . . . . . 0.469 ' CG ' ' O ' ' A' ' 45' ' ' GLN . 15.2 tt0 . . . . . 0 C--O 1.232 0.15 0 CA-C-O 120.775 0.322 . . . . 62.31 110.912 . . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 46' ' ' ILE . . . . . 0.903 ' CG1' HD11 ' A' ' 19' ' ' LEU . 0.0 OUTLIER 81.86 -34.74 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.229 -0.441 . . . . 73.44 111.112 -179.995 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 47' ' ' ILE . . . . . 0.92 HG12 HD21 ' A' ' 33' ' ' LEU . 0.1 OUTLIER -32.97 141.02 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.209 -0.45 . . . . 72.51 111.12 179.878 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 48' ' ' PHE . . . . . 0.872 ' HA ' HD22 ' A' ' 33' ' ' LEU . 1.4 p90 -153.06 164.59 37.73 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.172 -0.467 . . . . 74.25 110.927 179.961 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 49' ' ' GLU . . . . . 0.801 ' CG ' HD13 ' A' ' 33' ' ' LEU . 12.5 mt-10 -108.86 152.31 25.08 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.183 -0.462 . . . . 71.52 110.893 -179.953 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 50' ' ' ILE . . . . . 0.479 HD13 ' HA ' ' A' ' 30' ' ' PHE . 3.8 mm -133.89 141.54 43.73 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.142 -0.481 . . . . 73.01 111.144 179.951 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 85.8 m -86.28 126.7 34.49 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.168 -0.469 . . . . 41.01 111.144 179.957 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 52' ' ' LEU . . . . . 0.729 HD12 HD12 ' A' ' 66' ' ' LEU . 16.2 mt -132.59 159.55 39.19 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.194 -0.457 . . . . 72.41 110.908 179.953 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -178.31 174.56 1.28 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.178 -0.465 . . . . 75.03 110.918 179.979 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 54' ' ' SER . . . . . 0.462 ' HA ' ' CD1' ' A' ' 125' ' ' LEU . 7.3 p -63.16 -177.61 0.19 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.241 -0.436 . . . . 61.14 110.844 -179.792 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 30.2 m -91.18 -22.36 6.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.095 -0.502 . . . . 74.12 111.12 179.943 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -122.74 -170.13 2.04 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.208 -0.451 . . . . 52.55 110.862 179.95 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 1.7 mmmp? -118.11 -16.56 9.76 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.185 -0.462 . . . . 64.31 110.888 -179.97 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 58' ' ' GLU . . . . . 0.562 ' HA ' ' C ' ' A' ' 59' ' ' PRO . 56.8 mt-10 -120.22 146.69 43.14 Favored Pre-proline 0 C--N 1.329 -0.298 0 CA-C-O 121.675 0.75 . . . . 74.31 110.894 179.97 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 59' ' ' PRO . . . . . 0.562 ' C ' ' HA ' ' A' ' 58' ' ' GLU . 54.0 Cg_endo -69.75 -9.56 11.05 Favored 'Cis proline' 0 C--N 1.342 0.188 0 C-N-CA 122.695 -1.794 . . . . 52.3 112.334 0.034 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 60' ' ' VAL . . . . . 0.433 ' HB ' ' CG ' ' A' ' 88' ' ' ASN . 22.1 m -141.98 176.16 4.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.247 -0.433 . . . . 75.11 111.122 179.96 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 61' ' ' GLU . . . . . 0.447 ' O ' ' C ' ' A' ' 62' ' ' SER . 13.4 tt0 -106.97 -16.73 14.37 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.199 -0.455 . . . . 74.43 110.879 -180.0 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 62' ' ' SER . . . . . 0.887 ' HB3' HD21 ' A' ' 125' ' ' LEU . 26.7 m 34.12 87.19 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.161 -0.472 . . . . 50.51 110.87 -179.776 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 7.9 t -112.29 127.56 56.02 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.136 -0.483 . . . . 73.42 110.842 -179.777 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 64' ' ' ILE . . . . . . . . . . . . . 22.5 mt -140.61 140.34 33.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.144 -0.48 . . . . 53.11 111.127 179.948 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 29.8 m -103.28 117.3 34.19 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.15 -0.477 . . . . 54.44 111.159 179.968 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 66' ' ' LEU . . . . . 0.828 HD11 HG21 ' A' ' 121' ' ' THR . 8.9 mt -98.05 115.17 27.68 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.216 -0.447 . . . . 60.04 110.95 179.942 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 67' ' ' HIS . . . . . 0.571 ' CE1' HD11 ' A' ' 33' ' ' LEU . 10.5 t60 -111.67 110.08 20.29 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.193 -0.458 . . . . 75.11 110.885 179.893 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 68' ' ' PHE . . . . . 0.549 ' HB3' HD11 ' A' ' 81' ' ' ILE . 0.0 OUTLIER -102.81 140.21 37.38 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.239 -0.437 . . . . 73.03 110.897 -179.893 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 69' ' ' ALA . . . . . 0.537 ' HA ' HG22 ' A' ' 47' ' ' ILE . . . -120.73 116.41 25.21 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.144 -0.48 . . . . 32.3 111.073 179.961 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 70' ' ' MET . . . . . 0.575 ' CE ' HD11 ' A' ' 114' ' ' ILE . 1.1 mtt -87.06 108.96 19.1 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.241 -0.436 . . . . 55.53 110.908 179.934 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -61.68 160.38 27.26 Favored Pre-proline 0 C--N 1.33 -0.277 0 CA-C-O 121.516 0.674 . . . . 74.13 111.174 -179.924 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 72' ' ' PRO . . . . . 0.411 ' O ' HD13 ' A' ' 8' ' ' LEU . 53.7 Cg_endo -69.83 -4.17 13.53 Favored 'Trans proline' 0 C--N 1.341 0.173 0 C-N-CA 122.636 2.224 . . . . 63.53 112.373 179.937 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 73' ' ' MET . . . . . 0.505 ' O ' ' CB ' ' A' ' 76' ' ' TYR . 0.0 OUTLIER -111.92 -24.58 9.88 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.183 -0.462 . . . . 74.42 110.868 179.909 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 74' ' ' TYR . . . . . 0.655 ' CD1' ' C ' ' A' ' 74' ' ' TYR . 0.0 OUTLIER -48.94 152.7 1.73 Allowed Pre-proline 0 C--N 1.329 -0.309 0 CA-C-O 121.666 0.746 . . . . 72.24 110.941 -179.861 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 75' ' ' PRO . . . . . 0.549 ' HA ' ' CD2' ' A' ' 74' ' ' TYR . 53.4 Cg_endo -69.75 -8.55 10.53 Favored 'Cis proline' 0 C--O 1.232 0.196 0 C-N-CA 122.714 -1.786 . . . . 65.54 112.319 -0.056 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 76' ' ' TYR . . . . . 0.505 ' CB ' ' O ' ' A' ' 73' ' ' MET . 31.1 t80 -33.0 -46.79 0.16 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.255 -0.43 . . . . 74.33 110.912 -179.902 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 13.8 p -106.83 -171.44 1.89 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.135 -0.484 . . . . 65.41 111.125 -179.961 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -104.8 130.41 23.22 Favored Pre-proline 0 C--N 1.329 -0.3 0 CA-C-O 121.577 0.703 . . . . 72.21 111.123 179.843 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 79' ' ' PRO . . . . . 0.531 ' HG3' HD11 ' A' ' 113' ' ' ILE . 53.3 Cg_endo -69.8 167.54 24.19 Favored 'Trans proline' 0 C--O 1.231 0.153 0 C-N-CA 122.648 2.232 . . . . 75.32 112.336 -179.975 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 1.7 tt0 -118.85 134.82 54.9 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.213 -0.449 . . . . 74.13 110.876 -179.962 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 81' ' ' ILE . . . . . 0.569 HG21 HD22 ' A' ' 66' ' ' LEU . 12.1 mt -142.8 150.83 17.8 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.152 -0.476 . . . . 63.4 111.129 179.973 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 82' ' ' GLU . . . . . 0.504 ' HG3' ' CD ' ' A' ' 84' ' ' LYS . 9.2 pt-20 -149.43 147.64 28.5 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.167 -0.47 . . . . 63.1 110.906 179.923 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 83' ' ' PHE . . . . . 0.512 ' CZ ' ' HD3' ' A' ' 98' ' ' LYS . 6.3 m-85 -89.03 140.58 29.29 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.161 -0.472 . . . . 72.33 110.861 -179.891 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 84' ' ' LYS . . . . . 0.51 ' O ' ' N ' ' A' ' 86' ' ' VAL . 8.7 mmmt -124.26 174.69 7.54 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.133 -0.485 . . . . 54.13 110.913 179.971 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 85' ' ' ASN . . . . . 0.413 ' C ' HG22 ' A' ' 86' ' ' VAL . 5.0 m120 59.66 -76.06 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.265 -0.425 . . . . 63.31 110.852 179.937 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 86' ' ' VAL . . . . . 0.9 HG11 HD21 ' A' ' 94' ' ' LEU . 3.6 m 41.28 87.52 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.162 -0.472 . . . . 54.45 111.146 179.914 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -94.61 -78.39 0.44 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.187 -0.46 . . . . 61.31 110.934 -179.989 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 88' ' ' ASN . . . . . 0.433 ' CG ' ' HB ' ' A' ' 60' ' ' VAL . 33.6 m120 -83.96 55.02 3.11 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.173 -0.467 . . . . 71.22 110.871 -179.954 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 89' ' ' VAL . . . . . 0.579 HG21 HD13 ' A' ' 94' ' ' LEU . 1.3 p -152.75 145.79 15.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.192 -0.458 . . . . 73.44 111.145 179.921 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 90' ' ' MET . . . . . 0.633 ' O ' HD22 ' A' ' 94' ' ' LEU . 0.5 OUTLIER -95.18 -155.65 0.48 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.176 -0.465 . . . . 65.33 110.88 179.904 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 91' ' ' ASP . . . . . 0.477 ' O ' ' CG ' ' A' ' 95' ' ' GLN . 0.1 OUTLIER -98.61 -17.76 18.46 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.227 -0.442 . . . . 75.21 110.883 179.955 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 78.8 p -66.64 -47.11 73.61 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.192 -0.458 . . . . 60.42 110.911 -179.783 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 93' ' ' GLN . . . . . 0.549 ' CG ' ' CD2' ' A' ' 128' ' ' PHE . 5.9 mt-30 -68.69 -42.97 77.07 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.114 -0.494 . . . . 74.12 110.918 -179.987 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 94' ' ' LEU . . . . . 0.9 HD21 HG11 ' A' ' 86' ' ' VAL . 0.1 OUTLIER -59.04 -49.11 79.14 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.156 -0.475 . . . . 64.53 110.91 -179.998 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 95' ' ' GLN . . . . . 0.477 ' CG ' ' O ' ' A' ' 91' ' ' ASP . 7.3 mm-40 -66.06 -35.25 80.03 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.149 -0.478 . . . . 74.14 110.941 179.911 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 96' ' ' MET . . . . . 0.512 ' SD ' ' CE1' ' A' ' 128' ' ' PHE . 29.5 ttp -60.3 -44.85 95.04 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.187 -0.461 . . . . 63.14 110.873 179.961 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 97' ' ' LEU . . . . . 0.635 HD22 HG22 ' A' ' 121' ' ' THR . 33.7 mt -58.13 -39.8 79.67 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.227 -0.442 . . . . 64.41 110.906 -179.968 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 98' ' ' LYS . . . . . 0.512 ' HD3' ' CZ ' ' A' ' 83' ' ' PHE . 5.6 mmtp -57.39 -43.78 83.94 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.186 -0.461 . . . . 73.3 110.881 179.82 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -61.3 -39.0 88.83 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.229 -0.442 . . . . 51.34 110.853 -179.879 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 100' ' ' GLU . . . . . 0.507 ' HG2' ' CE1' ' A' ' 120' ' ' PHE . 0.3 OUTLIER -69.86 -28.6 65.79 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.168 -0.469 . . . . 65.13 110.916 -179.97 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 101' ' ' PHE . . . . . 0.657 ' CG ' HD11 ' A' ' 117' ' ' ILE . 9.2 m-30 -59.42 -39.17 82.62 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.143 -0.481 . . . . 72.45 110.843 -179.906 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.81 -39.5 94.38 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.143 -0.48 . . . . 64.04 110.904 -179.999 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 37.7 mtmt -68.77 -40.98 79.45 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.209 -0.451 . . . . 61.34 110.891 179.865 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 4.3 mt -65.09 -47.57 87.26 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 116.278 -0.419 . . . . 72.41 111.166 179.842 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 105' ' ' HIS . . . . . 0.495 ' O ' ' N ' ' A' ' 109' ' ' ARG . 4.6 t60 -62.76 -41.35 99.18 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.191 -0.459 . . . . 63.54 110.853 179.873 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -59.17 -42.35 90.56 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.224 -0.444 . . . . 74.25 110.89 -179.944 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 10.7 t -82.67 -28.12 30.85 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.191 -0.459 . . . . 74.02 111.126 -179.955 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 108' ' ' SER . . . . . 0.762 ' HB3' HG22 ' A' ' 113' ' ' ILE . 23.5 m -101.74 13.38 35.05 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.195 -0.457 . . . . 63.21 110.904 -179.874 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 109' ' ' ARG . . . . . 0.495 ' N ' ' O ' ' A' ' 105' ' ' HIS . 2.6 ttt-85 -61.57 77.88 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.114 -0.494 . . . . 72.23 110.882 -179.949 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 110' ' ' GLY . . . . . 0.448 ' N ' ' O ' ' A' ' 108' ' ' SER . . . 137.12 31.76 0.25 Allowed Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.739 -0.744 . . . . 61.43 112.52 -179.98 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 111' ' ' GLN . . . . . . . . . . . . . 7.2 pt20 -173.2 -165.69 0.3 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.743 0.306 . . . . 52.34 110.958 -179.841 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 38.8 mt-10 -65.74 127.64 32.77 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.216 -0.447 . . . . 73.5 110.88 179.994 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 113' ' ' ILE . . . . . 0.762 HG22 ' HB3' ' A' ' 108' ' ' SER . 19.3 pt -126.5 -10.9 4.66 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.133 -0.485 . . . . 74.24 111.112 179.974 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 114' ' ' ILE . . . . . 0.744 ' O ' HG23 ' A' ' 118' ' ' THR . 13.6 mm -67.06 -44.9 87.92 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.221 -0.445 . . . . 75.2 111.079 179.887 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 115' ' ' PHE . . . . . 0.644 ' CE1' HD13 ' A' ' 25' ' ' ILE . 19.7 t80 -68.98 -34.5 75.41 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.19 -0.459 . . . . 60.53 110.894 179.962 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 4.9 mm-40 -67.47 -47.53 69.79 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.154 -0.475 . . . . 63.01 110.89 -179.909 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 117' ' ' ILE . . . . . 0.657 HD11 ' CG ' ' A' ' 101' ' ' PHE . 0.5 OUTLIER -64.31 -40.53 89.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.108 -0.496 . . . . 61.32 111.165 179.949 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 118' ' ' THR . . . . . 0.744 HG23 ' O ' ' A' ' 114' ' ' ILE . 58.3 p -67.03 -43.38 82.94 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.166 -0.47 . . . . 75.21 111.13 179.93 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -68.07 -39.24 83.01 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.24 -0.437 . . . . 72.44 110.876 -179.861 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 120' ' ' PHE . . . . . 0.507 ' CE1' ' HG2' ' A' ' 100' ' ' GLU . 0.4 OUTLIER -69.69 -45.21 68.81 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.12 -0.491 . . . . 73.0 110.92 -179.995 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 121' ' ' THR . . . . . 0.828 HG21 HD11 ' A' ' 66' ' ' LEU . 19.0 p -66.63 -42.17 87.18 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.142 -0.481 . . . . 55.32 111.144 -179.935 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -65.06 -51.28 62.36 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.266 -0.425 . . . . 74.24 110.943 179.98 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 123' ' ' GLU . . . . . 0.474 ' CG ' ' N ' ' A' ' 124' ' ' LYS . 7.3 pt-20 -62.13 -46.2 90.08 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.188 -0.46 . . . . 74.54 110.869 -179.953 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 124' ' ' LYS . . . . . 0.474 ' N ' ' CG ' ' A' ' 123' ' ' GLU . 1.1 mmpt? -63.91 -40.07 95.64 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.189 -0.46 . . . . 70.35 110.874 179.986 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 125' ' ' LEU . . . . . 0.887 HD21 ' HB3' ' A' ' 62' ' ' SER . 0.1 OUTLIER -70.09 -38.97 75.83 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.231 -0.44 . . . . 73.51 110.9 179.92 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 126' ' ' ASP . . . . . 0.722 ' N ' HD13 ' A' ' 125' ' ' LEU . 1.6 t0 -66.72 -46.49 75.35 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.158 -0.474 . . . . 74.12 110.856 179.872 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -67.88 -28.63 67.69 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.215 -0.448 . . . . 73.11 110.914 -179.93 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 128' ' ' PHE . . . . . 0.549 ' CD2' ' CG ' ' A' ' 93' ' ' GLN . 0.5 OUTLIER . . . . . 0 C--N 1.329 -0.291 0 CA-C-N 116.17 -0.468 . . . . 61.12 110.906 -179.934 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 44.1 mt . . . . . 0 C--O 1.231 0.092 0 CA-C-O 120.813 0.339 . . . . 75.04 110.904 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 17.2 t0 -54.19 -31.67 53.55 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.198 -0.455 . . . . 72.21 110.866 179.828 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 10' ' ' GLN . . . . . 0.41 ' O ' ' HG2' ' A' ' 13' ' ' GLU . 97.0 mm-40 -66.72 -40.53 88.44 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.218 -0.447 . . . . 60.13 110.918 -179.901 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 20.1 m-85 -56.09 -22.94 30.9 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.194 -0.457 . . . . 73.3 110.925 -179.859 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 12' ' ' TYR . . . . . 0.585 ' CZ ' HD11 ' A' ' 46' ' ' ILE . 0.3 OUTLIER -57.69 -36.34 71.82 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.145 -0.48 . . . . 75.01 110.869 -179.885 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 13' ' ' GLU . . . . . 0.483 ' HG3' ' N ' ' A' ' 14' ' ' ILE . 5.0 pt-20 -61.63 -41.11 97.04 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.173 -0.467 . . . . 64.03 110.874 -179.997 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 14' ' ' ILE . . . . . 0.483 ' N ' ' HG3' ' A' ' 13' ' ' GLU . 3.8 mp -68.28 -44.33 83.94 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-N 116.153 -0.476 . . . . 60.13 111.125 -179.99 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 15' ' ' GLN . . . . . 0.819 ' HB3' HG21 ' A' ' 46' ' ' ILE . 10.2 mt-30 -65.99 -47.22 75.27 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.15 -0.477 . . . . 73.23 110.91 179.944 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 2.5 t -61.4 -40.69 95.29 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.177 -0.465 . . . . 72.2 110.871 -179.946 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -58.21 -33.72 69.6 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.208 -0.451 . . . . 75.54 110.887 -179.866 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 18' ' ' GLU . . . . . 0.401 ' OE1' ' SD ' ' A' ' 70' ' ' MET . 32.6 mt-10 -65.81 -39.08 90.54 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.197 -0.456 . . . . 74.5 110.876 -179.997 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.433 HD12 ' CE1' ' A' ' 48' ' ' PHE . 6.8 mp -63.18 -51.8 64.93 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.144 -0.48 . . . . 73.12 110.903 -179.943 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 1.7 pt-20 -68.8 -37.22 79.12 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.203 -0.453 . . . . 73.12 110.895 179.941 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -64.27 -50.51 67.63 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.148 -0.478 . . . . 65.51 111.066 179.97 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 22' ' ' ILE . . . . . 0.833 ' HA ' HD12 ' A' ' 25' ' ' ILE . 0.9 OUTLIER -71.85 -35.31 54.35 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.272 -0.422 . . . . 73.34 111.117 179.971 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 23' ' ' ARG . . . . . 0.458 ' HG3' ' CD2' ' A' ' 30' ' ' PHE . 7.6 mtp180 -54.36 -37.99 65.59 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.174 -0.466 . . . . 64.44 110.887 179.936 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -65.38 -31.41 72.5 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.18 -0.464 . . . . 42.53 110.859 -179.786 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 25' ' ' ILE . . . . . 0.833 HD12 ' HA ' ' A' ' 22' ' ' ILE . 5.1 mt -80.35 -45.43 22.1 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.135 -0.484 . . . . 73.12 111.099 179.972 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 26' ' ' TYR . . . . . 0.422 ' O ' ' N ' ' A' ' 30' ' ' PHE . 25.1 m-85 -107.97 41.28 1.57 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.175 -0.466 . . . . 70.11 110.909 -179.94 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 27' ' ' MET . . . . . 0.406 ' C ' ' O ' ' A' ' 26' ' ' TYR . 1.9 mtm -38.08 -52.94 1.42 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.137 -0.483 . . . . 74.42 110.869 179.907 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -88.83 -33.2 17.47 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.206 -0.452 . . . . 71.11 110.848 179.979 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -84.5 21.67 1.43 Allowed 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.237 -0.438 . . . . 62.5 110.875 179.997 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 30' ' ' PHE . . . . . 0.532 ' HA ' HD13 ' A' ' 50' ' ' ILE . 0.4 OUTLIER -111.0 128.67 55.92 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.189 -0.46 . . . . 53.12 110.89 -179.889 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 83.2 m -114.2 133.88 55.3 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.157 -0.474 . . . . 65.01 111.143 -179.923 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 41.8 t0 -98.11 120.5 38.62 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.213 -0.449 . . . . 71.51 110.891 179.918 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.941 HD21 HG12 ' A' ' 47' ' ' ILE . 0.2 OUTLIER -121.58 0.73 9.97 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.204 -0.453 . . . . 63.31 110.89 -179.904 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 34' ' ' THR . . . . . 0.787 ' N ' HD23 ' A' ' 33' ' ' LEU . 0.2 OUTLIER . . . . . 0 C--N 1.33 -0.274 0 CA-C-N 116.186 -0.461 . . . . 75.02 111.184 179.999 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 45' ' ' GLN . . . . . 0.99 ' HG2' HD12 ' A' ' 47' ' ' ILE . 7.4 pt20 . . . . . 0 C--O 1.231 0.127 0 CA-C-O 120.787 0.327 . . . . 75.01 110.913 . . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 46' ' ' ILE . . . . . 0.819 HG21 ' HB3' ' A' ' 15' ' ' GLN . 15.4 mm 69.9 75.48 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.177 -0.465 . . . . 63.32 111.153 179.961 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 47' ' ' ILE . . . . . 0.99 HD12 ' HG2' ' A' ' 45' ' ' GLN . 0.2 OUTLIER -142.52 148.33 20.13 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.171 -0.468 . . . . 73.05 111.135 179.875 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 48' ' ' PHE . . . . . 0.841 ' HA ' HD22 ' A' ' 33' ' ' LEU . 22.3 p90 -162.14 155.4 20.58 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.146 -0.479 . . . . 63.35 110.903 179.919 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 49' ' ' GLU . . . . . 0.601 ' HG3' HD13 ' A' ' 33' ' ' LEU . 13.4 mt-10 -108.44 151.88 25.44 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.199 -0.455 . . . . 74.32 110.87 -179.901 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 50' ' ' ILE . . . . . 0.532 HD13 ' HA ' ' A' ' 30' ' ' PHE . 29.9 mm -130.38 135.71 60.06 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.132 -0.486 . . . . 73.01 111.155 179.958 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 84.8 m -87.19 116.97 25.63 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.208 -0.451 . . . . 60.21 111.163 179.954 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 18.3 mt -117.0 164.91 13.99 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.241 -0.436 . . . . 71.42 110.94 179.959 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -175.76 175.84 1.96 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.203 -0.453 . . . . 75.01 110.865 179.943 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 76.6 p -66.69 -154.3 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.156 -0.474 . . . . 73.34 110.843 -179.789 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 17.3 m -119.21 -19.64 5.42 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.135 -0.484 . . . . 63.21 111.123 179.976 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -114.23 178.66 4.2 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.186 -0.461 . . . . 73.43 110.866 179.911 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 57' ' ' LYS . . . . . 0.462 ' N ' ' HD3' ' A' ' 57' ' ' LYS . 0.0 OUTLIER -118.24 -5.63 10.88 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.168 -0.469 . . . . 73.31 110.917 179.974 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 58' ' ' GLU . . . . . 0.553 ' HA ' ' C ' ' A' ' 59' ' ' PRO . 2.9 pt-20 -135.57 145.65 54.24 Favored Pre-proline 0 C--N 1.329 -0.287 0 CA-C-O 121.654 0.74 . . . . 75.44 110.91 179.939 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 59' ' ' PRO . . . . . 0.553 ' C ' ' HA ' ' A' ' 58' ' ' GLU . 53.6 Cg_endo -69.78 -6.92 9.73 Favored 'Cis proline' 0 C--N 1.342 0.185 0 C-N-CA 122.654 -1.811 . . . . 33.43 112.332 0.011 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 60' ' ' VAL . . . . . 0.457 ' O ' ' C ' ' A' ' 57' ' ' LYS . 32.3 m -140.89 -174.25 0.75 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.205 -0.452 . . . . 61.22 111.115 179.954 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 61' ' ' GLU . . . . . 0.46 ' O ' ' C ' ' A' ' 62' ' ' SER . 7.2 tt0 -119.28 -12.2 9.45 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.182 -0.463 . . . . 73.22 110.879 -179.965 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 62' ' ' SER . . . . . 0.827 ' CB ' HD11 ' A' ' 125' ' ' LEU . 0.2 OUTLIER 33.8 89.21 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.158 -0.474 . . . . 41.21 110.888 -179.79 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 5.0 p -119.06 123.63 44.94 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.158 -0.474 . . . . 74.0 110.839 -179.802 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 64' ' ' ILE . . . . . 0.794 HD11 HG21 ' A' ' 89' ' ' VAL . 33.6 mt -135.69 134.96 51.46 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.126 -0.488 . . . . 75.22 111.131 179.921 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 36.6 m -98.81 113.98 26.34 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.157 -0.474 . . . . 53.44 111.133 179.969 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 66' ' ' LEU . . . . . 0.681 HD21 HG21 ' A' ' 121' ' ' THR . 0.4 OUTLIER -94.74 111.37 23.15 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.236 -0.438 . . . . 61.33 110.899 179.984 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 5.1 t60 -103.38 112.02 24.72 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.217 -0.447 . . . . 72.13 110.873 179.843 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 68' ' ' PHE . . . . . 0.543 ' CE1' HG23 ' A' ' 114' ' ' ILE . 0.0 OUTLIER -103.76 139.91 38.35 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.227 -0.442 . . . . 74.21 110.861 -179.897 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 69' ' ' ALA . . . . . 0.777 ' HA ' HG22 ' A' ' 47' ' ' ILE . . . -123.66 116.22 22.73 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.171 -0.468 . . . . 75.54 111.058 179.94 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 70' ' ' MET . . . . . 0.449 ' HE1' ' CG1' ' A' ' 114' ' ' ILE . 0.0 OUTLIER -79.39 160.58 26.62 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.222 -0.445 . . . . 71.1 110.852 179.974 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -116.92 161.13 34.01 Favored Pre-proline 0 C--N 1.329 -0.295 0 CA-C-O 121.551 0.691 . . . . 60.32 111.145 -179.904 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.77 3.07 2.99 Favored 'Trans proline' 0 C--N 1.341 0.152 0 C-N-CA 122.702 2.268 . . . . 64.31 112.335 179.942 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 73' ' ' MET . . . . . 0.495 ' O ' ' CB ' ' A' ' 76' ' ' TYR . 0.5 OUTLIER -122.19 -24.98 4.97 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.201 -0.454 . . . . 73.1 110.901 179.889 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 74' ' ' TYR . . . . . 0.647 ' CD1' ' C ' ' A' ' 74' ' ' TYR . 0.0 OUTLIER -46.74 149.92 1.38 Allowed Pre-proline 0 C--N 1.329 -0.323 0 CA-C-O 121.698 0.761 . . . . 73.14 110.929 -179.875 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 75' ' ' PRO . . . . . 0.551 ' C ' ' HA ' ' A' ' 74' ' ' TYR . 53.5 Cg_endo -69.8 -10.31 11.51 Favored 'Cis proline' 0 C--O 1.232 0.198 0 C-N-CA 122.713 -1.786 . . . . 41.53 112.307 0.007 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 76' ' ' TYR . . . . . 0.495 ' CB ' ' O ' ' A' ' 73' ' ' MET . 24.3 t80 -34.08 -45.84 0.22 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.264 -0.426 . . . . 71.42 110.914 -179.91 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 77' ' ' THR . . . . . 0.464 HG23 ' HB2' ' A' ' 73' ' ' MET . 28.3 p -108.65 175.39 5.48 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.129 -0.487 . . . . 73.32 111.162 -179.969 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -100.55 127.69 32.07 Favored Pre-proline 0 C--N 1.329 -0.312 0 CA-C-O 121.541 0.686 . . . . 63.45 111.131 179.875 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 79' ' ' PRO . . . . . 0.762 ' HG3' HD11 ' A' ' 113' ' ' ILE . 53.8 Cg_endo -69.85 -168.82 0.3 Allowed 'Trans proline' 0 C--N 1.341 0.158 0 C-N-CA 122.656 2.237 . . . . 62.33 112.304 -179.947 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 80' ' ' GLU . . . . . 0.475 ' HG3' ' N ' ' A' ' 81' ' ' ILE . 0.3 OUTLIER -129.24 140.92 51.28 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.19 -0.459 . . . . 75.43 110.91 -179.976 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 81' ' ' ILE . . . . . 0.475 ' N ' ' HG3' ' A' ' 80' ' ' GLU . 3.1 mm -129.03 148.34 33.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.131 -0.486 . . . . 71.14 111.117 179.985 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 82' ' ' GLU . . . . . 0.507 ' HG3' ' CD ' ' A' ' 84' ' ' LYS . 4.1 pt-20 -147.83 142.85 27.0 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.195 -0.457 . . . . 62.04 110.908 179.966 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 83' ' ' PHE . . . . . 0.576 ' CD1' HD11 ' A' ' 66' ' ' LEU . 8.9 m-85 -99.39 138.64 36.19 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.171 -0.468 . . . . 64.44 110.899 -179.937 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 84' ' ' LYS . . . . . 0.507 ' CD ' ' HG3' ' A' ' 82' ' ' GLU . 7.7 mmmt -125.95 170.48 11.64 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.198 -0.455 . . . . 72.3 110.893 179.925 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 85' ' ' ASN . . . . . 0.432 ' O ' ' C ' ' A' ' 86' ' ' VAL . 2.5 m120 63.86 -72.97 0.05 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.232 -0.44 . . . . 63.02 110.889 179.97 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 86' ' ' VAL . . . . . 0.614 ' CG1' HD21 ' A' ' 94' ' ' LEU . 4.7 m 35.62 89.96 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.18 -0.464 . . . . 75.52 111.098 179.906 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -95.09 -68.14 0.82 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.173 -0.467 . . . . 61.15 110.862 -179.991 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 88' ' ' ASN . . . . . 0.438 ' ND2' HG11 ' A' ' 60' ' ' VAL . 19.9 t-20 -82.16 40.92 0.65 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.23 -0.441 . . . . 72.42 110.868 -179.943 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 89' ' ' VAL . . . . . 0.794 HG21 HD11 ' A' ' 64' ' ' ILE . 6.6 t -132.95 149.19 31.54 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.223 -0.444 . . . . 73.03 111.142 179.902 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 90' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -101.86 -69.52 0.78 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.175 -0.466 . . . . 74.23 110.843 179.936 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 2.7 p30 -177.31 -43.44 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.208 -0.451 . . . . 72.34 110.848 -179.975 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -54.22 -38.93 66.23 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.173 -0.467 . . . . 73.0 110.886 -179.794 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 93' ' ' GLN . . . . . 0.54 ' OE1' ' CG ' ' A' ' 128' ' ' PHE . 4.0 tt0 -65.94 -45.18 82.75 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.083 -0.508 . . . . 73.32 110.932 -179.954 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 94' ' ' LEU . . . . . 0.614 HD21 ' CG1' ' A' ' 86' ' ' VAL . 80.9 mt -60.51 -48.58 81.14 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.194 -0.457 . . . . 72.24 110.922 -179.994 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 2.7 mm-40 -63.66 -33.83 76.5 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.215 -0.448 . . . . 63.42 110.933 179.904 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 96' ' ' MET . . . . . 0.42 ' HE3' ' HG2' ' A' ' 124' ' ' LYS . 11.9 ttp -59.71 -39.49 84.8 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.191 -0.459 . . . . 54.42 110.901 179.946 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 97' ' ' LEU . . . . . 0.871 HD22 HG22 ' A' ' 121' ' ' THR . 29.1 mt -66.35 -39.13 88.98 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.193 -0.458 . . . . 63.32 110.934 -179.987 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 98' ' ' LYS . . . . . 0.434 ' HD3' ' CZ ' ' A' ' 83' ' ' PHE . 3.0 mmtp -61.62 -34.38 75.57 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.188 -0.46 . . . . 74.3 110.893 179.796 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 3.1 m -70.34 -45.88 65.28 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.233 -0.439 . . . . 62.24 110.872 -179.894 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 100' ' ' GLU . . . . . 0.719 ' O ' HD12 ' A' ' 104' ' ' ILE . 11.2 pt-20 -72.56 -23.79 61.03 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.159 -0.473 . . . . 62.52 110.906 -179.957 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 101' ' ' PHE . . . . . 0.616 ' CD1' ' O ' ' A' ' 97' ' ' LEU . 8.3 m-30 -59.87 -38.02 80.98 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.124 -0.489 . . . . 72.03 110.856 -179.918 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -62.33 -40.11 95.29 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.16 -0.473 . . . . 73.31 110.868 179.998 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 103' ' ' LYS . . . . . 0.415 ' O ' HG22 ' A' ' 107' ' ' THR . 4.1 tmmt? -67.57 -39.81 84.89 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.31 -0.405 . . . . 54.14 110.873 179.877 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 104' ' ' ILE . . . . . 0.719 HD12 ' O ' ' A' ' 100' ' ' GLU . 1.8 mt -62.9 -47.15 94.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.217 -0.447 . . . . 44.42 111.16 179.861 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 105' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -62.84 -43.07 99.78 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.126 -0.488 . . . . 74.1 110.868 179.862 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -59.98 -31.04 69.53 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.198 -0.455 . . . . 64.41 110.907 -179.944 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 107' ' ' THR . . . . . 0.415 HG22 ' O ' ' A' ' 103' ' ' LYS . 10.7 t -97.77 -9.66 26.18 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.15 -0.477 . . . . 73.42 111.152 -179.957 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 37.5 m -124.58 36.96 4.51 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.193 -0.458 . . . . 54.35 110.843 -179.827 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -97.18 93.83 6.77 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.155 -0.475 . . . . 75.14 110.878 -179.941 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 151.67 -13.88 0.79 Allowed Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.713 -0.756 . . . . 74.34 112.503 -179.954 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 111' ' ' GLN . . . . . . . . . . . . . 1.3 pt20 -132.09 -95.5 0.34 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.769 0.319 . . . . 75.23 110.884 -179.855 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 26.6 mt-10 -137.47 141.58 41.55 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.181 -0.463 . . . . 52.43 110.918 -179.942 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 113' ' ' ILE . . . . . 0.762 HD11 ' HG3' ' A' ' 79' ' ' PRO . 19.1 pt -124.17 -7.77 7.01 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.134 -0.484 . . . . 73.22 111.086 -179.977 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 114' ' ' ILE . . . . . 0.659 ' O ' HG23 ' A' ' 118' ' ' THR . 38.6 mm -67.07 -42.17 88.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.178 -0.464 . . . . 74.43 111.151 179.881 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 115' ' ' PHE . . . . . 0.811 ' HE1' HG21 ' A' ' 25' ' ' ILE . 29.2 t80 -72.53 -40.96 66.35 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.149 -0.478 . . . . 54.11 110.871 179.938 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 19.5 mm-40 -63.91 -42.57 97.37 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.16 -0.473 . . . . 64.42 110.923 -179.938 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 117' ' ' ILE . . . . . 0.596 HD11 ' CD2' ' A' ' 101' ' ' PHE . 0.4 OUTLIER -67.22 -41.97 87.37 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.116 -0.493 . . . . 73.33 111.179 179.952 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 118' ' ' THR . . . . . 0.659 HG23 ' O ' ' A' ' 114' ' ' ILE . 69.0 p -68.33 -43.12 78.26 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.158 -0.474 . . . . 61.54 111.141 179.903 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -64.51 -43.96 92.43 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.24 -0.436 . . . . 62.42 110.855 -179.809 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 120' ' ' PHE . . . . . 0.572 ' CD2' HD11 ' A' ' 104' ' ' ILE . 0.1 OUTLIER -63.1 -45.44 92.04 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.097 -0.501 . . . . 65.12 110.925 -179.986 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 121' ' ' THR . . . . . 0.871 HG22 HD22 ' A' ' 97' ' ' LEU . 25.0 p -69.17 -38.83 78.91 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.15 -0.477 . . . . 74.4 111.158 -179.982 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -64.21 -38.81 92.37 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.229 -0.441 . . . . 73.12 110.901 -179.999 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 123' ' ' GLU . . . . . 0.48 ' HG3' ' N ' ' A' ' 124' ' ' LYS . 6.4 pt-20 -77.65 -39.0 46.56 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.232 -0.44 . . . . 62.01 110.881 -179.925 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 124' ' ' LYS . . . . . 0.48 ' N ' ' HG3' ' A' ' 123' ' ' GLU . 0.1 OUTLIER -70.33 -39.64 74.63 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.214 -0.448 . . . . 73.34 110.865 179.982 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 125' ' ' LEU . . . . . 0.827 HD11 ' CB ' ' A' ' 62' ' ' SER . 1.3 tp -61.74 -50.43 72.45 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.253 -0.43 . . . . 65.41 110.928 179.929 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 3.1 t0 -57.84 -39.19 77.11 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.175 -0.466 . . . . 75.31 110.893 179.8 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 127' ' ' GLU . . . . . 0.463 ' HG3' ' N ' ' A' ' 128' ' ' PHE . 0.0 OUTLIER -63.96 -28.8 70.06 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.156 -0.474 . . . . 64.51 110.884 -179.879 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 128' ' ' PHE . . . . . 0.54 ' CG ' ' OE1' ' A' ' 93' ' ' GLN . 0.3 OUTLIER . . . . . 0 C--N 1.329 -0.316 0 CA-C-N 116.155 -0.475 . . . . 72.33 110.905 -179.949 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 8' ' ' LEU . . . . . 0.675 HD21 ' HE3' ' A' ' 73' ' ' MET . 63.3 mt . . . . . 0 C--O 1.231 0.11 0 CA-C-O 120.806 0.336 . . . . 73.11 110.88 . . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 1.2 t70 -50.5 -33.93 23.26 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.208 -0.451 . . . . 62.33 110.874 179.84 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 59.0 mm-40 -67.65 -36.8 81.42 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.195 -0.457 . . . . 71.43 110.904 -179.934 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 16.8 m-85 -62.82 -27.67 69.48 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.206 -0.452 . . . . 65.31 110.916 -179.841 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 1.5 t80 -60.07 -37.77 80.88 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.111 -0.495 . . . . 74.32 110.955 -179.924 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 2.1 mm-40 -61.47 -45.65 93.35 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.107 -0.497 . . . . 65.33 110.872 180.0 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 3.7 mp -65.76 -40.73 88.58 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.196 -0.456 . . . . 73.23 111.145 179.974 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 15' ' ' GLN . . . . . 0.553 ' HB3' HG21 ' A' ' 46' ' ' ILE . 80.5 mt-30 -59.2 -47.03 86.83 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.197 -0.456 . . . . 61.54 110.902 179.954 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 4.6 t -63.86 -42.34 97.58 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.21 -0.45 . . . . 62.52 110.844 -179.924 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -57.8 -33.51 68.66 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.199 -0.455 . . . . 71.45 110.842 -179.844 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 18' ' ' GLU . . . . . 0.487 ' OE1' ' CD1' ' A' ' 114' ' ' ILE . 1.4 mm-40 -67.25 -38.72 85.61 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.193 -0.458 . . . . 65.02 110.908 -179.996 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.456 ' CD2' HG13 ' A' ' 46' ' ' ILE . 8.6 mp -62.63 -51.53 66.9 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.142 -0.481 . . . . 73.25 110.916 179.993 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 1.8 pt-20 -68.72 -31.77 71.08 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.165 -0.47 . . . . 51.34 110.889 179.964 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -63.93 -48.39 76.75 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.177 -0.465 . . . . 75.32 111.082 179.928 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 22' ' ' ILE . . . . . 0.403 HG23 ' CD2' ' A' ' 26' ' ' TYR . 0.7 OUTLIER -76.93 -37.1 26.53 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.234 -0.439 . . . . 72.3 111.122 179.981 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 2.7 mtt180 -52.55 -34.22 49.14 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.198 -0.456 . . . . 72.24 110.844 -179.985 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -66.18 -37.81 86.5 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.194 -0.457 . . . . 71.31 110.874 -179.809 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 25' ' ' ILE . . . . . 0.742 HG21 ' HE1' ' A' ' 115' ' ' PHE . 3.2 mt -78.81 -45.16 25.11 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.127 -0.488 . . . . 72.22 111.171 179.922 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 26' ' ' TYR . . . . . 0.403 ' CD2' HG23 ' A' ' 22' ' ' ILE . 17.5 m-85 -106.94 45.11 1.0 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.168 -0.469 . . . . 62.33 110.916 179.998 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 1.5 mtm -45.15 -61.25 1.72 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.11 -0.496 . . . . 55.12 110.902 179.871 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 15.6 m-20 -75.5 -28.55 59.22 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.2 -0.454 . . . . 73.03 110.892 179.95 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -94.2 37.84 1.1 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.153 -0.476 . . . . 53.25 110.871 -179.99 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 30' ' ' PHE . . . . . 0.571 ' HA ' HD13 ' A' ' 50' ' ' ILE . 9.3 t80 -117.71 129.06 55.48 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.191 -0.459 . . . . 74.22 110.889 -179.908 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 82.7 m -118.13 131.13 56.44 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.167 -0.47 . . . . 72.43 111.174 -179.962 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 9.4 t0 -105.12 114.46 28.67 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.244 -0.434 . . . . 71.22 110.833 179.959 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 1.139 HD21 ' CE1' ' A' ' 67' ' ' HIS . 0.2 OUTLIER -111.05 -6.3 14.66 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.208 -0.451 . . . . 65.02 110.913 -179.965 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 34' ' ' THR . . . . . 0.683 ' N ' HD12 ' A' ' 33' ' ' LEU . 0.2 OUTLIER . . . . . 0 C--N 1.329 -0.295 0 CA-C-N 116.198 -0.456 . . . . 72.45 111.148 179.968 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 45' ' ' GLN . . . . . 0.958 ' HG2' HG23 ' A' ' 47' ' ' ILE . 0.1 OUTLIER . . . . . 0 C--O 1.232 0.175 0 CA-C-O 120.765 0.317 . . . . 62.01 110.895 . . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 46' ' ' ILE . . . . . 0.674 HG22 ' O ' ' A' ' 45' ' ' GLN . 0.1 OUTLIER 86.82 -16.67 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.222 -0.444 . . . . 50.35 111.126 179.974 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 47' ' ' ILE . . . . . 0.958 HG23 ' HG2' ' A' ' 45' ' ' GLN . 0.1 OUTLIER -45.62 149.63 0.31 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-N 116.16 -0.473 . . . . 74.43 111.105 179.872 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 48' ' ' PHE . . . . . 0.465 ' HA ' ' CD1' ' A' ' 33' ' ' LEU . 27.8 p90 -158.46 171.09 20.79 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.122 -0.49 . . . . 75.23 110.885 179.936 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 49' ' ' GLU . . . . . 0.764 ' OE2' HD23 ' A' ' 33' ' ' LEU . 5.8 mt-10 -119.35 161.16 20.94 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.168 -0.469 . . . . 74.23 110.884 -179.924 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 50' ' ' ILE . . . . . 0.571 HD13 ' HA ' ' A' ' 30' ' ' PHE . 8.2 mm -142.96 137.43 26.86 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.147 -0.478 . . . . 62.42 111.087 179.994 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 85.5 m -83.9 131.58 34.85 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.17 -0.468 . . . . 60.13 111.105 179.971 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 52' ' ' LEU . . . . . 0.881 HD12 HD12 ' A' ' 66' ' ' LEU . 17.4 mt -134.79 159.5 41.15 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.187 -0.461 . . . . 72.03 110.873 179.989 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 53' ' ' ARG . . . . . 0.428 ' HD2' ' C ' ' A' ' 52' ' ' LEU . 0.0 OUTLIER 178.82 166.21 0.89 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.156 -0.474 . . . . 75.24 110.885 179.977 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -57.38 167.3 1.0 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.153 -0.476 . . . . 75.43 110.841 -179.789 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 19.2 m -78.91 -21.52 12.81 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.111 -0.495 . . . . 73.05 111.096 179.965 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 2.4 t70 -118.54 -172.05 2.2 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.201 -0.454 . . . . 73.44 110.837 179.97 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 3.3 mmmm -119.04 -17.51 8.98 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.218 -0.446 . . . . 73.34 110.919 179.962 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 58' ' ' GLU . . . . . 0.551 ' HA ' ' C ' ' A' ' 59' ' ' PRO . 4.7 pt-20 -120.08 145.77 40.74 Favored Pre-proline 0 C--N 1.33 -0.28 0 CA-C-O 121.664 0.745 . . . . 63.43 110.868 179.944 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 59' ' ' PRO . . . . . 0.551 ' C ' ' HA ' ' A' ' 58' ' ' GLU . 52.9 Cg_endo -69.81 -14.67 12.59 Favored 'Cis proline' 0 C--N 1.342 0.217 0 C-N-CA 122.697 -1.793 . . . . 74.33 112.303 0.073 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 60' ' ' VAL . . . . . 0.439 ' HB ' ' CG ' ' A' ' 88' ' ' ASN . 13.3 m -142.37 166.86 15.68 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.261 -0.427 . . . . 73.33 111.154 179.925 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 26.0 tt0 -102.88 -22.05 13.91 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.191 -0.459 . . . . 71.52 110.88 -179.952 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 62' ' ' SER . . . . . 0.545 ' HB3' HD11 ' A' ' 125' ' ' LEU . 2.5 m 40.77 92.31 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.205 -0.452 . . . . 73.35 110.821 -179.783 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 1.1 p -108.95 123.07 48.53 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.12 -0.491 . . . . 63.25 110.886 -179.863 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 64' ' ' ILE . . . . . 0.488 HD11 HG21 ' A' ' 89' ' ' VAL . 41.6 mt -136.98 137.4 46.94 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.115 -0.493 . . . . 70.01 111.155 179.958 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 16.3 m -101.24 115.69 31.09 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.206 -0.452 . . . . 74.23 111.17 179.951 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 66' ' ' LEU . . . . . 0.924 HD21 ' CE1' ' A' ' 83' ' ' PHE . 14.8 mt -95.93 109.24 21.64 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.202 -0.454 . . . . 63.15 110.909 179.989 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 67' ' ' HIS . . . . . 1.139 ' CE1' HD21 ' A' ' 33' ' ' LEU . 3.6 t60 -101.76 110.46 22.45 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.208 -0.451 . . . . 64.54 110.813 179.894 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 68' ' ' PHE . . . . . 0.469 ' HA ' ' CG1' ' A' ' 81' ' ' ILE . 0.0 OUTLIER -101.74 138.91 38.09 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.17 -0.468 . . . . 74.32 110.87 -179.938 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 69' ' ' ALA . . . . . 0.627 ' HA ' HG22 ' A' ' 47' ' ' ILE . . . -118.68 123.56 45.22 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.157 -0.474 . . . . 61.11 111.119 179.903 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 70' ' ' MET . . . . . 0.669 ' CE ' HD11 ' A' ' 114' ' ' ILE . 7.8 mmt -90.72 89.88 7.7 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.241 -0.436 . . . . 74.31 110.864 179.99 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -47.06 159.55 0.38 Allowed Pre-proline 0 C--N 1.33 -0.274 0 CA-C-O 121.589 0.709 . . . . 71.23 111.122 -179.957 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 72' ' ' PRO . . . . . 0.421 ' O ' HD22 ' A' ' 8' ' ' LEU . 53.7 Cg_endo -69.76 2.15 3.79 Favored 'Trans proline' 0 C--N 1.342 0.201 0 C-N-CA 122.66 2.24 . . . . 75.31 112.348 179.926 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 73' ' ' MET . . . . . 0.675 ' HE3' HD21 ' A' ' 8' ' ' LEU . 0.0 OUTLIER -116.86 -25.82 7.14 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.245 -0.434 . . . . 74.23 110.873 179.886 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 74' ' ' TYR . . . . . 0.662 ' CD1' ' C ' ' A' ' 74' ' ' TYR . 0.0 OUTLIER -52.24 153.75 4.73 Favored Pre-proline 0 C--N 1.328 -0.364 0 CA-C-O 121.693 0.759 . . . . 72.13 110.898 -179.846 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 75' ' ' PRO . . . . . 0.534 ' C ' ' HA ' ' A' ' 74' ' ' TYR . 53.6 Cg_endo -69.74 -11.11 11.77 Favored 'Cis proline' 0 C--N 1.341 0.182 0 C-N-CA 122.682 -1.799 . . . . 72.42 112.359 -0.114 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 76' ' ' TYR . . . . . 0.5 ' CB ' ' O ' ' A' ' 73' ' ' MET . 10.2 t80 -33.91 -57.01 0.47 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.241 -0.436 . . . . 72.15 110.947 -179.947 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 77' ' ' THR . . . . . 0.669 HG23 ' HB3' ' A' ' 73' ' ' MET . 30.4 p -97.72 -179.66 4.52 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.098 -0.501 . . . . 71.22 111.089 -179.955 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -94.88 129.25 36.45 Favored Pre-proline 0 C--N 1.329 -0.291 0 CA-C-O 121.623 0.725 . . . . 73.33 111.068 179.888 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 79' ' ' PRO . . . . . 0.596 ' HG3' HD11 ' A' ' 113' ' ' ILE . 53.4 Cg_endo -69.78 174.09 10.04 Favored 'Trans proline' 0 C--N 1.342 0.205 0 C-N-CA 122.666 2.244 . . . . 62.04 112.344 -179.988 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 80' ' ' GLU . . . . . 0.408 ' O ' HG13 ' A' ' 81' ' ' ILE . 3.1 tt0 -118.45 138.54 52.41 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.196 -0.456 . . . . 73.14 110.874 -179.975 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 81' ' ' ILE . . . . . 0.469 ' CG1' ' HA ' ' A' ' 68' ' ' PHE . 15.0 mt -144.56 148.93 17.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.131 -0.486 . . . . 71.53 111.118 179.983 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 82' ' ' GLU . . . . . 0.514 ' HG3' ' CD ' ' A' ' 84' ' ' LYS . 11.3 pt-20 -146.34 148.28 32.21 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.188 -0.46 . . . . 71.05 110.88 179.953 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 83' ' ' PHE . . . . . 0.924 ' CE1' HD21 ' A' ' 66' ' ' LEU . 49.6 m-85 -90.42 136.68 32.9 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.172 -0.467 . . . . 71.44 110.915 -179.975 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 84' ' ' LYS . . . . . 0.514 ' CD ' ' HG3' ' A' ' 82' ' ' GLU . 9.4 mmmt -125.82 169.95 12.1 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.12 -0.491 . . . . 74.03 110.893 -179.996 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 85' ' ' ASN . . . . . 0.469 ' O ' ' C ' ' A' ' 86' ' ' VAL . 5.7 m-80 62.63 -73.03 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.251 -0.431 . . . . 72.15 110.903 179.981 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 86' ' ' VAL . . . . . 0.654 ' O ' HG23 ' A' ' 86' ' ' VAL . 30.5 m 31.86 91.34 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.226 -0.443 . . . . 73.24 111.132 179.919 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -96.18 -72.99 0.61 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.172 -0.467 . . . . 64.51 110.932 -179.98 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 88' ' ' ASN . . . . . 0.439 ' CG ' ' HB ' ' A' ' 60' ' ' VAL . 70.2 m-80 -76.95 54.12 0.99 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.158 -0.473 . . . . 64.34 110.927 -179.995 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 89' ' ' VAL . . . . . 0.488 HG21 HD11 ' A' ' 64' ' ' ILE . 16.2 t -139.2 154.99 25.95 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.203 -0.453 . . . . 64.31 111.114 179.954 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 90' ' ' MET . . . . . . . . . . . . . 4.8 mtm -100.95 -69.59 0.77 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.177 -0.465 . . . . 64.12 110.866 179.938 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 4.3 p-10 173.62 -44.63 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.201 -0.454 . . . . 72.35 110.86 179.945 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -54.38 -38.69 66.43 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.222 -0.444 . . . . 53.51 110.857 -179.74 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 93' ' ' GLN . . . . . 0.596 ' OE1' ' CD2' ' A' ' 128' ' ' PHE . 0.0 OUTLIER -66.6 -42.69 86.52 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.169 -0.469 . . . . 43.55 110.91 -179.969 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 84.1 mt -62.26 -48.29 80.58 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.158 -0.474 . . . . 74.3 110.927 -179.983 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -65.45 -34.27 77.88 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.205 -0.452 . . . . 75.42 110.92 179.88 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 96' ' ' MET . . . . . . . . . . . . . 26.8 ttp -59.99 -39.36 85.45 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.194 -0.457 . . . . 44.11 110.878 179.939 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 97' ' ' LEU . . . . . 0.747 HD22 HG22 ' A' ' 121' ' ' THR . 17.3 mt -66.85 -39.65 87.65 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.243 -0.435 . . . . 55.21 110.908 -179.98 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 5.2 mmtm -56.29 -38.0 70.63 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.198 -0.455 . . . . 73.42 110.876 179.853 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 1.7 m -69.58 -39.64 77.2 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.237 -0.438 . . . . 74.33 110.85 -179.885 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 100' ' ' GLU . . . . . 0.68 ' O ' HD12 ' A' ' 104' ' ' ILE . 68.4 mm-40 -69.22 -24.53 64.03 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.137 -0.483 . . . . 75.21 110.876 -179.912 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 101' ' ' PHE . . . . . 0.649 ' CG ' HD11 ' A' ' 117' ' ' ILE . 6.9 m-30 -63.0 -32.39 73.74 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.155 -0.475 . . . . 72.01 110.886 -179.947 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 102' ' ' LYS . . . . . 0.437 ' HE2' ' C ' ' A' ' 102' ' ' LYS . 2.3 ttpt -70.5 -41.79 72.17 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.171 -0.468 . . . . 74.31 110.893 179.965 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 12.2 ttpt -66.87 -41.17 87.74 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.223 -0.444 . . . . 73.31 110.912 179.872 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 104' ' ' ILE . . . . . 0.68 HD12 ' O ' ' A' ' 100' ' ' GLU . 3.2 mt -64.84 -47.59 87.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.22 -0.445 . . . . 63.15 111.112 179.856 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 105' ' ' HIS . . . . . 0.429 ' O ' ' N ' ' A' ' 109' ' ' ARG . 10.1 t60 -62.91 -41.23 99.39 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.224 -0.444 . . . . 74.14 110.889 179.899 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -59.11 -42.59 90.9 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.217 -0.447 . . . . 65.22 110.904 -179.962 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 10.4 t -81.97 -27.14 33.38 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.184 -0.462 . . . . 75.42 111.152 -179.97 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 108' ' ' SER . . . . . 0.515 ' HB2' HG22 ' A' ' 113' ' ' ILE . 40.5 m -107.44 24.31 13.08 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.225 -0.443 . . . . 32.31 110.839 -179.869 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 109' ' ' ARG . . . . . 0.429 ' N ' ' O ' ' A' ' 105' ' ' HIS . 18.0 ttt180 -71.65 81.76 0.84 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.156 -0.475 . . . . 71.13 110.861 -179.924 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 155.51 -33.35 0.64 Allowed Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 120.774 -0.727 . . . . 25.42 112.54 -179.931 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 111' ' ' GLN . . . . . . . . . . . . . 10.5 pt20 -112.09 -158.72 0.66 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.746 0.308 . . . . 65.23 110.92 -179.862 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 4.0 mt-10 -69.85 136.65 50.97 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.242 -0.435 . . . . 61.55 110.871 -179.943 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 113' ' ' ILE . . . . . 0.596 HD11 ' HG3' ' A' ' 79' ' ' PRO . 2.3 pt -123.95 -6.73 7.21 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.108 -0.496 . . . . 74.23 111.095 179.998 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 114' ' ' ILE . . . . . 0.868 ' H ' HD12 ' A' ' 114' ' ' ILE . 3.5 mp -68.22 -46.66 80.74 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-N 116.194 -0.457 . . . . 65.44 111.155 179.834 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 115' ' ' PHE . . . . . 0.742 ' HE1' HG21 ' A' ' 25' ' ' ILE . 11.4 t80 -65.19 -37.46 87.42 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.142 -0.481 . . . . 72.22 110.916 179.91 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 6.6 mm-40 -67.87 -45.24 75.11 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.106 -0.497 . . . . 74.43 110.897 -179.947 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 117' ' ' ILE . . . . . 0.649 HD11 ' CG ' ' A' ' 101' ' ' PHE . 0.4 OUTLIER -67.55 -40.92 85.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.157 -0.474 . . . . 73.34 111.085 -179.981 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 118' ' ' THR . . . . . 0.69 HG23 ' O ' ' A' ' 114' ' ' ILE . 81.3 p -68.79 -43.49 75.59 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.204 -0.453 . . . . 73.34 111.134 179.978 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 3.3 t -68.1 -44.42 76.24 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.262 -0.427 . . . . 64.14 110.836 -179.832 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 4.6 t80 -62.9 -45.2 93.63 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.146 -0.479 . . . . 75.42 110.887 -179.939 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 121' ' ' THR . . . . . 0.747 HG22 HD22 ' A' ' 97' ' ' LEU . 17.1 p -66.23 -45.32 81.06 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.099 -0.5 . . . . 74.1 111.138 -179.892 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 40.8 tt0 -65.26 -43.81 90.08 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.266 -0.425 . . . . 73.51 110.902 -179.99 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 11.1 pt-20 -70.61 -28.8 65.12 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.178 -0.465 . . . . 62.31 110.895 -179.945 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 124' ' ' LYS . . . . . 0.463 ' HA ' ' CE ' ' A' ' 124' ' ' LYS . 0.2 OUTLIER -78.99 -40.86 30.46 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.173 -0.467 . . . . 74.12 110.894 179.921 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 125' ' ' LEU . . . . . 0.641 ' O ' HD23 ' A' ' 125' ' ' LEU . 0.7 OUTLIER -69.98 -38.1 75.93 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.236 -0.438 . . . . 61.35 110.949 179.906 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -66.7 -46.31 75.97 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.185 -0.461 . . . . 73.44 110.837 179.866 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 127' ' ' GLU . . . . . 0.443 ' OE1' ' C ' ' A' ' 127' ' ' GLU . 1.6 pp20? -65.88 -28.19 68.77 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.185 -0.461 . . . . 72.42 110.873 -179.885 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 128' ' ' PHE . . . . . 0.596 ' CD2' ' OE1' ' A' ' 93' ' ' GLN . 0.2 OUTLIER . . . . . 0 C--N 1.329 -0.311 0 CA-C-N 116.144 -0.48 . . . . 72.55 110.9 -179.913 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 8' ' ' LEU . . . . . 0.585 HD21 ' CE ' ' A' ' 73' ' ' MET . 60.4 mt . . . . . 0 C--O 1.231 0.109 0 CA-C-O 120.829 0.347 . . . . 74.23 110.903 . . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 9' ' ' ASP . . . . . 0.437 ' O ' ' HB2' ' A' ' 12' ' ' TYR . 16.3 t70 -50.51 -33.38 21.28 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.21 -0.45 . . . . 51.53 110.841 179.831 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 2.3 mm-40 -70.11 -40.76 74.69 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.19 -0.459 . . . . 74.41 110.914 -179.865 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 12.7 m-85 -50.99 -24.72 3.92 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.199 -0.455 . . . . 72.41 110.929 -179.872 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 12' ' ' TYR . . . . . 0.437 ' HB2' ' O ' ' A' ' 9' ' ' ASP . 0.1 OUTLIER -59.17 -36.23 74.94 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.127 -0.488 . . . . 74.34 110.919 -179.947 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 13' ' ' GLU . . . . . 0.505 ' HG3' ' N ' ' A' ' 14' ' ' ILE . 6.5 pt-20 -60.28 -42.87 96.36 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.12 -0.491 . . . . 63.14 110.901 -179.938 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 14' ' ' ILE . . . . . 0.505 ' N ' ' HG3' ' A' ' 13' ' ' GLU . 3.9 mp -68.46 -39.95 81.46 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.144 -0.48 . . . . 71.1 111.149 179.927 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 15' ' ' GLN . . . . . 0.481 ' HG2' ' CE1' ' A' ' 74' ' ' TYR . 79.8 mt-30 -63.63 -48.28 77.91 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.175 -0.466 . . . . 50.41 110.888 179.941 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -64.84 -39.18 93.15 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.211 -0.449 . . . . 55.03 110.95 -179.958 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -59.08 -33.82 71.26 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.183 -0.462 . . . . 75.11 110.902 -179.927 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 2.1 mm-40 -66.61 -41.01 89.04 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.152 -0.477 . . . . 71.52 110.892 179.972 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.866 HD11 HG13 ' A' ' 46' ' ' ILE . 6.0 mt -59.96 -51.39 69.88 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.164 -0.471 . . . . 64.31 110.898 -179.941 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 5.0 pt-20 -68.34 -34.95 77.02 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.191 -0.459 . . . . 75.33 110.891 179.916 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -62.76 -50.6 70.41 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.157 -0.474 . . . . 74.34 111.099 179.923 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 22' ' ' ILE . . . . . 0.737 ' HA ' HD12 ' A' ' 25' ' ' ILE . 0.6 OUTLIER -77.65 -34.27 20.03 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.155 -0.475 . . . . 64.11 111.151 179.991 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 1.6 mtt180 -52.25 -35.23 49.23 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.202 -0.454 . . . . 64.34 110.887 179.94 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -67.23 -29.14 68.71 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.167 -0.47 . . . . 63.32 110.857 -179.743 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 25' ' ' ILE . . . . . 0.93 HD13 ' CE1' ' A' ' 115' ' ' PHE . 4.5 mt -84.49 -45.21 17.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.092 -0.504 . . . . 61.13 111.163 179.896 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 16.1 m-85 -110.38 46.69 1.02 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.196 -0.456 . . . . 75.14 110.904 -179.975 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 5.1 mtm -43.95 -61.83 1.32 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.114 -0.494 . . . . 64.5 110.9 179.897 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -82.7 -19.28 38.36 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.235 -0.438 . . . . 64.22 110.894 179.924 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 45.2 m-20 -100.55 37.15 1.75 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.209 -0.45 . . . . 74.2 110.885 179.967 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 30' ' ' PHE . . . . . 0.409 ' HA ' HD13 ' A' ' 50' ' ' ILE . 3.9 t80 -125.5 126.28 44.61 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.186 -0.461 . . . . 74.23 110.869 -179.898 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 52.7 m -118.1 133.27 56.06 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.167 -0.47 . . . . 74.13 111.116 -179.958 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 5.7 t0 -103.74 114.32 28.49 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.236 -0.438 . . . . 74.54 110.892 179.863 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.727 HD12 ' N ' ' A' ' 34' ' ' THR . 0.2 OUTLIER -103.34 -5.44 22.99 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.182 -0.463 . . . . 74.11 110.885 -179.91 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 34' ' ' THR . . . . . 0.727 ' N ' HD12 ' A' ' 33' ' ' LEU . 0.3 OUTLIER . . . . . 0 C--N 1.329 -0.302 0 CA-C-N 116.198 -0.456 . . . . 72.35 111.143 179.933 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 45' ' ' GLN . . . . . 0.839 ' HG2' HG23 ' A' ' 47' ' ' ILE . 18.0 pt20 . . . . . 0 C--O 1.232 0.145 0 CA-C-O 120.768 0.318 . . . . 51.34 110.906 . . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 46' ' ' ILE . . . . . 0.866 HG13 HD11 ' A' ' 19' ' ' LEU . 0.0 OUTLIER 84.83 -24.46 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.236 -0.438 . . . . 74.31 111.089 179.946 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 47' ' ' ILE . . . . . 0.839 HG23 ' HG2' ' A' ' 45' ' ' GLN . 0.2 OUTLIER -32.7 143.66 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.181 -0.463 . . . . 75.54 111.154 179.864 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 11.8 p90 -156.92 174.43 15.52 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.216 -0.447 . . . . 64.41 110.873 179.958 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 49' ' ' GLU . . . . . 0.466 ' CG ' ' HB2' ' A' ' 67' ' ' HIS . 6.3 mt-10 -123.54 161.03 25.73 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.146 -0.479 . . . . 74.23 110.888 -179.908 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 50' ' ' ILE . . . . . 0.411 HD13 ' HA ' ' A' ' 50' ' ' ILE . 13.6 mm -138.04 129.34 38.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.171 -0.468 . . . . 71.45 111.084 -179.988 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 89.3 m -84.01 121.91 28.04 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.142 -0.481 . . . . 72.13 111.141 179.932 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 52' ' ' LEU . . . . . 0.725 HD12 HD12 ' A' ' 66' ' ' LEU . 27.4 mt -121.56 166.06 14.77 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.23 -0.441 . . . . 54.35 110.941 179.935 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 53' ' ' ARG . . . . . 0.508 ' C ' HD21 ' A' ' 125' ' ' LEU . 18.8 ptt180 -179.31 164.79 1.39 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.206 -0.452 . . . . 63.11 110.85 179.97 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 54' ' ' SER . . . . . 0.735 ' N ' HD21 ' A' ' 125' ' ' LEU . 1.7 m -60.65 167.8 2.52 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.164 -0.471 . . . . 54.54 110.867 -179.809 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 27.5 m -76.9 -24.72 15.42 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.119 -0.491 . . . . 61.32 111.155 179.93 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 3.2 t0 -120.5 -171.97 2.28 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.147 -0.479 . . . . 73.33 110.845 179.936 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 7.4 mmmt -116.11 -20.53 9.83 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.141 -0.481 . . . . 74.12 110.888 179.969 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 58' ' ' GLU . . . . . 0.558 ' HA ' ' C ' ' A' ' 59' ' ' PRO . 6.3 pt-20 -115.15 144.38 32.05 Favored Pre-proline 0 C--N 1.329 -0.298 0 CA-C-O 121.674 0.749 . . . . 73.43 110.831 179.959 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 59' ' ' PRO . . . . . 0.558 ' C ' ' HA ' ' A' ' 58' ' ' GLU . 53.5 Cg_endo -69.79 -13.88 12.5 Favored 'Cis proline' 0 C--N 1.342 0.192 0 C-N-CA 122.683 -1.799 . . . . 74.53 112.308 -0.017 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 60' ' ' VAL . . . . . 0.437 ' HB ' ' CG ' ' A' ' 88' ' ' ASN . 10.2 m -147.32 171.3 3.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-N 116.266 -0.424 . . . . 65.41 111.148 179.892 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 61' ' ' GLU . . . . . 0.462 ' O ' ' C ' ' A' ' 62' ' ' SER . 1.4 pt-20 -107.1 -18.41 13.9 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.165 -0.47 . . . . 72.42 110.914 179.967 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 62' ' ' SER . . . . . 0.738 ' HB2' HD11 ' A' ' 125' ' ' LEU . 71.1 m 32.72 90.55 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.143 -0.481 . . . . 52.12 110.915 -179.821 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 26.8 t -107.75 123.16 48.13 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.131 -0.486 . . . . 72.31 110.866 -179.802 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 64' ' ' ILE . . . . . 0.949 HD11 HG21 ' A' ' 89' ' ' VAL . 35.8 mt -134.77 135.39 53.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-N 116.125 -0.489 . . . . 74.54 111.161 179.921 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 53.1 m -104.98 114.58 28.88 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.171 -0.468 . . . . 63.55 111.078 -179.947 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 66' ' ' LEU . . . . . 0.725 HD12 HD12 ' A' ' 52' ' ' LEU . 19.9 mt -91.46 109.8 21.09 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.234 -0.439 . . . . 53.12 110.913 179.929 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 67' ' ' HIS . . . . . 0.617 ' CE1' HD21 ' A' ' 33' ' ' LEU . 0.8 OUTLIER -90.25 109.48 20.57 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.18 -0.464 . . . . 74.22 110.855 179.844 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 68' ' ' PHE . . . . . 0.672 ' HD2' HD12 ' A' ' 81' ' ' ILE . 0.0 OUTLIER -104.33 139.54 39.17 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.219 -0.446 . . . . 74.44 110.872 -179.904 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 69' ' ' ALA . . . . . 0.427 ' O ' ' CB ' ' A' ' 79' ' ' PRO . . . -121.84 129.33 52.52 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.149 -0.478 . . . . 62.44 111.085 179.942 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 70' ' ' MET . . . . . 0.521 ' CE ' HD11 ' A' ' 114' ' ' ILE . 1.0 OUTLIER -100.64 102.61 13.78 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.219 -0.446 . . . . 74.1 110.898 179.929 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -58.66 160.12 11.08 Favored Pre-proline 0 C--N 1.329 -0.283 0 CA-C-O 121.595 0.712 . . . . 71.23 111.137 -179.908 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.75 -2.2 9.76 Favored 'Trans proline' 0 C--N 1.341 0.162 0 C-N-CA 122.706 2.271 . . . . 73.43 112.333 179.992 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 73' ' ' MET . . . . . 0.954 ' HG2' HG23 ' A' ' 77' ' ' THR . 2.0 ttm -117.58 -18.28 9.77 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.232 -0.44 . . . . 71.54 110.889 179.886 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 74' ' ' TYR . . . . . 0.685 ' CD1' ' C ' ' A' ' 74' ' ' TYR . 0.0 OUTLIER -58.58 162.28 6.73 Favored Pre-proline 0 C--N 1.328 -0.354 0 CA-C-O 121.729 0.776 . . . . 71.13 110.875 -179.832 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 75' ' ' PRO . . . . . 0.552 ' HA ' ' CD2' ' A' ' 74' ' ' TYR . 53.3 Cg_endo -69.75 -4.83 8.52 Favored 'Cis proline' 0 C--N 1.341 0.156 0 C-N-CA 122.678 -1.801 . . . . 71.45 112.343 -0.087 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 76' ' ' TYR . . . . . 0.447 ' N ' ' HA ' ' A' ' 74' ' ' TYR . 0.3 OUTLIER -35.95 -60.49 0.54 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.199 -0.455 . . . . 74.43 110.877 -179.912 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 77' ' ' THR . . . . . 0.954 HG23 ' HG2' ' A' ' 73' ' ' MET . 33.6 p -88.08 -170.57 3.03 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.141 -0.481 . . . . 71.41 111.123 -179.973 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -105.01 123.1 40.93 Favored Pre-proline 0 C--N 1.33 -0.282 0 CA-C-O 121.593 0.711 . . . . 54.53 111.069 179.878 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 79' ' ' PRO . . . . . 0.634 ' HG3' HD11 ' A' ' 113' ' ' ILE . 53.8 Cg_endo -69.79 -165.46 0.16 Allowed 'Trans proline' 0 C--N 1.341 0.176 0 C-N-CA 122.696 2.264 . . . . 74.23 112.339 179.952 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 80' ' ' GLU . . . . . 0.463 ' HG3' ' N ' ' A' ' 81' ' ' ILE . 1.5 tt0 -128.0 141.7 51.44 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.19 -0.459 . . . . 73.15 110.846 -179.968 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 81' ' ' ILE . . . . . 0.672 HD12 ' HD2' ' A' ' 68' ' ' PHE . 9.1 mm -138.41 138.09 43.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.113 -0.494 . . . . 71.43 111.109 179.969 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 82' ' ' GLU . . . . . 0.492 ' HG3' ' CD ' ' A' ' 84' ' ' LYS . 4.4 pt-20 -147.7 144.69 28.5 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.144 -0.48 . . . . 63.24 110.885 179.958 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 83' ' ' PHE . . . . . 0.745 ' HD2' HG21 ' A' ' 64' ' ' ILE . 1.8 m-85 -95.16 139.82 30.95 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.156 -0.474 . . . . 71.25 110.922 -179.943 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 84' ' ' LYS . . . . . 0.492 ' CD ' ' HG3' ' A' ' 82' ' ' GLU . 10.6 mmmt -124.64 175.26 7.31 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.164 -0.471 . . . . 72.33 110.888 -179.998 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 7.3 m120 61.63 -75.01 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.223 -0.444 . . . . 65.32 110.914 179.956 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 86' ' ' VAL . . . . . 0.472 ' N ' ' O ' ' A' ' 84' ' ' LYS . 4.2 m 37.4 87.04 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.178 -0.465 . . . . 64.31 111.141 179.878 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -98.74 -69.15 0.77 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.207 -0.452 . . . . 74.34 110.889 -179.98 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 88' ' ' ASN . . . . . 0.437 ' CG ' ' HB ' ' A' ' 60' ' ' VAL . 62.3 m-80 -83.28 42.24 0.81 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.248 -0.433 . . . . 54.41 110.889 -179.978 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 89' ' ' VAL . . . . . 0.949 HG21 HD11 ' A' ' 64' ' ' ILE . 38.7 t -134.48 146.75 30.51 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.191 -0.459 . . . . 75.35 111.143 179.923 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 90' ' ' MET . . . . . . . . . . . . . 16.5 mtm -96.51 -70.99 0.69 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.144 -0.48 . . . . 74.41 110.876 179.918 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER 171.29 -31.62 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.192 -0.458 . . . . 73.0 110.92 179.993 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -55.96 -46.66 78.53 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.157 -0.474 . . . . 63.34 110.879 -179.776 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 93' ' ' GLN . . . . . 0.751 ' NE2' ' CE2' ' A' ' 128' ' ' PHE . 11.6 pt20 -70.56 -40.75 73.16 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.155 -0.475 . . . . 74.54 110.935 179.991 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 94' ' ' LEU . . . . . 0.699 ' HG ' HG11 ' A' ' 89' ' ' VAL . 54.8 mt -57.81 -48.98 78.15 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.159 -0.473 . . . . 65.22 110.914 -179.963 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -65.86 -33.83 76.74 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.151 -0.477 . . . . 64.12 110.879 179.949 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 96' ' ' MET . . . . . 0.485 ' HG2' ' N ' ' A' ' 97' ' ' LEU . 0.0 OUTLIER -59.73 -36.49 76.68 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.213 -0.448 . . . . 75.23 110.867 179.98 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 97' ' ' LEU . . . . . 0.558 HD13 HG22 ' A' ' 121' ' ' THR . 17.0 mt -69.01 -41.68 77.42 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.194 -0.457 . . . . 73.14 110.925 -179.962 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -55.04 -36.65 65.76 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.159 -0.473 . . . . 73.44 110.895 179.864 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -67.46 -43.38 81.2 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.226 -0.443 . . . . 55.35 110.883 -179.948 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 100' ' ' GLU . . . . . 0.4 ' O ' HD12 ' A' ' 104' ' ' ILE . 1.9 mp0 -71.92 -25.22 61.82 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.119 -0.491 . . . . 72.14 110.87 -179.953 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 101' ' ' PHE . . . . . 0.645 ' CD2' HD11 ' A' ' 117' ' ' ILE . 10.8 m-30 -59.51 -26.84 65.64 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.188 -0.46 . . . . 71.05 110.897 -179.944 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 102' ' ' LYS . . . . . 0.428 ' HE2' ' C ' ' A' ' 102' ' ' LYS . 0.2 OUTLIER -72.18 -41.72 66.69 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.141 -0.482 . . . . 74.13 110.875 179.967 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.39 -40.48 73.92 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.244 -0.434 . . . . 72.25 110.869 179.895 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 104' ' ' ILE . . . . . 0.661 HD11 ' CD2' ' A' ' 120' ' ' PHE . 4.0 mt -62.46 -47.11 94.55 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-N 116.245 -0.434 . . . . 74.12 111.093 179.881 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 105' ' ' HIS . . . . . 0.48 ' CE1' ' HG3' ' A' ' 109' ' ' ARG . 16.8 t60 -62.97 -41.0 99.4 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.184 -0.462 . . . . 75.43 110.865 179.91 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 1.1 t-20 -59.51 -38.25 80.46 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.205 -0.452 . . . . 60.54 110.927 -179.945 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 107' ' ' THR . . . . . 0.405 HG22 ' O ' ' A' ' 104' ' ' ILE . 6.8 t -83.21 -27.95 29.62 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.155 -0.475 . . . . 75.43 111.096 179.995 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 1.6 m -112.89 46.7 1.18 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.278 -0.419 . . . . 72.11 110.85 -179.837 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 109' ' ' ARG . . . . . 0.48 ' HG3' ' CE1' ' A' ' 105' ' ' HIS . 2.7 ttp-105 -97.89 84.5 3.34 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.143 -0.481 . . . . 72.12 110.873 -179.976 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 110' ' ' GLY . . . . . 0.421 ' HA2' ' CG ' ' A' ' 75' ' ' PRO . . . 137.99 1.3 2.35 Favored Glycine 0 N--CA 1.452 -0.296 0 C-N-CA 120.768 -0.73 . . . . 71.53 112.488 -179.981 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 111' ' ' GLN . . . . . 0.505 ' O ' ' CG ' ' A' ' 112' ' ' GLU . 11.4 mm-40 -127.64 -75.11 0.57 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.732 0.301 . . . . 75.45 110.934 -179.923 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 112' ' ' GLU . . . . . 0.505 ' CG ' ' O ' ' A' ' 111' ' ' GLN . 31.0 mt-10 -163.6 141.74 7.68 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.223 -0.444 . . . . 63.42 110.875 -179.945 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 113' ' ' ILE . . . . . 0.634 HD11 ' HG3' ' A' ' 79' ' ' PRO . 21.7 pt -128.34 -10.93 3.4 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.118 -0.492 . . . . 71.15 111.16 179.963 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 114' ' ' ILE . . . . . 0.759 ' O ' HG23 ' A' ' 118' ' ' THR . 25.5 mm -66.87 -44.72 88.75 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.148 -0.478 . . . . 71.43 111.149 179.846 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 115' ' ' PHE . . . . . 0.93 ' CE1' HD13 ' A' ' 25' ' ' ILE . 11.3 t80 -72.55 -37.04 68.37 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.141 -0.481 . . . . 73.43 110.873 179.976 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 6.7 mm-40 -67.39 -45.51 76.0 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.141 -0.481 . . . . 73.55 110.901 -179.924 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 117' ' ' ILE . . . . . 0.645 HD11 ' CD2' ' A' ' 101' ' ' PHE . 1.0 OUTLIER -66.91 -42.12 88.48 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.101 -0.499 . . . . 73.34 111.137 179.97 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 118' ' ' THR . . . . . 0.759 HG23 ' O ' ' A' ' 114' ' ' ILE . 79.8 p -68.21 -40.16 82.19 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.172 -0.467 . . . . 70.51 111.132 179.953 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 4.5 t -68.03 -44.03 77.39 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.226 -0.443 . . . . 71.23 110.857 -179.82 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 120' ' ' PHE . . . . . 0.661 ' CD2' HD11 ' A' ' 104' ' ' ILE . 0.3 OUTLIER -60.5 -46.23 90.9 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.111 -0.495 . . . . 63.4 110.868 -179.928 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 121' ' ' THR . . . . . 0.713 HG21 HD11 ' A' ' 66' ' ' LEU . 44.4 p -69.34 -39.09 78.37 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.183 -0.462 . . . . 72.0 111.132 -179.921 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 2.4 tt0 -67.24 -39.68 86.21 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.251 -0.431 . . . . 75.3 110.946 179.958 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 123' ' ' GLU . . . . . 0.502 ' HG3' ' N ' ' A' ' 124' ' ' LYS . 10.1 pt-20 -73.83 -40.47 63.31 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.167 -0.47 . . . . 61.43 110.889 -179.946 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 124' ' ' LYS . . . . . 0.502 ' N ' ' HG3' ' A' ' 123' ' ' GLU . 2.0 mmpt? -78.73 -19.52 52.14 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.174 -0.466 . . . . 63.54 110.894 179.949 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 125' ' ' LEU . . . . . 0.738 HD11 ' HB2' ' A' ' 62' ' ' SER . 1.9 tp -69.49 -52.45 26.46 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.255 -0.429 . . . . 54.53 110.941 179.863 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 10.7 t70 -69.51 -36.86 76.84 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.199 -0.455 . . . . 63.21 110.826 179.854 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 127' ' ' GLU . . . . . 0.471 ' HG3' ' N ' ' A' ' 128' ' ' PHE . 0.4 OUTLIER -59.73 -36.22 76.14 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.221 -0.445 . . . . 71.14 110.858 -179.865 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 128' ' ' PHE . . . . . 0.751 ' CE2' ' NE2' ' A' ' 93' ' ' GLN . 0.0 OUTLIER . . . . . 0 C--N 1.328 -0.33 0 CA-C-N 116.15 -0.477 . . . . 62.13 110.894 -179.927 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 8' ' ' LEU . . . . . 0.618 HD13 ' O ' ' A' ' 72' ' ' PRO . 20.5 mt . . . . . 0 C--O 1.231 0.093 0 CA-C-O 120.767 0.318 . . . . 72.4 110.91 . . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 9.3 t0 -55.13 -34.97 64.2 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.202 -0.454 . . . . 74.3 110.862 179.856 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 94.2 mm-40 -63.59 -35.78 81.63 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.223 -0.444 . . . . 73.04 110.859 -179.891 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 21.6 m-85 -65.77 -24.97 67.05 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.236 -0.438 . . . . 74.44 110.897 -179.853 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -58.93 -41.05 86.43 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.167 -0.47 . . . . 74.01 110.893 -179.898 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 2.0 mm-40 -59.65 -45.94 90.51 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.142 -0.481 . . . . 72.4 110.904 -179.964 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 14' ' ' ILE . . . . . 0.528 HG22 ' OE2' ' A' ' 18' ' ' GLU . 4.2 mp -68.03 -41.08 84.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.138 -0.483 . . . . 70.33 111.145 179.955 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 15' ' ' GLN . . . . . 0.446 ' HB3' HG21 ' A' ' 46' ' ' ILE . 57.1 mt-30 -62.79 -48.06 80.77 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.192 -0.458 . . . . 72.34 110.944 179.922 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -61.84 -45.1 95.28 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.152 -0.477 . . . . 65.1 110.887 -179.981 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -57.84 -33.82 69.05 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.215 -0.448 . . . . 73.44 110.883 -179.907 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 18' ' ' GLU . . . . . 0.528 ' OE2' HG22 ' A' ' 14' ' ' ILE . 2.9 mt-10 -64.03 -38.62 91.72 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.197 -0.456 . . . . 64.34 110.887 -179.96 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 7.8 mp -66.06 -51.52 57.4 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.116 -0.493 . . . . 75.43 110.95 179.986 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 1.5 pt-20 -68.91 -33.77 74.3 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.145 -0.479 . . . . 70.11 110.869 179.948 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -65.98 -50.04 65.71 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.21 -0.45 . . . . 43.2 111.122 179.896 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 22' ' ' ILE . . . . . 0.781 ' HA ' HD12 ' A' ' 25' ' ' ILE . 0.7 OUTLIER -72.19 -34.16 48.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.22 -0.446 . . . . 60.1 111.166 179.975 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -52.39 -36.19 53.46 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.164 -0.471 . . . . 73.3 110.899 179.931 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -67.27 -30.23 70.06 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.165 -0.47 . . . . 52.34 110.799 -179.777 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 25' ' ' ILE . . . . . 0.919 HD13 ' CE1' ' A' ' 115' ' ' PHE . 4.3 mt -83.31 -45.21 18.8 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.141 -0.481 . . . . 61.42 111.112 179.976 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 25.7 m-85 -108.5 42.25 1.43 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.168 -0.469 . . . . 65.23 110.923 -179.96 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER -40.12 -59.07 1.32 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.128 -0.487 . . . . 75.2 110.887 179.884 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -86.14 -20.89 27.97 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.25 -0.432 . . . . 64.32 110.834 179.99 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 42.4 m-20 -96.29 34.79 1.54 Allowed 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.204 -0.453 . . . . 72.35 110.864 -179.996 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 16.1 t80 -118.67 138.48 52.59 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.215 -0.448 . . . . 74.31 110.899 -179.928 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 94.7 m -117.66 134.11 55.24 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.145 -0.48 . . . . 74.1 111.116 -179.894 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -101.23 118.51 37.13 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.249 -0.432 . . . . 74.22 110.901 179.923 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.981 HD21 HG12 ' A' ' 47' ' ' ILE . 0.4 OUTLIER -125.69 -5.68 6.95 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.235 -0.438 . . . . 74.31 110.916 -179.94 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 34' ' ' THR . . . . . 0.609 ' N ' HD23 ' A' ' 33' ' ' LEU . 0.2 OUTLIER . . . . . 0 C--N 1.33 -0.27 0 CA-C-N 116.171 -0.468 . . . . 64.53 111.141 179.914 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 45' ' ' GLN . . . . . 0.733 ' HG2' HG23 ' A' ' 47' ' ' ILE . 26.3 pt20 . . . . . 0 C--O 1.232 0.162 0 CA-C-O 120.719 0.295 . . . . 70.2 110.905 . . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 46' ' ' ILE . . . . . 0.616 HG22 ' O ' ' A' ' 45' ' ' GLN . 0.1 OUTLIER 84.72 -1.27 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 116.235 -0.439 . . . . 62.11 111.144 179.963 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 47' ' ' ILE . . . . . 0.981 HG12 HD21 ' A' ' 33' ' ' LEU . 0.3 OUTLIER -62.61 146.83 12.27 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.167 -0.47 . . . . 73.21 111.137 179.846 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 48' ' ' PHE . . . . . 0.835 ' HA ' HD22 ' A' ' 33' ' ' LEU . 3.6 p90 -151.05 153.8 35.78 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.174 -0.466 . . . . 72.25 110.876 179.943 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 49' ' ' GLU . . . . . 0.705 ' HG3' HD13 ' A' ' 33' ' ' LEU . 10.7 mt-10 -108.52 143.85 36.98 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.117 -0.492 . . . . 73.14 110.864 -179.88 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 30.8 mm -125.94 131.74 71.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.176 -0.466 . . . . 73.2 111.155 179.95 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 85.2 m -85.1 125.6 32.91 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.187 -0.46 . . . . 72.4 111.137 179.975 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 52' ' ' LEU . . . . . 0.873 HD12 HD12 ' A' ' 66' ' ' LEU . 19.9 mt -122.52 164.89 17.29 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.184 -0.462 . . . . 62.01 110.889 179.988 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER 179.11 172.87 0.81 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.205 -0.452 . . . . 74.23 110.861 179.954 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -62.91 170.96 2.38 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.2 -0.454 . . . . 70.41 110.843 -179.799 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 21.8 m -84.85 -24.2 7.21 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 116.14 -0.482 . . . . 55.11 111.143 179.964 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -117.83 -172.72 2.3 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.176 -0.466 . . . . 62.41 110.868 179.92 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -115.19 -12.58 11.85 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.222 -0.444 . . . . 74.34 110.914 -179.972 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 58' ' ' GLU . . . . . 0.545 ' HA ' ' C ' ' A' ' 59' ' ' PRO . 6.3 pm0 -126.79 149.45 68.67 Favored Pre-proline 0 C--N 1.33 -0.257 0 CA-C-O 121.674 0.75 . . . . 61.14 110.879 179.929 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 59' ' ' PRO . . . . . 0.545 ' C ' ' HA ' ' A' ' 58' ' ' GLU . 53.3 Cg_endo -69.8 -8.83 10.78 Favored 'Cis proline' 0 C--N 1.342 0.219 0 C-N-CA 122.674 -1.802 . . . . 72.23 112.303 0.076 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 60' ' ' VAL . . . . . 0.439 HG21 ' CG ' ' A' ' 88' ' ' ASN . 22.3 m -142.51 165.26 16.8 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.197 -0.456 . . . . 41.05 111.093 179.923 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 61' ' ' GLU . . . . . 0.405 ' O ' ' O ' ' A' ' 62' ' ' SER . 7.5 tt0 -93.58 -25.05 17.71 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.143 -0.481 . . . . 74.14 110.848 -179.918 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 62' ' ' SER . . . . . 0.405 ' O ' ' O ' ' A' ' 61' ' ' GLU . 0.5 OUTLIER 41.63 94.15 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.185 -0.461 . . . . 74.2 110.836 -179.79 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 9.2 p -116.57 122.74 45.52 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.145 -0.48 . . . . 72.54 110.874 -179.854 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 64' ' ' ILE . . . . . 1.069 HD11 HG21 ' A' ' 89' ' ' VAL . 21.1 mt -137.89 138.61 43.79 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.132 -0.485 . . . . 60.01 111.097 179.992 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 20.1 m -104.49 113.87 27.72 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.2 -0.455 . . . . 71.3 111.126 179.939 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 66' ' ' LEU . . . . . 0.873 HD12 HD12 ' A' ' 52' ' ' LEU . 6.5 mt -99.17 112.19 24.39 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.174 -0.466 . . . . 71.23 110.927 179.964 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -109.6 114.32 27.84 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.217 -0.447 . . . . 75.31 110.826 179.897 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 68' ' ' PHE . . . . . 0.583 ' CE1' HG23 ' A' ' 114' ' ' ILE . 0.0 OUTLIER -103.31 140.43 37.42 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.213 -0.448 . . . . 63.02 110.865 -179.928 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -117.28 131.33 56.84 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.128 -0.487 . . . . 74.25 111.114 179.944 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 70' ' ' MET . . . . . 0.503 ' SD ' ' CZ ' ' A' ' 74' ' ' TYR . 3.1 mmt -93.49 98.82 11.44 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.224 -0.443 . . . . 73.01 110.858 179.998 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -55.49 163.49 1.84 Allowed Pre-proline 0 C--N 1.33 -0.262 0 CA-C-O 121.57 0.7 . . . . 54.43 111.125 -179.923 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 72' ' ' PRO . . . . . 0.618 ' O ' HD13 ' A' ' 8' ' ' LEU . 53.9 Cg_endo -69.77 3.14 2.95 Favored 'Trans proline' 0 C--N 1.341 0.168 0 C-N-CA 122.668 2.245 . . . . 60.23 112.348 179.935 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 73' ' ' MET . . . . . 0.509 ' HB3' HG23 ' A' ' 77' ' ' THR . 0.1 OUTLIER -126.31 -22.99 3.91 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.21 -0.45 . . . . 55.4 110.868 179.927 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 74' ' ' TYR . . . . . 0.643 ' CD1' ' C ' ' A' ' 74' ' ' TYR . 0.0 OUTLIER -49.56 150.04 3.77 Favored Pre-proline 0 C--N 1.329 -0.32 0 CA-C-O 121.67 0.748 . . . . 61.32 110.959 -179.872 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 75' ' ' PRO . . . . . 0.551 ' C ' ' HA ' ' A' ' 74' ' ' TYR . 53.8 Cg_endo -69.74 -14.06 12.42 Favored 'Cis proline' 0 C--O 1.231 0.157 0 C-N-CA 122.706 -1.789 . . . . 75.31 112.32 -0.006 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 76' ' ' TYR . . . . . 0.507 ' CB ' ' O ' ' A' ' 73' ' ' MET . 9.0 t80 -33.6 -45.75 0.18 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.239 -0.437 . . . . 75.11 110.949 -179.855 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 77' ' ' THR . . . . . 0.509 HG23 ' HB3' ' A' ' 73' ' ' MET . 45.6 p -108.79 164.86 12.01 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.147 -0.479 . . . . 54.41 111.165 -179.997 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -79.84 125.96 81.07 Favored Pre-proline 0 C--N 1.329 -0.292 0 CA-C-O 121.579 0.704 . . . . 51.33 111.119 179.839 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 79' ' ' PRO . . . . . 0.767 ' HG3' HD11 ' A' ' 113' ' ' ILE . 53.8 Cg_endo -69.74 176.43 6.76 Favored 'Trans proline' 0 C--N 1.341 0.147 0 C-N-CA 122.673 2.248 . . . . 72.12 112.343 -179.961 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -119.04 135.13 54.79 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.248 -0.433 . . . . 75.12 110.877 -179.983 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 81' ' ' ILE . . . . . 0.61 HD13 HD13 ' A' ' 117' ' ' ILE . 13.7 mt -143.27 151.29 17.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.156 -0.475 . . . . 71.04 111.135 179.949 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 82' ' ' GLU . . . . . 0.501 ' HG3' ' CD ' ' A' ' 84' ' ' LYS . 11.2 pt-20 -148.99 147.94 29.17 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.144 -0.48 . . . . 74.44 110.868 179.996 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 83' ' ' PHE . . . . . 0.451 ' CE1' HD21 ' A' ' 66' ' ' LEU . 64.6 m-85 -90.63 140.27 29.92 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.16 -0.473 . . . . 72.22 110.897 -179.937 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 84' ' ' LYS . . . . . 0.501 ' CD ' ' HG3' ' A' ' 82' ' ' GLU . 8.0 mmmt -126.4 165.58 18.78 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.201 -0.454 . . . . 73.02 110.877 179.964 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 85' ' ' ASN . . . . . 0.465 ' O ' ' C ' ' A' ' 86' ' ' VAL . 8.2 m120 63.55 -71.82 0.06 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.235 -0.439 . . . . 73.1 110.893 179.97 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 86' ' ' VAL . . . . . 0.687 ' O ' HG23 ' A' ' 86' ' ' VAL . 28.0 m 30.81 91.21 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.156 -0.475 . . . . 73.22 111.106 179.924 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -94.28 -85.25 0.3 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.117 -0.492 . . . . 64.24 110.881 -179.988 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 88' ' ' ASN . . . . . 0.439 ' CG ' HG21 ' A' ' 60' ' ' VAL . 1.0 OUTLIER -45.52 -38.14 6.04 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.207 -0.451 . . . . 74.23 110.923 -179.933 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 89' ' ' VAL . . . . . 1.069 HG21 HD11 ' A' ' 64' ' ' ILE . 3.4 t -61.91 142.92 15.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.134 -0.485 . . . . 74.23 111.103 179.905 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 90' ' ' MET . . . . . . . . . . . . . 7.2 mtm -95.15 -56.46 2.72 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.134 -0.485 . . . . 74.53 110.899 179.91 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER 170.21 -41.87 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.197 -0.456 . . . . 64.53 110.9 179.98 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -54.27 -38.66 66.09 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.188 -0.46 . . . . 55.33 110.87 -179.781 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 93' ' ' GLN . . . . . 0.646 ' CD ' ' CD1' ' A' ' 128' ' ' PHE . 0.0 OUTLIER -68.25 -43.22 78.36 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.151 -0.477 . . . . 70.34 110.906 -179.977 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 62.8 mt -60.52 -48.34 82.21 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.228 -0.442 . . . . 72.41 110.912 -179.957 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -63.38 -34.14 77.07 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.163 -0.471 . . . . 64.12 110.934 179.934 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 96' ' ' MET . . . . . . . . . . . . . 35.3 ttp -60.65 -40.36 91.72 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.175 -0.466 . . . . 73.55 110.832 179.982 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 97' ' ' LEU . . . . . 0.791 HD22 HG22 ' A' ' 121' ' ' THR . 81.2 mt -65.91 -39.88 90.98 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.247 -0.433 . . . . 72.11 110.896 -179.997 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 11.3 mmtm -54.69 -47.19 73.98 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.213 -0.449 . . . . 73.03 110.892 179.831 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 15.7 m -60.3 -36.75 78.59 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.235 -0.438 . . . . 45.32 110.87 -179.888 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 78.2 mm-40 -71.13 -30.21 66.21 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.16 -0.473 . . . . 71.22 110.885 -179.951 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 101' ' ' PHE . . . . . 0.864 ' CD2' HD11 ' A' ' 117' ' ' ILE . 9.0 m-30 -59.33 -37.52 78.01 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.173 -0.467 . . . . 72.44 110.877 -179.98 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -64.8 -40.36 95.09 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.201 -0.454 . . . . 41.2 110.93 179.986 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 25.8 ttpp -70.16 -43.39 70.94 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.197 -0.456 . . . . 75.55 110.88 179.859 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 104' ' ' ILE . . . . . 0.408 ' O ' ' N ' ' A' ' 108' ' ' SER . 4.5 mt -62.14 -47.53 92.68 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 116.232 -0.44 . . . . 62.45 111.128 179.903 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 105' ' ' HIS . . . . . . . . . . . . . 3.2 t60 -62.98 -43.47 98.71 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.187 -0.46 . . . . 73.21 110.839 179.889 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -57.38 -40.26 77.79 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.229 -0.441 . . . . 72.34 110.92 -179.997 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 14.3 t -89.14 -21.22 23.45 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.167 -0.469 . . . . 64.5 111.146 -179.968 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 108' ' ' SER . . . . . 0.594 ' CB ' HG22 ' A' ' 113' ' ' ILE . 60.0 m -109.54 31.16 6.0 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.229 -0.441 . . . . 71.54 110.838 -179.846 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 6.6 ttp180 -79.5 88.1 5.08 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.14 -0.482 . . . . 62.11 110.855 -179.92 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 113.31 44.82 0.77 Allowed Glycine 0 N--CA 1.451 -0.339 0 C-N-CA 120.747 -0.74 . . . . 50.03 112.473 -179.981 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 111' ' ' GLN . . . . . . . . . . . . . 21.5 pt20 -174.77 28.31 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.775 0.321 . . . . 74.42 110.924 -179.886 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER 70.97 140.45 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.198 -0.455 . . . . 71.54 110.935 -179.901 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 113' ' ' ILE . . . . . 0.767 HD11 ' HG3' ' A' ' 79' ' ' PRO . 34.1 pt -134.78 0.1 1.15 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.167 -0.469 . . . . 72.23 111.158 179.987 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 114' ' ' ILE . . . . . 0.737 ' O ' HG23 ' A' ' 118' ' ' THR . 18.8 mm -63.29 -45.88 97.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.148 -0.478 . . . . 74.22 111.158 179.872 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 115' ' ' PHE . . . . . 0.919 ' CE1' HD13 ' A' ' 25' ' ' ILE . 22.2 t80 -72.66 -32.03 65.53 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.114 -0.494 . . . . 75.43 110.835 179.964 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 20.5 mm-40 -67.91 -45.97 72.9 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.187 -0.46 . . . . 74.03 110.915 -179.967 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 117' ' ' ILE . . . . . 0.864 HD11 ' CD2' ' A' ' 101' ' ' PHE . 0.9 OUTLIER -66.39 -43.7 91.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.194 -0.457 . . . . 71.21 111.105 179.989 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 118' ' ' THR . . . . . 0.737 HG23 ' O ' ' A' ' 114' ' ' ILE . 43.9 p -67.95 -41.78 81.95 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.145 -0.48 . . . . 53.23 111.122 179.979 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 43.2 t -68.06 -43.18 79.24 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.242 -0.435 . . . . 73.05 110.833 -179.839 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 3.7 t80 -67.83 -48.63 65.66 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.179 -0.464 . . . . 63.45 110.894 -179.965 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 121' ' ' THR . . . . . 0.791 HG22 HD22 ' A' ' 97' ' ' LEU . 29.0 p -61.88 -39.56 92.38 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.18 -0.464 . . . . 71.22 111.128 -179.919 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -66.68 -50.81 61.67 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.216 -0.447 . . . . 54.25 110.883 -179.968 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 123' ' ' GLU . . . . . 0.417 ' HG3' ' N ' ' A' ' 124' ' ' LYS . 5.5 pt-20 -63.01 -38.17 90.12 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.221 -0.445 . . . . 72.23 110.88 -179.96 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 124' ' ' LYS . . . . . 0.434 ' HA ' ' CE ' ' A' ' 124' ' ' LYS . 0.0 OUTLIER -75.82 -35.08 60.13 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.182 -0.463 . . . . 63.02 110.895 179.996 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 125' ' ' LEU . . . . . 0.69 ' C ' HD23 ' A' ' 125' ' ' LEU . 4.2 tt -70.57 -50.85 33.02 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.201 -0.454 . . . . 74.53 110.927 179.88 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 126' ' ' ASP . . . . . 0.411 ' CG ' ' N ' ' A' ' 127' ' ' GLU . 0.0 OUTLIER -57.56 -46.58 83.78 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.147 -0.478 . . . . 74.33 110.827 179.888 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 127' ' ' GLU . . . . . 0.454 ' OE1' ' C ' ' A' ' 127' ' ' GLU . 0.9 OUTLIER -65.08 -28.15 69.26 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.221 -0.445 . . . . 74.41 110.872 -179.896 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 128' ' ' PHE . . . . . 0.646 ' CD1' ' CD ' ' A' ' 93' ' ' GLN . 0.2 OUTLIER . . . . . 0 C--N 1.329 -0.304 0 CA-C-N 116.155 -0.475 . . . . 75.41 110.878 -179.908 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 29.0 mt . . . . . 0 C--O 1.231 0.096 0 CA-C-O 120.8 0.333 . . . . 62.02 110.925 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -55.2 -30.18 59.42 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.201 -0.454 . . . . 73.1 110.835 179.867 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 77.5 mm-40 -67.2 -35.75 80.28 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.232 -0.44 . . . . 74.52 110.916 -179.852 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 11' ' ' TYR . . . . . 0.49 ' CD1' ' HD2' ' A' ' 75' ' ' PRO . 26.9 m-85 -66.6 -28.1 68.24 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.158 -0.474 . . . . 72.34 110.875 -179.876 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -59.3 -39.24 82.39 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.131 -0.486 . . . . 73.3 110.923 -179.865 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -59.04 -44.25 91.76 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.163 -0.471 . . . . 63.14 110.894 179.976 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 14' ' ' ILE . . . . . 0.618 HG22 ' OE1' ' A' ' 18' ' ' GLU . 3.8 mp -66.94 -48.01 80.77 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.156 -0.475 . . . . 63.01 111.108 179.976 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 57.6 mt-30 -57.85 -46.55 84.63 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.231 -0.44 . . . . 73.11 110.927 179.934 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 6.7 t -58.6 -44.93 90.03 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.226 -0.443 . . . . 71.12 110.91 -179.964 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 1.1 t30 -59.03 -33.88 71.27 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.152 -0.476 . . . . 74.31 110.918 -179.912 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 18' ' ' GLU . . . . . 0.618 ' OE1' HG22 ' A' ' 14' ' ' ILE . 2.2 mp0 -64.35 -39.09 93.2 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.174 -0.466 . . . . 73.4 110.91 179.961 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.846 HD11 HG13 ' A' ' 46' ' ' ILE . 5.7 mt -63.56 -51.27 66.12 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.165 -0.471 . . . . 71.33 110.92 -179.971 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 6.6 pt-20 -68.59 -35.02 76.78 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.163 -0.471 . . . . 73.5 110.894 179.914 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -62.7 -50.67 70.2 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.161 -0.472 . . . . 71.42 111.072 179.962 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 22' ' ' ILE . . . . . 0.796 ' HA ' HD12 ' A' ' 25' ' ' ILE . 0.6 OUTLIER -74.72 -34.98 35.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.234 -0.439 . . . . 64.24 111.163 179.96 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 16.4 mtt180 -52.6 -35.78 54.95 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.151 -0.477 . . . . 74.2 110.846 179.95 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -67.51 -31.2 71.16 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.212 -0.449 . . . . 60.24 110.88 -179.798 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 25' ' ' ILE . . . . . 0.796 HD12 ' HA ' ' A' ' 22' ' ' ILE . 4.8 mt -80.32 -45.22 22.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.114 -0.494 . . . . 71.55 111.102 -179.997 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 17.5 m-85 -109.84 44.02 1.26 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.17 -0.468 . . . . 74.23 110.925 -179.975 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 1.3 mtm -43.49 -40.81 4.04 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.124 -0.489 . . . . 73.41 110.843 179.929 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -104.72 -20.12 13.72 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.275 -0.42 . . . . 61.43 110.863 179.963 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 3.6 m-20 -95.17 22.9 6.21 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.238 -0.437 . . . . 75.13 110.852 179.996 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 30' ' ' PHE . . . . . 0.577 ' CD1' ' C ' ' A' ' 30' ' ' PHE . 0.1 OUTLIER -114.52 143.78 44.42 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.231 -0.441 . . . . 74.24 110.866 -179.912 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 23.7 m -123.99 130.94 53.4 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.11 -0.495 . . . . 73.5 111.147 -179.936 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 1.2 t70 -94.05 114.3 26.43 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.202 -0.454 . . . . 74.11 110.849 179.926 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.985 HD23 ' N ' ' A' ' 34' ' ' THR . 0.2 OUTLIER -117.89 -17.36 9.79 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.229 -0.441 . . . . 62.34 110.934 -179.967 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 34' ' ' THR . . . . . 0.985 ' N ' HD23 ' A' ' 33' ' ' LEU . 4.7 m . . . . . 0 C--N 1.329 -0.293 0 CA-C-N 116.181 -0.463 . . . . 65.24 111.123 179.952 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 45' ' ' GLN . . . . . 0.819 ' HB3' HD12 ' A' ' 47' ' ' ILE . 22.4 tt0 . . . . . 0 C--O 1.232 0.154 0 CA-C-O 120.764 0.316 . . . . 72.42 110.917 . . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 46' ' ' ILE . . . . . 0.846 HG13 HD11 ' A' ' 19' ' ' LEU . 0.0 OUTLIER 79.72 -42.35 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.24 -0.436 . . . . 65.22 111.13 179.991 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 47' ' ' ILE . . . . . 0.897 HG12 HD21 ' A' ' 33' ' ' LEU . 0.2 OUTLIER -34.03 143.27 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.206 -0.452 . . . . 73.32 111.156 179.87 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 48' ' ' PHE . . . . . 0.855 ' HA ' HD22 ' A' ' 33' ' ' LEU . 1.1 p90 -150.05 164.7 34.85 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.16 -0.473 . . . . 74.32 110.833 -179.989 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 49' ' ' GLU . . . . . 0.912 ' HG3' HD13 ' A' ' 33' ' ' LEU . 34.3 mt-10 -108.84 147.56 31.92 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.123 -0.489 . . . . 75.12 110.879 -179.945 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 50' ' ' ILE . . . . . 0.48 HD13 ' HA ' ' A' ' 30' ' ' PHE . 14.4 mm -128.31 135.89 61.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.185 -0.461 . . . . 74.02 111.157 179.951 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 25.9 m -93.73 125.19 38.22 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.168 -0.469 . . . . 71.14 111.14 179.974 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 52' ' ' LEU . . . . . 0.418 HD23 ' HA ' ' A' ' 52' ' ' LEU . 13.9 mt -119.72 165.02 15.06 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.206 -0.452 . . . . 64.15 110.869 179.979 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -166.41 154.35 10.16 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.178 -0.464 . . . . 71.53 110.894 179.985 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 1.9 m -56.8 -172.95 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.162 -0.472 . . . . 73.44 110.868 -179.797 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 34.5 m -87.75 -33.04 6.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.145 -0.48 . . . . 51.31 111.096 179.978 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 5.1 t0 -119.42 -166.55 1.28 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.23 -0.441 . . . . 63.44 110.875 179.922 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 57' ' ' LYS . . . . . 0.446 ' O ' ' C ' ' A' ' 60' ' ' VAL . 1.6 mmmp? -119.31 -25.9 5.99 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.215 -0.448 . . . . 73.22 110.866 -179.995 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 58' ' ' GLU . . . . . 0.555 ' HA ' ' C ' ' A' ' 59' ' ' PRO . 7.0 pt-20 -112.14 144.46 30.82 Favored Pre-proline 0 C--N 1.329 -0.286 0 CA-C-O 121.613 0.721 . . . . 73.31 110.877 179.982 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 59' ' ' PRO . . . . . 0.555 ' C ' ' HA ' ' A' ' 58' ' ' GLU . 53.4 Cg_endo -69.81 -14.44 12.57 Favored 'Cis proline' 0 C--O 1.231 0.171 0 C-N-CA 122.684 -1.798 . . . . 72.1 112.348 0.051 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 60' ' ' VAL . . . . . 0.725 HG11 ' OD1' ' A' ' 88' ' ' ASN . 15.5 m -140.95 -177.88 1.37 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.211 -0.45 . . . . 73.55 111.128 179.938 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 61' ' ' GLU . . . . . 0.441 ' O ' ' C ' ' A' ' 62' ' ' SER . 2.3 pt-20 -119.6 -12.91 9.22 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.177 -0.465 . . . . 61.44 110.891 -179.98 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 62' ' ' SER . . . . . 0.757 ' CB ' HD11 ' A' ' 125' ' ' LEU . 3.6 m 34.26 90.02 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.162 -0.472 . . . . 73.03 110.869 -179.769 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 9.7 p -110.19 122.97 48.89 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.152 -0.476 . . . . 63.33 110.891 -179.865 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 64' ' ' ILE . . . . . 0.733 HD11 HG21 ' A' ' 89' ' ' VAL . 19.8 mt -135.69 142.0 40.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.127 -0.488 . . . . 53.12 111.124 179.944 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 99.6 m -109.71 116.2 31.26 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.194 -0.457 . . . . 74.33 111.115 179.94 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 66' ' ' LEU . . . . . 0.596 HD11 HG21 ' A' ' 121' ' ' THR . 53.0 mt -95.16 116.52 28.84 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.2 -0.454 . . . . 72.33 110.942 179.904 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 5.0 t-80 -105.64 113.83 27.63 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.152 -0.477 . . . . 63.34 110.87 179.861 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 68' ' ' PHE . . . . . 0.551 ' CE1' HG23 ' A' ' 114' ' ' ILE . 0.0 OUTLIER -103.83 139.92 38.37 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.229 -0.441 . . . . 70.22 110.899 -179.927 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -115.47 107.25 14.94 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.188 -0.46 . . . . 61.11 111.122 179.921 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 70' ' ' MET . . . . . 0.425 ' H ' HG22 ' A' ' 47' ' ' ILE . 0.3 OUTLIER -74.7 81.98 2.07 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.248 -0.433 . . . . 73.33 110.911 179.949 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -40.61 158.75 0.16 Allowed Pre-proline 0 C--N 1.33 -0.273 0 CA-C-O 121.579 0.704 . . . . 43.35 111.143 -179.928 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.74 -1.12 7.92 Favored 'Trans proline' 0 C--N 1.341 0.179 0 C-N-CA 122.701 2.267 . . . . 62.42 112.39 179.886 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 73' ' ' MET . . . . . 0.634 ' HB3' HG23 ' A' ' 77' ' ' THR . 0.1 OUTLIER -112.75 -26.02 8.79 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.198 -0.455 . . . . 72.24 110.88 179.899 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 74' ' ' TYR . . . . . 0.635 ' CD1' ' C ' ' A' ' 74' ' ' TYR . 0.0 OUTLIER -48.87 149.93 2.92 Favored Pre-proline 0 C--N 1.328 -0.327 0 CA-C-O 121.681 0.753 . . . . 73.1 110.939 -179.893 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 75' ' ' PRO . . . . . 0.551 ' C ' ' HA ' ' A' ' 74' ' ' TYR . 53.9 Cg_endo -69.72 -12.88 12.24 Favored 'Cis proline' 0 C--O 1.232 0.187 0 C-N-CA 122.761 -1.766 . . . . 73.4 112.329 -0.056 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 76' ' ' TYR . . . . . 0.49 ' CB ' ' O ' ' A' ' 73' ' ' MET . 6.5 t80 -35.74 -51.29 0.67 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.251 -0.431 . . . . 74.13 110.93 -179.9 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 77' ' ' THR . . . . . 0.634 HG23 ' HB3' ' A' ' 73' ' ' MET . 48.2 p -107.1 167.51 9.85 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.12 -0.491 . . . . 74.42 111.122 -179.992 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -88.93 129.39 48.53 Favored Pre-proline 0 C--N 1.329 -0.314 0 CA-C-O 121.59 0.709 . . . . 61.43 111.122 179.858 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 79' ' ' PRO . . . . . 0.58 ' HG3' HD11 ' A' ' 113' ' ' ILE . 53.0 Cg_endo -69.77 -172.47 0.58 Allowed 'Trans proline' 0 C--N 1.341 0.171 0 C-N-CA 122.667 2.244 . . . . 72.34 112.321 -179.948 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -120.57 132.98 55.42 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.212 -0.449 . . . . 63.24 110.871 -179.957 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 81' ' ' ILE . . . . . 0.487 HD13 ' HA ' ' A' ' 68' ' ' PHE . 9.8 mm -122.96 142.31 40.04 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-N 116.161 -0.472 . . . . 43.3 111.159 179.97 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 82' ' ' GLU . . . . . 0.515 ' HG3' ' CD ' ' A' ' 84' ' ' LYS . 4.6 pt-20 -145.09 144.93 31.21 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.217 -0.447 . . . . 51.32 110.893 179.972 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 83' ' ' PHE . . . . . 0.496 ' CE2' ' HD3' ' A' ' 98' ' ' LYS . 33.7 m-85 -99.04 135.28 40.68 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.157 -0.474 . . . . 55.52 110.888 -179.94 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 84' ' ' LYS . . . . . 0.515 ' CD ' ' HG3' ' A' ' 82' ' ' GLU . 9.2 mmmt -125.4 171.84 10.13 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.165 -0.471 . . . . 73.45 110.847 -179.989 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 85' ' ' ASN . . . . . 0.486 ' O ' ' C ' ' A' ' 86' ' ' VAL . 5.6 m120 62.41 -73.87 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.216 -0.447 . . . . 71.34 110.878 179.954 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 86' ' ' VAL . . . . . 0.704 ' O ' HG23 ' A' ' 86' ' ' VAL . 33.6 m 29.74 91.51 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.18 -0.464 . . . . 73.22 111.11 179.911 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -93.64 -63.57 1.19 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.138 -0.483 . . . . 74.05 110.909 -179.958 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 88' ' ' ASN . . . . . 0.725 ' OD1' HG11 ' A' ' 60' ' ' VAL . 17.1 t30 -81.82 39.22 0.54 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.202 -0.454 . . . . 75.11 110.925 -179.987 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 89' ' ' VAL . . . . . 0.733 HG21 HD11 ' A' ' 64' ' ' ILE . 15.6 t -141.2 149.49 20.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.171 -0.468 . . . . 73.41 111.135 179.905 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 90' ' ' MET . . . . . . . . . . . . . 6.2 mtm -107.72 -61.49 1.56 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.152 -0.476 . . . . 54.45 110.865 179.927 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 91' ' ' ASP . . . . . 0.417 ' OD1' ' N ' ' A' ' 92' ' ' SER . 0.0 OUTLIER -177.64 -30.84 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.233 -0.439 . . . . 75.34 110.908 179.988 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 92' ' ' SER . . . . . 0.417 ' N ' ' OD1' ' A' ' 91' ' ' ASP . 47.4 t -55.46 -45.7 76.89 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.175 -0.466 . . . . 63.33 110.89 -179.807 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 93' ' ' GLN . . . . . 0.514 ' HG3' ' CE2' ' A' ' 128' ' ' PHE . 3.9 mp0 -68.58 -41.71 79.28 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.125 -0.489 . . . . 73.24 110.903 -179.985 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 94' ' ' LEU . . . . . 0.668 ' CD1' HG11 ' A' ' 89' ' ' VAL . 7.5 mp -58.61 -48.98 79.16 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.211 -0.45 . . . . 71.24 110.916 -179.986 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 45.7 mt-30 -66.16 -34.45 78.06 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.226 -0.443 . . . . 72.11 110.93 179.928 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 96' ' ' MET . . . . . 0.424 ' SD ' ' CE1' ' A' ' 128' ' ' PHE . 5.7 ttp -59.74 -39.7 85.62 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.159 -0.473 . . . . 73.3 110.864 179.972 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 97' ' ' LEU . . . . . 0.862 HD22 HG22 ' A' ' 121' ' ' THR . 13.4 mt -67.24 -42.18 84.39 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.288 -0.415 . . . . 51.13 110.892 -179.972 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 98' ' ' LYS . . . . . 0.496 ' HD3' ' CE2' ' A' ' 83' ' ' PHE . 3.2 mmmp? -55.23 -42.35 73.28 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.22 -0.445 . . . . 70.35 110.893 179.876 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -59.81 -44.57 93.94 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.206 -0.452 . . . . 72.42 110.883 -179.887 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 100' ' ' GLU . . . . . 0.508 ' O ' HD12 ' A' ' 104' ' ' ILE . 19.3 mt-10 -69.88 -27.44 64.82 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.111 -0.495 . . . . 64.03 110.872 -179.97 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 101' ' ' PHE . . . . . 0.784 ' CD2' HD11 ' A' ' 117' ' ' ILE . 11.8 m-30 -59.37 -28.83 67.22 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.198 -0.455 . . . . 74.11 110.869 -179.945 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 6.5 ttmt -71.79 -43.38 65.77 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.136 -0.484 . . . . 72.51 110.903 179.983 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 16.8 ttpp -69.07 -42.97 75.5 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.235 -0.439 . . . . 72.55 110.882 179.857 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 104' ' ' ILE . . . . . 0.546 HD11 ' CD2' ' A' ' 120' ' ' PHE . 3.5 mt -62.59 -47.46 92.82 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.248 -0.433 . . . . 74.42 111.148 179.854 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 105' ' ' HIS . . . . . . . . . . . . . 35.6 t-80 -62.84 -41.94 99.54 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.185 -0.461 . . . . 63.4 110.872 179.884 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -57.33 -41.25 79.65 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.172 -0.467 . . . . 74.01 110.866 -179.952 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 9.4 t -83.57 -15.61 48.55 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.226 -0.443 . . . . 61.11 111.137 -179.954 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 108' ' ' SER . . . . . 0.578 ' HB2' HG22 ' A' ' 113' ' ' ILE . 1.8 m -124.54 43.55 2.99 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.203 -0.453 . . . . 73.25 110.857 -179.899 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 4.9 ttt180 -90.38 83.23 5.9 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.123 -0.49 . . . . 73.1 110.845 -179.955 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 110' ' ' GLY . . . . . 0.476 ' HA2' ' CG ' ' A' ' 75' ' ' PRO . . . 136.63 -4.43 3.65 Favored Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.712 -0.756 . . . . 53.21 112.486 -179.971 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 111' ' ' GLN . . . . . . . . . . . . . 13.2 mm-40 -116.46 -94.76 0.48 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.784 0.326 . . . . 62.13 110.892 -179.909 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 39.9 mt-10 -149.05 131.4 15.62 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.236 -0.438 . . . . 63.13 110.915 -179.935 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 113' ' ' ILE . . . . . 0.58 HD11 ' HG3' ' A' ' 79' ' ' PRO . 16.3 pt -121.29 -9.52 9.71 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.157 -0.474 . . . . 73.42 111.166 179.932 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 114' ' ' ILE . . . . . 0.924 ' O ' HG23 ' A' ' 118' ' ' THR . 30.2 mm -65.53 -45.85 91.42 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.187 -0.461 . . . . 73.42 111.18 179.819 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 115' ' ' PHE . . . . . 0.726 ' CE1' HD13 ' A' ' 25' ' ' ILE . 31.8 t80 -73.03 -34.49 66.38 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.173 -0.467 . . . . 64.54 110.901 179.917 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 9.0 mm-40 -68.06 -47.88 67.11 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.131 -0.486 . . . . 72.34 110.92 -179.934 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 117' ' ' ILE . . . . . 0.784 HD11 ' CD2' ' A' ' 101' ' ' PHE . 0.9 OUTLIER -63.53 -39.98 87.35 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.13 -0.487 . . . . 71.2 111.133 179.938 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 118' ' ' THR . . . . . 0.924 HG23 ' O ' ' A' ' 114' ' ' ILE . 46.9 p -68.0 -43.54 78.65 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.18 -0.464 . . . . 73.34 111.13 179.972 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -68.01 -44.15 77.21 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.206 -0.452 . . . . 75.24 110.876 -179.877 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 120' ' ' PHE . . . . . 0.546 ' CD2' HD11 ' A' ' 104' ' ' ILE . 1.2 t80 -60.79 -49.45 77.43 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.147 -0.479 . . . . 71.02 110.881 -179.948 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 121' ' ' THR . . . . . 0.862 HG22 HD22 ' A' ' 97' ' ' LEU . 75.5 p -60.04 -40.37 89.14 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.143 -0.481 . . . . 73.23 111.171 -179.891 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -68.07 -51.34 47.65 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.208 -0.451 . . . . 74.11 110.894 179.972 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 123' ' ' GLU . . . . . 0.47 ' CG ' ' N ' ' A' ' 124' ' ' LYS . 4.5 pt-20 -58.91 -46.21 88.43 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.267 -0.424 . . . . 72.11 110.876 -179.908 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 124' ' ' LYS . . . . . 0.47 ' N ' ' CG ' ' A' ' 123' ' ' GLU . 0.0 OUTLIER -73.77 -26.91 60.89 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.17 -0.468 . . . . 63.43 110.896 179.966 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 125' ' ' LEU . . . . . 0.757 HD11 ' CB ' ' A' ' 62' ' ' SER . 2.5 tp -67.9 -50.21 57.5 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.234 -0.439 . . . . 74.32 110.944 179.913 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -61.41 -38.44 87.09 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.175 -0.466 . . . . 60.31 110.872 179.803 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 127' ' ' GLU . . . . . 0.433 ' HG3' ' N ' ' A' ' 128' ' ' PHE . 0.0 OUTLIER -62.27 -28.97 70.09 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.218 -0.446 . . . . 74.13 110.868 -179.879 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 128' ' ' PHE . . . . . 0.514 ' CE2' ' HG3' ' A' ' 93' ' ' GLN . 0.6 OUTLIER . . . . . 0 C--N 1.329 -0.304 0 CA-C-N 116.148 -0.478 . . . . 62.02 110.882 -179.912 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 50.9 mt . . . . . 0 C--O 1.231 0.117 0 CA-C-O 120.825 0.345 . . . . 65.32 110.916 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 37.2 t70 -50.61 -31.13 15.11 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.187 -0.46 . . . . 74.45 110.894 179.819 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 82.6 mm-40 -67.51 -39.65 85.11 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.185 -0.461 . . . . 73.32 110.931 -179.938 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 19.2 m-85 -59.41 -25.4 64.29 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.176 -0.466 . . . . 74.32 110.945 -179.925 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 1.6 t80 -59.33 -38.98 81.7 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.155 -0.475 . . . . 70.3 110.901 -179.905 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -61.43 -42.52 98.88 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.166 -0.47 . . . . 61.11 110.879 -179.964 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 3.1 mp -67.54 -41.9 86.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.171 -0.468 . . . . 73.11 111.169 179.957 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 15' ' ' GLN . . . . . 0.42 ' NE2' ' O ' ' A' ' 71' ' ' THR . 73.0 mt-30 -60.88 -44.7 96.71 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.12 -0.491 . . . . 73.34 110.901 179.917 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 6.9 t -64.02 -39.6 94.47 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.217 -0.447 . . . . 64.22 110.911 -179.919 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 8.0 m-20 -58.02 -33.92 69.48 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.158 -0.474 . . . . 65.43 110.889 -179.9 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 18' ' ' GLU . . . . . 0.4 ' CD ' ' OH ' ' A' ' 74' ' ' TYR . 1.6 mm-40 -65.38 -37.67 87.71 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.173 -0.467 . . . . 73.44 110.886 -179.986 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.419 ' CD2' HG13 ' A' ' 46' ' ' ILE . 5.9 mp -66.14 -51.4 58.23 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.134 -0.485 . . . . 73.34 110.952 179.99 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -68.68 -34.18 75.24 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.196 -0.457 . . . . 74.02 110.881 179.915 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -64.54 -50.85 65.68 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.145 -0.479 . . . . 71.03 111.113 179.906 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 22' ' ' ILE . . . . . 0.748 ' HA ' HD12 ' A' ' 25' ' ' ILE . 0.6 OUTLIER -75.1 -34.46 31.82 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 116.252 -0.431 . . . . 70.33 111.161 179.943 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 23' ' ' ARG . . . . . 0.519 ' O ' ' CA ' ' A' ' 27' ' ' MET . 0.0 OUTLIER -52.43 -35.53 52.33 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.177 -0.465 . . . . 64.54 110.896 179.972 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -68.43 -28.53 67.15 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.132 -0.486 . . . . 74.21 110.908 -179.833 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 25' ' ' ILE . . . . . 0.785 HD13 ' CE1' ' A' ' 115' ' ' PHE . 4.7 mt -84.13 -45.15 18.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.134 -0.485 . . . . 72.52 111.137 179.939 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 26' ' ' TYR . . . . . 0.508 ' O ' ' N ' ' A' ' 29' ' ' ASP . 32.3 m-85 -106.32 21.01 18.1 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.146 -0.479 . . . . 73.31 110.915 -179.991 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 27' ' ' MET . . . . . 0.519 ' CA ' ' O ' ' A' ' 23' ' ' ARG . 0.0 OUTLIER -33.87 -45.56 0.19 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.112 -0.494 . . . . 73.25 110.873 179.951 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 31.1 t70 -86.19 -31.19 21.9 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.209 -0.45 . . . . 74.35 110.871 179.965 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 29' ' ' ASP . . . . . 0.508 ' N ' ' O ' ' A' ' 26' ' ' TYR . 1.3 m-20 -103.21 37.77 1.91 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.151 -0.477 . . . . 44.45 110.907 179.972 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 30' ' ' PHE . . . . . 0.607 ' HA ' HD13 ' A' ' 50' ' ' ILE . 0.6 OUTLIER -109.91 135.13 51.26 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.183 -0.462 . . . . 65.4 110.876 -179.881 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 45.4 m -115.24 130.9 57.04 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.132 -0.485 . . . . 72.5 111.182 -179.934 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -104.9 115.3 30.06 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.283 -0.417 . . . . 62.14 110.904 179.925 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.898 HD21 ' CE1' ' A' ' 67' ' ' HIS . 0.5 OUTLIER -119.18 4.01 11.34 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.223 -0.444 . . . . 54.51 110.882 -179.915 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 34' ' ' THR . . . . . 0.539 ' N ' HD12 ' A' ' 33' ' ' LEU . 1.3 m . . . . . 0 C--N 1.329 -0.283 0 CA-C-N 116.213 -0.449 . . . . 64.52 111.125 179.945 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 45' ' ' GLN . . . . . 0.506 ' O ' HG22 ' A' ' 46' ' ' ILE . 17.6 tt0 . . . . . 0 C--O 1.232 0.137 0 CA-C-O 120.765 0.317 . . . . 71.32 110.899 . . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 46' ' ' ILE . . . . . 0.506 HG22 ' O ' ' A' ' 45' ' ' GLN . 0.0 OUTLIER 81.67 -11.56 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.178 -0.465 . . . . 54.35 111.108 179.936 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 47' ' ' ILE . . . . . 0.468 HG12 ' CD1' ' A' ' 33' ' ' LEU . 0.2 OUTLIER -51.5 150.57 0.91 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 116.157 -0.474 . . . . 73.2 111.114 179.879 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 6.8 p90 -161.95 161.19 28.57 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.118 -0.492 . . . . 73.03 110.875 179.968 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 49' ' ' GLU . . . . . 0.57 ' CD ' HD23 ' A' ' 33' ' ' LEU . 8.6 mt-10 -111.25 161.02 16.44 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.137 -0.483 . . . . 71.34 110.858 -179.942 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 50' ' ' ILE . . . . . 0.607 HD13 ' HA ' ' A' ' 30' ' ' PHE . 7.8 mm -140.27 132.38 32.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.114 -0.493 . . . . 73.52 111.173 179.941 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 24.2 m -84.44 123.29 30.07 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.205 -0.452 . . . . 75.21 111.164 179.995 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 52' ' ' LEU . . . . . 0.533 HD12 HD12 ' A' ' 66' ' ' LEU . 31.2 mt -121.72 164.98 16.48 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.229 -0.442 . . . . 61.23 110.928 179.979 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 53' ' ' ARG . . . . . 0.67 ' C ' HD21 ' A' ' 125' ' ' LEU . 7.6 ptt180 175.68 163.42 0.32 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.231 -0.44 . . . . 71.05 110.848 179.943 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 54' ' ' SER . . . . . 0.882 ' CA ' HD11 ' A' ' 125' ' ' LEU . 1.4 t -60.59 -156.47 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.184 -0.462 . . . . 71.22 110.87 -179.842 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 55' ' ' VAL . . . . . 0.417 HG22 ' OD1' ' A' ' 126' ' ' ASP . 15.7 m -122.31 -22.84 2.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.114 -0.494 . . . . 73.3 111.144 179.896 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 56' ' ' ASP . . . . . 0.439 ' OD1' ' N ' ' A' ' 56' ' ' ASP . 0.2 OUTLIER -110.5 -175.39 2.71 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.181 -0.463 . . . . 61.4 110.889 179.906 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 3.9 mmmm -118.47 -10.87 10.04 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.173 -0.467 . . . . 61.14 110.884 179.999 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 58' ' ' GLU . . . . . 0.558 ' HA ' ' C ' ' A' ' 59' ' ' PRO . 44.3 mt-10 -126.34 141.89 41.24 Favored Pre-proline 0 C--N 1.329 -0.288 0 CA-C-O 121.659 0.742 . . . . 74.25 110.885 179.974 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 59' ' ' PRO . . . . . 0.558 ' C ' ' HA ' ' A' ' 58' ' ' GLU . 53.4 Cg_endo -69.79 -3.18 7.58 Favored 'Cis proline' 0 C--N 1.342 0.205 0 C-N-CA 122.653 -1.811 . . . . 63.24 112.36 0.035 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 60' ' ' VAL . . . . . 0.47 ' HB ' ' ND2' ' A' ' 88' ' ' ASN . 18.3 m -157.61 -173.29 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.232 -0.44 . . . . 74.53 111.144 179.918 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 61' ' ' GLU . . . . . 0.408 ' O ' ' O ' ' A' ' 62' ' ' SER . 8.3 tt0 -114.86 -22.1 9.8 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.184 -0.462 . . . . 72.13 110.873 -179.969 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 62' ' ' SER . . . . . 0.844 ' HB3' HD13 ' A' ' 125' ' ' LEU . 0.4 OUTLIER 49.4 101.63 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.137 -0.483 . . . . 61.15 110.864 -179.787 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 63' ' ' SER . . . . . 0.405 ' HB3' ' CD ' ' A' ' 87' ' ' GLN . 26.0 t -125.31 123.26 39.05 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.14 -0.482 . . . . 75.3 110.887 -179.83 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 64' ' ' ILE . . . . . 0.921 HD11 HG21 ' A' ' 89' ' ' VAL . 64.7 mt -145.16 142.56 22.59 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.178 -0.465 . . . . 55.55 111.163 179.938 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 23.5 m -107.52 119.07 38.4 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.198 -0.455 . . . . 40.02 111.123 -179.994 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 66' ' ' LEU . . . . . 0.565 HD11 HG21 ' A' ' 121' ' ' THR . 54.1 mt -99.01 109.97 22.64 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.242 -0.436 . . . . 72.42 110.915 179.913 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 67' ' ' HIS . . . . . 0.898 ' CE1' HD21 ' A' ' 33' ' ' LEU . 1.9 t60 -96.47 109.76 22.26 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.152 -0.476 . . . . 64.04 110.853 179.869 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 68' ' ' PHE . . . . . 0.493 ' HD2' HD12 ' A' ' 81' ' ' ILE . 0.0 OUTLIER -103.92 139.91 38.42 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.245 -0.434 . . . . 73.14 110.875 -179.911 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 69' ' ' ALA . . . . . 0.451 ' O ' ' CB ' ' A' ' 79' ' ' PRO . . . -126.64 129.04 47.71 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.145 -0.479 . . . . 63.14 111.119 179.908 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 70' ' ' MET . . . . . 0.473 ' CE ' HD11 ' A' ' 114' ' ' ILE . 0.0 OUTLIER -94.64 157.86 15.78 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.234 -0.439 . . . . 73.01 110.854 179.982 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 71' ' ' THR . . . . . 0.42 ' O ' ' NE2' ' A' ' 15' ' ' GLN . 0.1 OUTLIER -112.16 162.93 19.09 Favored Pre-proline 0 C--N 1.33 -0.241 0 CA-C-O 121.601 0.715 . . . . 51.24 111.096 -179.945 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.76 0.1 6.13 Favored 'Trans proline' 0 C--N 1.341 0.173 0 C-N-CA 122.71 2.273 . . . . 60.11 112.348 179.933 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 73' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -115.06 -26.71 7.6 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.241 -0.436 . . . . 63.24 110.911 179.895 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 74' ' ' TYR . . . . . 0.66 ' CD1' ' C ' ' A' ' 74' ' ' TYR . 0.0 OUTLIER -45.76 151.66 0.81 Allowed Pre-proline 0 C--N 1.329 -0.323 0 CA-C-O 121.675 0.75 . . . . 72.33 110.935 -179.873 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 75' ' ' PRO . . . . . 0.552 ' HA ' ' CD2' ' A' ' 74' ' ' TYR . 53.6 Cg_endo -69.8 2.15 5.02 Favored 'Cis proline' 0 C--O 1.232 0.205 0 C-N-CA 122.634 -1.819 . . . . 61.21 112.329 -0.036 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 76' ' ' TYR . . . . . 0.729 ' O ' HG23 ' A' ' 77' ' ' THR . 19.6 t80 -75.3 44.46 0.26 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.258 -0.428 . . . . 72.22 110.967 -179.968 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 77' ' ' THR . . . . . 0.729 HG23 ' O ' ' A' ' 76' ' ' TYR . 0.6 OUTLIER -172.61 -177.57 1.75 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.086 -0.506 . . . . 73.13 111.181 -179.971 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -118.73 116.59 34.58 Favored Pre-proline 0 C--N 1.329 -0.313 0 CA-C-O 121.587 0.708 . . . . 73.1 111.075 179.863 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 79' ' ' PRO . . . . . 0.474 ' HG3' ' CD1' ' A' ' 113' ' ' ILE . 53.7 Cg_endo -69.72 -164.66 0.13 Allowed 'Trans proline' 0 C--N 1.342 0.192 0 C-N-CA 122.674 2.249 . . . . 50.5 112.356 179.978 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 80' ' ' GLU . . . . . 0.578 ' O ' HD13 ' A' ' 81' ' ' ILE . 0.3 OUTLIER -135.32 136.03 41.24 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.19 -0.459 . . . . 71.44 110.907 179.985 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 81' ' ' ILE . . . . . 0.578 HD13 ' O ' ' A' ' 80' ' ' GLU . 10.0 mm -127.99 144.34 37.98 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.113 -0.494 . . . . 60.33 111.168 179.954 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 82' ' ' GLU . . . . . 0.453 ' HG3' ' CD ' ' A' ' 84' ' ' LYS . 1.2 pt-20 -148.51 145.93 28.12 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.162 -0.472 . . . . 72.23 110.888 179.973 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 83' ' ' PHE . . . . . 0.558 ' CE2' ' HD3' ' A' ' 98' ' ' LYS . 7.3 m-85 -99.33 139.95 34.22 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.171 -0.468 . . . . 74.42 110.895 -179.965 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 84' ' ' LYS . . . . . 0.478 ' O ' ' N ' ' A' ' 86' ' ' VAL . 5.3 mmmt -127.06 173.62 9.53 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.172 -0.467 . . . . 74.13 110.889 179.981 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 3.1 m120 61.35 -75.51 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.191 -0.459 . . . . 55.43 110.907 179.946 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 86' ' ' VAL . . . . . 0.672 HG11 HD21 ' A' ' 94' ' ' LEU . 3.6 m 40.22 91.35 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.151 -0.477 . . . . 75.24 111.099 179.858 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 87' ' ' GLN . . . . . 0.405 ' CD ' ' HB3' ' A' ' 63' ' ' SER . 0.1 OUTLIER -96.79 -65.08 0.99 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.143 -0.48 . . . . 74.3 110.934 179.974 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 88' ' ' ASN . . . . . 0.47 ' ND2' ' HB ' ' A' ' 60' ' ' VAL . 8.5 m120 -84.95 34.23 0.54 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.218 -0.447 . . . . 74.14 110.907 -179.995 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 89' ' ' VAL . . . . . 0.921 HG21 HD11 ' A' ' 64' ' ' ILE . 17.1 t -138.06 146.57 26.86 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.205 -0.452 . . . . 61.23 111.148 179.925 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 90' ' ' MET . . . . . . . . . . . . . 13.7 mtm -101.75 -62.97 1.19 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.186 -0.461 . . . . 71.22 110.857 179.932 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -179.53 -32.73 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.215 -0.448 . . . . 74.45 110.848 179.973 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 39.0 t -53.97 -42.3 68.8 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.206 -0.452 . . . . 74.22 110.872 -179.789 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 93' ' ' GLN . . . . . 0.579 ' HG3' ' CZ ' ' A' ' 128' ' ' PHE . 1.9 mp0 -70.36 -39.69 74.46 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.132 -0.485 . . . . 74.13 110.945 -179.98 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 94' ' ' LEU . . . . . 0.672 HD21 HG11 ' A' ' 86' ' ' VAL . 7.4 mp -59.76 -48.16 82.77 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.174 -0.466 . . . . 64.4 110.927 179.992 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 73.7 mt-30 -65.52 -33.91 77.03 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.186 -0.461 . . . . 71.34 110.944 179.91 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 96' ' ' MET . . . . . . . . . . . . . 46.7 ttp -59.8 -38.01 80.73 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.193 -0.458 . . . . 75.54 110.891 179.947 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 97' ' ' LEU . . . . . 0.665 HD22 HG22 ' A' ' 121' ' ' THR . 30.4 mt -72.21 -38.97 68.89 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.226 -0.443 . . . . 74.14 110.954 179.992 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 98' ' ' LYS . . . . . 0.558 ' HD3' ' CE2' ' A' ' 83' ' ' PHE . 2.3 mmmp? -57.1 -38.36 73.28 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.169 -0.469 . . . . 60.13 110.945 179.797 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 5.1 m -63.26 -40.32 97.08 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.185 -0.462 . . . . 74.54 110.872 -179.897 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 100' ' ' GLU . . . . . 0.536 ' O ' HD12 ' A' ' 104' ' ' ILE . 4.2 mm-40 -74.24 -26.46 60.25 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.129 -0.487 . . . . 72.2 110.894 -179.961 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 101' ' ' PHE . . . . . 0.596 ' CD1' ' O ' ' A' ' 97' ' ' LEU . 12.7 m-30 -59.44 -29.95 68.14 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.171 -0.468 . . . . 72.32 110.887 -179.94 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 1.9 tmpt? -74.82 -42.43 58.05 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.158 -0.474 . . . . 73.24 110.86 179.978 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 103' ' ' LYS . . . . . 0.408 ' HG2' ' N ' ' A' ' 104' ' ' ILE . 0.0 OUTLIER -70.13 -37.82 75.4 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.242 -0.436 . . . . 71.22 110.905 179.885 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 104' ' ' ILE . . . . . 0.536 HD12 ' O ' ' A' ' 100' ' ' GLU . 4.2 mt -63.47 -47.52 91.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.217 -0.447 . . . . 71.32 111.088 179.888 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 105' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -61.49 -41.09 96.75 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.223 -0.444 . . . . 74.31 110.879 179.9 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -61.66 -41.05 97.01 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.157 -0.474 . . . . 64.35 110.877 -179.921 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 8.8 t -81.41 -28.27 34.38 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.15 -0.477 . . . . 54.13 111.18 -179.986 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 108' ' ' SER . . . . . 0.555 ' HB2' HG22 ' A' ' 113' ' ' ILE . 67.1 m -100.47 17.48 21.52 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.178 -0.464 . . . . 55.4 110.856 -179.897 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.23 90.86 0.15 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.135 -0.484 . . . . 75.24 110.875 -179.961 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 137.57 -23.39 3.11 Favored Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.737 -0.744 . . . . 63.34 112.447 -179.997 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 111' ' ' GLN . . . . . . . . . . . . . 4.7 pt20 -119.64 -156.8 0.68 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.721 0.296 . . . . 74.21 110.962 -179.903 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 46.8 mt-10 -72.62 139.54 47.45 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.208 -0.451 . . . . 74.12 110.866 -179.918 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 113' ' ' ILE . . . . . 0.555 HG22 ' HB2' ' A' ' 108' ' ' SER . 4.7 pt -123.22 -24.66 2.25 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.196 -0.457 . . . . 73.34 111.139 179.96 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 114' ' ' ILE . . . . . 0.481 ' O ' HG23 ' A' ' 118' ' ' THR . 36.9 mm -59.26 -45.13 93.27 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 116.189 -0.46 . . . . 71.24 111.136 179.856 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 115' ' ' PHE . . . . . 0.785 ' CE1' HD13 ' A' ' 25' ' ' ILE . 28.8 t80 -66.95 -35.29 79.65 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.116 -0.493 . . . . 75.51 110.865 179.967 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 5.2 mm-40 -66.81 -47.91 70.58 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.154 -0.475 . . . . 73.43 110.89 -179.888 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 117' ' ' ILE . . . . . 0.558 ' O ' HG23 ' A' ' 121' ' ' THR . 0.3 OUTLIER -64.42 -41.92 93.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.133 -0.485 . . . . 70.22 111.151 179.959 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 118' ' ' THR . . . . . 0.482 ' N ' ' CG2' ' A' ' 117' ' ' ILE . 66.1 p -67.84 -42.25 81.71 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.208 -0.451 . . . . 64.2 111.141 179.979 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 6.1 t -66.55 -44.25 82.87 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.229 -0.442 . . . . 60.11 110.869 -179.876 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 120' ' ' PHE . . . . . 0.407 ' CE2' ' NZ ' ' A' ' 124' ' ' LYS . 0.2 OUTLIER -64.95 -47.08 78.91 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.132 -0.485 . . . . 73.35 110.88 -179.948 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 121' ' ' THR . . . . . 0.665 HG22 HD22 ' A' ' 97' ' ' LEU . 76.3 p -67.68 -38.96 84.45 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.163 -0.472 . . . . 72.32 111.159 -179.933 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 9.9 tt0 -64.96 -47.99 75.66 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.238 -0.437 . . . . 71.23 110.884 179.986 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 3.0 pt-20 -63.73 -39.25 93.84 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.262 -0.426 . . . . 72.14 110.86 -179.897 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 124' ' ' LYS . . . . . 0.418 ' O ' ' CG ' ' A' ' 127' ' ' GLU . 0.0 OUTLIER -67.49 -40.95 85.25 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.189 -0.46 . . . . 72.42 110.896 179.948 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 125' ' ' LEU . . . . . 0.882 HD11 ' CA ' ' A' ' 54' ' ' SER . 0.2 OUTLIER -68.95 -36.89 78.46 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.17 -0.468 . . . . 72.22 110.94 179.944 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 126' ' ' ASP . . . . . 0.417 ' OD1' HG22 ' A' ' 55' ' ' VAL . 7.9 t0 -64.02 -41.96 97.27 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.166 -0.47 . . . . 74.41 110.889 179.775 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 127' ' ' GLU . . . . . 0.418 ' CG ' ' O ' ' A' ' 124' ' ' LYS . 8.2 pt-20 -69.91 -37.49 75.98 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.152 -0.476 . . . . 75.52 110.87 -179.882 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 128' ' ' PHE . . . . . 0.579 ' CZ ' ' HG3' ' A' ' 93' ' ' GLN . 1.1 m-85 . . . . . 0 C--N 1.329 -0.316 0 CA-C-N 116.154 -0.476 . . . . 74.13 110.9 -179.932 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 8' ' ' LEU . . . . . 0.656 HD13 ' O ' ' A' ' 72' ' ' PRO . 47.9 mt . . . . . 0 C--O 1.231 0.111 0 CA-C-O 120.805 0.336 . . . . 73.32 110.929 . . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -51.5 -32.11 26.33 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.2 -0.455 . . . . 63.31 110.885 179.836 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 80.6 mm-40 -68.11 -37.75 81.51 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.149 -0.478 . . . . 74.43 110.903 -179.917 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 22.0 m-85 -59.74 -27.98 66.97 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.214 -0.448 . . . . 72.03 110.95 -179.857 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -59.54 -37.04 77.34 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.091 -0.504 . . . . 73.1 110.911 -179.94 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 1.4 mm-40 -64.13 -45.22 89.5 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.105 -0.498 . . . . 73.31 110.84 -179.944 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 4.2 mp -67.51 -42.64 87.2 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.178 -0.464 . . . . 74.22 111.184 179.95 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 15' ' ' GLN . . . . . 0.603 ' HB3' HG21 ' A' ' 46' ' ' ILE . 62.4 mt-30 -65.59 -48.4 72.47 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.168 -0.469 . . . . 75.13 110.925 179.921 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 4.2 t -58.57 -37.22 75.28 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.223 -0.444 . . . . 71.45 110.903 -179.942 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -57.79 -33.83 68.97 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.143 -0.481 . . . . 63.13 110.913 -179.91 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 14.8 mt-10 -66.97 -38.15 85.55 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.141 -0.481 . . . . 64.32 110.9 -179.992 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.408 ' CD2' HG13 ' A' ' 46' ' ' ILE . 8.9 mp -63.42 -51.34 66.16 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.117 -0.492 . . . . 75.11 110.911 -179.96 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 3.0 pt-20 -68.48 -34.83 76.6 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.147 -0.478 . . . . 75.21 110.877 179.949 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -66.49 -50.44 63.29 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.163 -0.471 . . . . 74.15 111.107 179.923 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 22' ' ' ILE . . . . . 0.592 HD11 ' HB2' ' A' ' 115' ' ' PHE . 0.8 OUTLIER -74.21 -34.46 37.71 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.261 -0.427 . . . . 74.3 111.165 179.968 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 38.1 mtp180 -52.9 -34.8 56.55 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.192 -0.458 . . . . 71.24 110.873 179.91 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -67.13 -35.26 79.35 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.221 -0.445 . . . . 74.5 110.831 -179.762 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 25' ' ' ILE . . . . . 0.651 HD13 ' CE1' ' A' ' 115' ' ' PHE . 3.2 mt -80.05 -45.09 22.74 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.155 -0.475 . . . . 75.13 111.126 179.978 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 25.2 m-85 -107.02 45.14 1.0 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.176 -0.465 . . . . 54.22 110.907 -179.97 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 2.2 mtm -43.08 -54.07 4.56 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.191 -0.459 . . . . 73.43 110.861 179.911 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -92.99 -24.42 18.37 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.236 -0.438 . . . . 73.23 110.865 179.987 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 9.1 m-20 -86.99 28.76 0.87 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.182 -0.463 . . . . 62.0 110.861 179.968 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 30' ' ' PHE . . . . . 0.611 ' CD1' ' C ' ' A' ' 30' ' ' PHE . 0.4 OUTLIER -113.5 144.34 43.01 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.222 -0.445 . . . . 72.13 110.892 -179.917 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 31' ' ' THR . . . . . 0.4 ' N ' ' CD1' ' A' ' 30' ' ' PHE . 52.6 m -123.9 130.07 52.0 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.126 -0.488 . . . . 75.4 111.092 -179.902 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -96.92 114.14 25.74 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.204 -0.453 . . . . 42.42 110.844 179.88 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 1.113 HD23 ' N ' ' A' ' 34' ' ' THR . 0.1 OUTLIER -117.17 -18.35 10.01 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.217 -0.447 . . . . 74.14 110.894 -179.961 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 34' ' ' THR . . . . . 1.113 ' N ' HD23 ' A' ' 33' ' ' LEU . 4.9 m . . . . . 0 C--N 1.329 -0.298 0 CA-C-N 116.199 -0.455 . . . . 70.44 111.122 -179.981 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 45' ' ' GLN . . . . . 0.808 ' HG2' HG23 ' A' ' 47' ' ' ILE . 24.5 pt20 . . . . . 0 C--O 1.232 0.172 0 CA-C-O 120.746 0.307 . . . . 70.35 110.875 . . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 46' ' ' ILE . . . . . 0.699 HG22 ' O ' ' A' ' 45' ' ' GLN . 0.1 OUTLIER 86.68 2.52 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.244 -0.435 . . . . 71.31 111.182 -179.992 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 47' ' ' ILE . . . . . 0.808 HG23 ' HG2' ' A' ' 45' ' ' GLN . 0.2 OUTLIER -66.39 147.68 12.48 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.167 -0.47 . . . . 62.24 111.113 179.864 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 48' ' ' PHE . . . . . 0.926 ' HA ' HD22 ' A' ' 33' ' ' LEU . 6.6 p90 -160.94 163.41 31.86 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.189 -0.46 . . . . 71.32 110.885 179.977 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 49' ' ' GLU . . . . . 0.782 ' HG3' HD13 ' A' ' 33' ' ' LEU . 19.1 mt-10 -110.73 157.39 19.8 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.128 -0.487 . . . . 73.5 110.878 -179.929 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 50' ' ' ILE . . . . . 0.568 HD13 ' HA ' ' A' ' 30' ' ' PHE . 9.5 mm -134.27 135.24 54.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.177 -0.465 . . . . 60.21 111.136 -179.986 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 99.7 m -85.08 135.08 34.15 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.156 -0.474 . . . . 54.41 111.131 -179.996 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 52' ' ' LEU . . . . . 0.574 HD12 HD22 ' A' ' 66' ' ' LEU . 9.1 mt -133.98 156.01 48.95 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.203 -0.453 . . . . 74.15 110.936 179.978 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 53' ' ' ARG . . . . . 0.619 ' C ' HD21 ' A' ' 125' ' ' LEU . 0.0 OUTLIER -155.92 163.43 39.77 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.174 -0.466 . . . . 74.33 110.858 179.956 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 54' ' ' SER . . . . . 0.687 ' N ' HD21 ' A' ' 125' ' ' LEU . 0.3 OUTLIER -58.72 -169.0 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.174 -0.466 . . . . 33.14 110.85 -179.753 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -82.51 -37.65 14.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.128 -0.487 . . . . 72.54 111.131 179.973 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 5.4 t0 -130.43 -153.55 0.57 Allowed 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.157 -0.474 . . . . 50.04 110.873 179.91 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 57' ' ' LYS . . . . . 0.442 ' HD2' ' CD ' ' A' ' 61' ' ' GLU . 0.5 OUTLIER -116.94 -11.09 10.85 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.213 -0.449 . . . . 73.32 110.891 -179.983 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 58' ' ' GLU . . . . . 0.548 ' HA ' ' C ' ' A' ' 59' ' ' PRO . 1.8 pt-20 -126.6 147.07 59.15 Favored Pre-proline 0 C--N 1.329 -0.3 0 CA-C-O 121.664 0.745 . . . . 64.42 110.888 179.982 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 59' ' ' PRO . . . . . 0.548 ' C ' ' HA ' ' A' ' 58' ' ' GLU . 53.6 Cg_endo -69.75 -8.38 10.45 Favored 'Cis proline' 0 C--N 1.342 0.217 0 C-N-CA 122.679 -1.8 . . . . 75.53 112.353 0.011 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 60' ' ' VAL . . . . . 0.43 HG21 ' CG ' ' A' ' 88' ' ' ASN . 14.1 m -149.11 164.77 4.04 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.198 -0.455 . . . . 65.43 111.143 179.924 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 61' ' ' GLU . . . . . 0.442 ' CD ' ' HD2' ' A' ' 57' ' ' LYS . 1.9 tp10 -93.95 -28.2 15.93 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.226 -0.443 . . . . 74.21 110.872 -179.919 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 62' ' ' SER . . . . . 0.869 ' HB3' HD11 ' A' ' 125' ' ' LEU . 5.1 t 40.42 93.82 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.146 -0.479 . . . . 62.4 110.885 -179.796 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 63' ' ' SER . . . . . 0.429 ' HB2' ' CG ' ' A' ' 53' ' ' ARG . 1.3 t -115.17 123.76 49.73 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.142 -0.481 . . . . 43.14 110.845 -179.801 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 64' ' ' ILE . . . . . 0.666 HD13 HD11 ' A' ' 94' ' ' LEU . 38.0 mt -134.8 137.49 50.83 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 116.165 -0.471 . . . . 53.01 111.134 179.934 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 51.6 m -100.16 114.6 28.11 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.159 -0.473 . . . . 73.41 111.156 179.956 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 66' ' ' LEU . . . . . 0.945 HD21 HG21 ' A' ' 121' ' ' THR . 1.5 mp -94.04 111.46 23.18 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.22 -0.445 . . . . 72.13 110.887 179.966 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 1.5 t60 -102.77 111.4 23.7 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.184 -0.462 . . . . 53.11 110.844 179.831 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 68' ' ' PHE . . . . . 0.571 ' CE1' HG23 ' A' ' 114' ' ' ILE . 0.0 OUTLIER -103.83 142.38 34.48 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.199 -0.455 . . . . 70.02 110.904 -179.944 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -124.8 121.94 36.0 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.121 -0.491 . . . . 43.4 111.116 179.93 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 70' ' ' MET . . . . . 0.544 ' CE ' HD11 ' A' ' 114' ' ' ILE . 0.0 OUTLIER -86.61 91.41 8.57 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.205 -0.452 . . . . 75.44 110.869 179.987 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -43.87 157.24 0.28 Allowed Pre-proline 0 C--N 1.33 -0.256 0 CA-C-O 121.589 0.709 . . . . 72.53 111.118 -179.932 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 72' ' ' PRO . . . . . 0.656 ' O ' HD13 ' A' ' 8' ' ' LEU . 53.9 Cg_endo -69.7 2.21 3.71 Favored 'Trans proline' 0 C--N 1.341 0.169 0 C-N-CA 122.671 2.247 . . . . 54.32 112.364 179.93 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 73' ' ' MET . . . . . 0.492 ' O ' ' CB ' ' A' ' 76' ' ' TYR . 0.1 OUTLIER -118.57 -25.84 6.33 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.208 -0.451 . . . . 75.1 110.884 179.943 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 74' ' ' TYR . . . . . 0.658 ' CD1' ' C ' ' A' ' 74' ' ' TYR . 0.0 OUTLIER -47.66 150.45 1.8 Allowed Pre-proline 0 C--N 1.329 -0.316 0 CA-C-O 121.697 0.76 . . . . 73.4 110.915 -179.875 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 75' ' ' PRO . . . . . 0.552 ' C ' ' HA ' ' A' ' 74' ' ' TYR . 53.4 Cg_endo -69.76 -10.97 11.76 Favored 'Cis proline' 0 C--N 1.341 0.182 0 C-N-CA 122.68 -1.8 . . . . 72.42 112.348 -0.038 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 76' ' ' TYR . . . . . 0.492 ' CB ' ' O ' ' A' ' 73' ' ' MET . 25.0 t80 -34.03 -52.21 0.44 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.189 -0.459 . . . . 71.53 110.934 -179.879 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 31.0 p -106.46 -175.74 2.88 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.075 -0.511 . . . . 75.12 111.066 -179.938 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -100.96 132.37 22.13 Favored Pre-proline 0 C--N 1.329 -0.306 0 CA-C-O 121.552 0.691 . . . . 61.23 111.08 179.89 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 79' ' ' PRO . . . . . 0.711 ' HG3' HD11 ' A' ' 113' ' ' ILE . 53.7 Cg_endo -69.71 -167.52 0.23 Allowed 'Trans proline' 0 C--N 1.341 0.155 0 C-N-CA 122.672 2.248 . . . . 61.14 112.339 179.969 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 80' ' ' GLU . . . . . 0.576 ' O ' HD13 ' A' ' 81' ' ' ILE . 1.7 tt0 -130.0 142.63 50.61 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.164 -0.471 . . . . 61.23 110.905 -179.983 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 81' ' ' ILE . . . . . 0.576 HD13 ' O ' ' A' ' 80' ' ' GLU . 6.1 mm -133.94 141.68 43.31 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.18 -0.464 . . . . 71.13 111.135 -179.996 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 82' ' ' GLU . . . . . 0.473 ' HG3' ' CD ' ' A' ' 84' ' ' LYS . 3.5 pt-20 -147.44 140.3 24.94 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.211 -0.45 . . . . 71.33 110.878 179.995 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 83' ' ' PHE . . . . . 0.511 ' CD1' HD11 ' A' ' 66' ' ' LEU . 11.8 m-85 -95.71 140.98 29.74 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.114 -0.493 . . . . 64.31 110.847 -179.899 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 84' ' ' LYS . . . . . 0.473 ' CD ' ' HG3' ' A' ' 82' ' ' GLU . 9.8 mmmt -124.53 171.01 10.34 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.149 -0.478 . . . . 55.5 110.895 179.965 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 85' ' ' ASN . . . . . 0.4 ' C ' HG22 ' A' ' 86' ' ' VAL . 3.2 m120 63.35 -73.17 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.241 -0.436 . . . . 65.13 110.891 179.899 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 86' ' ' VAL . . . . . 0.672 HG11 HD21 ' A' ' 94' ' ' LEU . 2.7 m 40.96 94.5 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.142 -0.481 . . . . 62.44 111.125 179.893 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -97.13 -83.29 0.39 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.136 -0.484 . . . . 62.15 110.946 179.98 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 88' ' ' ASN . . . . . 0.43 ' CG ' HG21 ' A' ' 60' ' ' VAL . 13.2 t30 -59.99 -40.46 89.26 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.209 -0.45 . . . . 73.43 110.879 -179.984 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 89' ' ' VAL . . . . . 1.084 HG21 HD13 ' A' ' 94' ' ' LEU . 0.9 OUTLIER -62.58 141.03 18.5 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.157 -0.474 . . . . 74.32 111.109 179.953 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 90' ' ' MET . . . . . . . . . . . . . 6.8 mtm -97.22 -67.25 0.86 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.149 -0.478 . . . . 71.33 110.848 179.935 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 6.8 p-10 178.77 -32.4 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.249 -0.432 . . . . 74.41 110.889 179.997 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -54.55 -46.45 73.64 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.175 -0.466 . . . . 43.31 110.882 -179.757 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 93' ' ' GLN . . . . . 0.601 ' OE1' ' CE2' ' A' ' 128' ' ' PHE . 1.5 pt20 -70.87 -36.84 72.97 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.136 -0.484 . . . . 72.31 110.943 -179.98 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 94' ' ' LEU . . . . . 1.084 HD13 HG21 ' A' ' 89' ' ' VAL . 0.6 OUTLIER -57.66 -47.42 82.31 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.185 -0.461 . . . . 72.51 110.967 179.991 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 3.5 mm-40 -62.93 -34.09 76.73 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.193 -0.458 . . . . 72.11 110.913 179.89 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 96' ' ' MET . . . . . . . . . . . . . 19.1 ttp -59.95 -40.04 87.61 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.173 -0.467 . . . . 65.13 110.912 179.943 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 97' ' ' LEU . . . . . 0.599 ' O ' ' CD1' ' A' ' 101' ' ' PHE . 27.0 mt -68.02 -40.78 82.87 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.204 -0.453 . . . . 71.33 110.914 179.98 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 98' ' ' LYS . . . . . 0.487 ' HD3' ' CE2' ' A' ' 83' ' ' PHE . 3.7 mmtp -57.26 -36.52 71.08 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.178 -0.465 . . . . 63.45 110.899 179.857 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -68.93 -43.73 74.51 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.209 -0.45 . . . . 74.21 110.847 -179.897 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 100' ' ' GLU . . . . . 0.406 ' O ' HD12 ' A' ' 104' ' ' ILE . 37.3 mm-40 -66.82 -24.0 66.11 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.173 -0.467 . . . . 75.05 110.905 -179.959 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 101' ' ' PHE . . . . . 0.627 ' CD2' HD11 ' A' ' 117' ' ' ILE . 11.1 m-30 -60.53 -37.08 80.03 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.148 -0.478 . . . . 74.34 110.917 -179.972 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 1.7 tmpt? -63.96 -40.22 95.93 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.112 -0.495 . . . . 75.32 110.878 -180.0 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 2.3 mppt? -69.48 -40.35 77.12 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.226 -0.443 . . . . 63.25 110.89 179.868 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 104' ' ' ILE . . . . . 0.455 ' O ' ' CG2' ' A' ' 107' ' ' THR . 4.3 mt -64.12 -47.62 89.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.218 -0.446 . . . . 64.42 111.08 179.913 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 105' ' ' HIS . . . . . 0.474 ' O ' ' N ' ' A' ' 109' ' ' ARG . 3.4 t60 -62.56 -41.28 98.81 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.207 -0.451 . . . . 72.11 110.854 179.898 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 1.3 t-20 -57.66 -36.95 72.58 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.244 -0.435 . . . . 72.22 110.905 -179.946 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 107' ' ' THR . . . . . 0.455 ' CG2' ' O ' ' A' ' 104' ' ' ILE . 5.1 t -84.93 -26.1 27.45 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.149 -0.478 . . . . 65.22 111.141 179.995 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 108' ' ' SER . . . . . 0.49 ' OG ' HG22 ' A' ' 113' ' ' ILE . 27.5 p -109.05 20.87 17.9 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.251 -0.431 . . . . 72.32 110.885 -179.893 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 109' ' ' ARG . . . . . 0.474 ' N ' ' O ' ' A' ' 105' ' ' HIS . 11.6 ttt180 -62.83 77.48 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.104 -0.498 . . . . 70.32 110.875 -179.926 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 110' ' ' GLY . . . . . 0.427 ' N ' ' O ' ' A' ' 108' ' ' SER . . . 136.67 33.55 0.23 Allowed Glycine 0 N--CA 1.451 -0.365 0 C-N-CA 120.745 -0.741 . . . . 73.44 112.488 -179.977 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 111' ' ' GLN . . . . . . . . . . . . . 3.9 pt20 -170.12 -166.27 0.53 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.735 0.302 . . . . 73.32 110.897 -179.898 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 15.2 mt-10 -68.98 129.98 41.46 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.218 -0.446 . . . . 74.03 110.914 -179.926 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 113' ' ' ILE . . . . . 0.711 HD11 ' HG3' ' A' ' 79' ' ' PRO . 22.4 pt -126.69 -8.15 4.83 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.202 -0.453 . . . . 71.32 111.139 179.947 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 114' ' ' ILE . . . . . 0.663 ' O ' HG23 ' A' ' 118' ' ' THR . 42.3 mm -64.88 -44.17 96.25 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-N 116.189 -0.46 . . . . 64.23 111.127 179.8 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 115' ' ' PHE . . . . . 0.651 ' CE1' HD13 ' A' ' 25' ' ' ILE . 19.2 t80 -68.85 -35.24 76.69 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.208 -0.451 . . . . 73.42 110.884 179.966 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 35.5 mm-40 -66.48 -46.03 77.69 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.127 -0.488 . . . . 61.53 110.877 -179.943 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 117' ' ' ILE . . . . . 0.627 HD11 ' CD2' ' A' ' 101' ' ' PHE . 0.4 OUTLIER -64.03 -40.81 90.38 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.149 -0.478 . . . . 73.25 111.168 179.983 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 118' ' ' THR . . . . . 0.663 HG23 ' O ' ' A' ' 114' ' ' ILE . 67.7 p -68.25 -41.56 80.98 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.129 -0.487 . . . . 54.33 111.136 179.974 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 1.2 t -67.98 -43.5 78.82 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.215 -0.448 . . . . 74.14 110.871 -179.852 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -66.64 -41.56 88.07 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.174 -0.466 . . . . 74.52 110.87 -179.971 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 121' ' ' THR . . . . . 0.945 HG21 HD21 ' A' ' 66' ' ' LEU . 11.9 p -67.66 -39.18 84.56 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.119 -0.491 . . . . 51.23 111.133 -179.926 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 59.1 tt0 -64.99 -50.64 65.53 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.245 -0.434 . . . . 74.35 110.899 -179.981 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 123' ' ' GLU . . . . . 0.453 ' HG3' ' N ' ' A' ' 124' ' ' LYS . 12.3 pt-20 -60.16 -36.38 77.43 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.173 -0.467 . . . . 62.3 110.882 -179.921 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 124' ' ' LYS . . . . . 0.49 ' HA ' ' CG ' ' A' ' 127' ' ' GLU . 0.0 OUTLIER -78.52 -32.36 47.99 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.144 -0.48 . . . . 60.31 110.91 179.942 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 125' ' ' LEU . . . . . 0.869 HD11 ' HB3' ' A' ' 62' ' ' SER . 0.5 OUTLIER -72.25 -41.48 66.74 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.217 -0.447 . . . . 61.51 110.952 179.903 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -70.37 -46.28 64.4 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.151 -0.477 . . . . 63.05 110.896 179.835 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 127' ' ' GLU . . . . . 0.571 ' CD ' ' N ' ' A' ' 128' ' ' PHE . 3.1 pp20? -59.15 -50.82 72.56 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.153 -0.476 . . . . 63.44 110.859 -179.91 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 128' ' ' PHE . . . . . 0.601 ' CE2' ' OE1' ' A' ' 93' ' ' GLN . 0.0 OUTLIER . . . . . 0 C--N 1.329 -0.317 0 CA-C-N 116.145 -0.479 . . . . 75.12 110.873 -179.881 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.23 0.07 0 CA-C-O 120.789 0.328 . . . . 65.4 110.883 . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 40.5 m -136.96 94.01 2.91 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.23 -0.441 . . . . 70.31 110.897 -179.869 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -127.46 100.11 5.89 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.085 -0.507 . . . . 74.34 110.933 179.999 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 57.5 p -163.67 -55.95 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.219 -0.446 . . . . 74.23 110.806 -179.925 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 5' ' ' HIS . . . . . 0.483 ' HB3' HD12 ' A' ' 6' ' ' LEU . 0.2 OUTLIER -41.9 -65.4 0.46 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.145 -0.479 . . . . 63.0 110.835 179.992 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 6' ' ' LEU . . . . . 0.483 HD12 ' HB3' ' A' ' 5' ' ' HIS . 6.2 mp -104.74 114.23 28.32 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.205 -0.452 . . . . 74.24 110.913 -179.94 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 7' ' ' THR . . . . . 0.501 HG23 ' HB2' ' A' ' 9' ' ' ASP . 3.0 t -81.86 169.72 16.52 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.181 -0.463 . . . . 74.14 111.17 179.933 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.687 HD13 ' O ' ' A' ' 72' ' ' PRO . 11.0 mt -55.06 -30.53 59.81 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.249 -0.432 . . . . 71.11 110.954 179.96 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 9' ' ' ASP . . . . . 0.501 ' HB2' HG23 ' A' ' 7' ' ' THR . 2.8 m-20 -53.02 -32.18 45.26 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.156 -0.475 . . . . 75.14 110.834 179.868 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 62.8 mm-40 -64.84 -38.42 90.92 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.193 -0.458 . . . . 60.5 110.893 -179.84 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 11' ' ' TYR . . . . . 0.421 ' CD1' ' HD2' ' A' ' 75' ' ' PRO . 20.7 m-85 -64.16 -25.18 67.97 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.183 -0.462 . . . . 74.12 110.946 -179.887 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -58.98 -37.4 76.72 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.142 -0.481 . . . . 74.23 110.926 -179.957 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 1.6 mm-40 -65.91 -43.35 88.44 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.125 -0.489 . . . . 73.44 110.909 179.978 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 4.3 mp -67.22 -43.24 88.44 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 116.135 -0.484 . . . . 61.1 111.152 179.968 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 15' ' ' GLN . . . . . 0.543 ' HB3' HG21 ' A' ' 46' ' ' ILE . 81.7 mt-30 -64.69 -46.28 83.03 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.152 -0.476 . . . . 73.21 110.911 179.965 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 38.9 t -60.96 -38.84 87.33 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.182 -0.463 . . . . 72.22 110.847 -179.931 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 1.5 m-20 -58.79 -33.87 70.83 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.172 -0.467 . . . . 74.03 110.899 -179.878 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 15.6 mt-10 -67.71 -38.59 83.81 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.16 -0.473 . . . . 63.22 110.865 -179.954 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.469 HD13 ' O ' ' A' ' 15' ' ' GLN . 9.8 mp -61.48 -51.68 67.67 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.176 -0.466 . . . . 75.03 110.932 179.989 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 2.5 pt-20 -68.86 -34.6 75.73 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.192 -0.458 . . . . 75.14 110.895 179.958 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -65.35 -45.79 82.77 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.142 -0.481 . . . . 72.53 111.114 179.948 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 22' ' ' ILE . . . . . 0.783 ' HA ' HD12 ' A' ' 25' ' ' ILE . 0.5 OUTLIER -77.2 -34.59 21.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.186 -0.461 . . . . 73.34 111.14 179.944 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -53.39 -35.59 60.53 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.177 -0.465 . . . . 75.4 110.841 179.98 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -66.79 -31.43 72.06 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.167 -0.47 . . . . 72.15 110.863 -179.77 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 25' ' ' ILE . . . . . 0.783 HD12 ' HA ' ' A' ' 22' ' ' ILE . 5.0 mt -79.72 -45.09 23.3 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.163 -0.472 . . . . 73.11 111.112 179.943 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 38.4 m-85 -111.51 45.73 1.18 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.187 -0.46 . . . . 74.31 110.928 -179.988 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 27' ' ' MET . . . . . 0.44 ' H ' ' HE2' ' A' ' 27' ' ' MET . 0.2 OUTLIER -40.85 -40.56 1.39 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.131 -0.486 . . . . 73.32 110.884 179.909 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 11.4 m-20 -106.07 -27.2 11.27 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.204 -0.453 . . . . 75.12 110.887 179.942 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 10.7 m-20 -85.05 29.57 0.64 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.196 -0.456 . . . . 73.04 110.853 179.998 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 30' ' ' PHE . . . . . 0.545 ' CD1' ' C ' ' A' ' 30' ' ' PHE . 0.3 OUTLIER -113.21 146.04 39.98 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.229 -0.442 . . . . 64.34 110.853 -179.929 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 42.5 m -122.89 132.9 54.38 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.117 -0.492 . . . . 64.01 111.17 -179.928 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -98.33 114.72 27.12 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.257 -0.428 . . . . 75.2 110.852 179.923 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.952 HD21 HG12 ' A' ' 47' ' ' ILE . 0.3 OUTLIER -120.53 -16.47 8.31 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.147 -0.479 . . . . 74.04 110.951 -179.982 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 34' ' ' THR . . . . . 0.787 ' N ' HD23 ' A' ' 33' ' ' LEU . 0.9 OUTLIER -49.22 160.18 0.24 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.154 -0.476 . . . . 72.54 111.14 179.918 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -75.54 50.32 0.53 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.176 -0.465 . . . . 62.42 110.887 179.897 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 36' ' ' ARG . . . . . 0.442 ' O ' ' C ' ' A' ' 37' ' ' LYS . 22.3 mtp180 -114.84 -41.05 3.42 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.217 -0.447 . . . . 74.34 110.877 179.962 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 37' ' ' LYS . . . . . 0.442 ' C ' ' O ' ' A' ' 36' ' ' ARG . 1.0 OUTLIER -34.01 134.44 0.18 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.213 -0.448 . . . . 54.43 110.95 179.928 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER 71.03 -78.24 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.213 -0.449 . . . . 72.0 110.839 -179.85 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 39' ' ' SER . . . . . 0.405 ' O ' ' O ' ' A' ' 36' ' ' ARG . 6.2 m -64.62 -175.68 0.2 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.156 -0.474 . . . . 51.24 110.884 -179.806 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 40' ' ' TRP . . . . . . . . . . . . . 34.7 t-105 -95.51 -44.9 7.31 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.167 -0.469 . . . . 75.21 110.956 179.979 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -179.34 131.81 0.11 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.21 -0.45 . . . . 74.24 110.859 179.919 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 42' ' ' LYS . . . . . 0.431 ' C ' ' CD ' ' A' ' 44' ' ' PRO . 0.1 OUTLIER -129.23 -89.6 0.5 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.21 -0.45 . . . . 70.54 110.876 -179.968 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 43' ' ' GLN . . . . . 0.487 ' N ' ' CD ' ' A' ' 44' ' ' PRO . 2.9 mt-30 -119.28 50.81 1.49 Allowed Pre-proline 0 C--N 1.329 -0.293 0 CA-C-O 121.616 0.722 . . . . 73.22 110.908 179.981 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 44' ' ' PRO . . . . . 0.487 ' CD ' ' N ' ' A' ' 43' ' ' GLN . 53.4 Cg_endo -69.74 144.96 55.82 Favored 'Trans proline' 0 C--N 1.342 0.22 0 C-N-CA 122.675 2.25 . . . . 53.2 112.319 -179.985 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 45' ' ' GLN . . . . . 0.614 ' HB3' HD12 ' A' ' 47' ' ' ILE . 12.4 tt0 -121.99 6.3 9.82 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.185 -0.461 . . . . 73.34 110.957 179.951 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 46' ' ' ILE . . . . . 0.576 HG22 ' O ' ' A' ' 45' ' ' GLN . 0.0 OUTLIER 84.1 -28.26 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.147 -0.479 . . . . 72.43 111.134 179.958 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 47' ' ' ILE . . . . . 0.952 HG12 HD21 ' A' ' 33' ' ' LEU . 0.2 OUTLIER -43.32 148.3 0.21 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.157 -0.474 . . . . 74.21 111.12 179.866 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 48' ' ' PHE . . . . . 0.768 ' HA ' HD22 ' A' ' 33' ' ' LEU . 5.8 p90 -156.53 158.05 36.48 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.197 -0.456 . . . . 70.02 110.909 179.933 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 49' ' ' GLU . . . . . 0.701 ' CG ' HD13 ' A' ' 33' ' ' LEU . 40.1 mt-10 -108.99 152.0 25.56 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.128 -0.487 . . . . 73.23 110.846 -179.891 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 50' ' ' ILE . . . . . 0.458 HD13 ' HA ' ' A' ' 30' ' ' PHE . 23.2 mm -131.46 137.03 56.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.157 -0.474 . . . . 71.42 111.101 179.963 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 75.9 m -84.67 124.3 31.33 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.164 -0.471 . . . . 73.35 111.104 179.974 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 52' ' ' LEU . . . . . 0.63 HD12 HD22 ' A' ' 66' ' ' LEU . 20.7 mt -126.8 159.55 33.49 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.222 -0.445 . . . . 61.34 110.886 179.95 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 53' ' ' ARG . . . . . 0.517 ' C ' HD21 ' A' ' 125' ' ' LEU . 0.1 OUTLIER -179.88 168.23 1.31 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.166 -0.47 . . . . 74.45 110.931 179.944 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 54' ' ' SER . . . . . 0.659 ' N ' HD21 ' A' ' 125' ' ' LEU . 16.3 p -56.14 -173.26 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.22 -0.445 . . . . 44.42 110.869 -179.808 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 18.1 m -94.21 -28.1 4.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.135 -0.484 . . . . 74.2 111.105 179.94 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 1.6 t0 -121.55 -164.07 1.11 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.224 -0.444 . . . . 71.53 110.862 179.966 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 3.1 mmmm -118.39 -12.88 9.82 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.196 -0.456 . . . . 72.42 110.89 179.987 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 58' ' ' GLU . . . . . 0.563 ' HA ' ' C ' ' A' ' 59' ' ' PRO . 68.1 mt-10 -121.38 145.51 42.61 Favored Pre-proline 0 C--N 1.329 -0.287 0 CA-C-O 121.636 0.732 . . . . 73.04 110.895 179.972 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 59' ' ' PRO . . . . . 0.563 ' C ' ' HA ' ' A' ' 58' ' ' GLU . 53.7 Cg_endo -69.75 -9.42 10.98 Favored 'Cis proline' 0 C--O 1.231 0.172 0 C-N-CA 122.701 -1.791 . . . . 73.1 112.326 0.035 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 60' ' ' VAL . . . . . 0.641 HG22 ' CG ' ' A' ' 129' ' ' GLN . 21.7 m -146.31 178.96 1.06 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.241 -0.436 . . . . 75.33 111.134 179.91 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 61' ' ' GLU . . . . . 0.458 ' O ' ' C ' ' A' ' 62' ' ' SER . 15.2 tt0 -108.04 -18.43 13.79 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.169 -0.469 . . . . 65.0 110.886 -179.933 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 62' ' ' SER . . . . . 0.458 ' C ' ' O ' ' A' ' 61' ' ' GLU . 0.9 OUTLIER 33.8 77.56 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.167 -0.47 . . . . 61.02 110.87 -179.794 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -102.87 126.76 50.15 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.143 -0.48 . . . . 63.43 110.849 -179.804 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 64' ' ' ILE . . . . . . . . . . . . . 21.1 mt -140.24 143.29 29.88 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 116.175 -0.466 . . . . 70.03 111.102 179.947 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 92.1 m -106.98 118.94 38.02 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.169 -0.469 . . . . 63.24 111.083 179.99 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 66' ' ' LEU . . . . . 0.71 HD21 HG21 ' A' ' 121' ' ' THR . 1.7 mp -100.09 114.0 27.03 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.198 -0.456 . . . . 70.2 110.924 179.913 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 67' ' ' HIS . . . . . 0.492 ' CE1' HD11 ' A' ' 33' ' ' LEU . 7.5 t60 -108.4 113.28 26.22 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.233 -0.44 . . . . 75.43 110.798 179.888 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 68' ' ' PHE . . . . . 0.56 ' CE1' HG23 ' A' ' 114' ' ' ILE . 0.0 OUTLIER -103.98 139.96 38.38 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.197 -0.456 . . . . 74.41 110.866 -179.937 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -119.66 119.46 33.79 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.135 -0.484 . . . . 73.03 111.108 179.94 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 70' ' ' MET . . . . . 0.491 ' CE ' HD11 ' A' ' 114' ' ' ILE . 2.5 mmt -84.25 89.41 7.33 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.223 -0.444 . . . . 74.41 110.919 179.946 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -45.02 157.76 0.32 Allowed Pre-proline 0 C--N 1.33 -0.274 0 CA-C-O 121.583 0.706 . . . . 71.13 111.124 -179.903 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 72' ' ' PRO . . . . . 0.687 ' O ' HD13 ' A' ' 8' ' ' LEU . 54.0 Cg_endo -69.77 2.87 3.15 Favored 'Trans proline' 0 C--N 1.341 0.173 0 C-N-CA 122.643 2.229 . . . . 53.01 112.368 179.899 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 73' ' ' MET . . . . . 0.486 ' O ' ' CB ' ' A' ' 76' ' ' TYR . 0.0 OUTLIER -117.7 -26.38 6.58 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.23 -0.441 . . . . 74.03 110.879 179.918 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 74' ' ' TYR . . . . . 0.637 ' CD1' ' C ' ' A' ' 74' ' ' TYR . 0.0 OUTLIER -47.14 148.71 1.95 Allowed Pre-proline 0 C--N 1.328 -0.327 0 CA-C-O 121.712 0.768 . . . . 64.13 110.915 -179.862 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 75' ' ' PRO . . . . . 0.561 ' C ' ' HA ' ' A' ' 74' ' ' TYR . 54.1 Cg_endo -69.78 -13.46 12.44 Favored 'Cis proline' 0 C--N 1.342 0.185 0 C-N-CA 122.67 -1.804 . . . . 74.14 112.361 -0.009 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 76' ' ' TYR . . . . . 0.486 ' CB ' ' O ' ' A' ' 73' ' ' MET . 9.4 t80 -34.95 -46.3 0.3 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.207 -0.452 . . . . 62.44 110.867 -179.866 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 77' ' ' THR . . . . . 0.449 HG23 ' CB ' ' A' ' 73' ' ' MET . 66.7 p -111.58 177.7 4.57 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.14 -0.482 . . . . 75.45 111.16 -179.953 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -98.33 135.03 21.39 Favored Pre-proline 0 C--N 1.328 -0.327 0 CA-C-O 121.578 0.704 . . . . 72.24 111.058 179.893 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 79' ' ' PRO . . . . . 0.806 ' HG3' HD11 ' A' ' 113' ' ' ILE . 53.5 Cg_endo -69.74 -167.27 0.22 Allowed 'Trans proline' 0 C--N 1.341 0.159 0 C-N-CA 122.667 2.245 . . . . 33.51 112.374 179.97 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -131.09 127.23 37.72 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.259 -0.428 . . . . 51.14 110.853 -179.97 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 81' ' ' ILE . . . . . 0.507 HD13 ' HA ' ' A' ' 68' ' ' PHE . 10.0 mm -119.54 140.59 43.03 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.144 -0.48 . . . . 74.33 111.202 179.9 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 82' ' ' GLU . . . . . 0.471 ' HG3' ' CD ' ' A' ' 84' ' ' LYS . 1.0 OUTLIER -146.27 137.92 24.79 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.229 -0.441 . . . . 71.23 110.908 179.969 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 83' ' ' PHE . . . . . 0.45 ' CD1' HD11 ' A' ' 66' ' ' LEU . 9.9 m-85 -93.48 140.0 30.08 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.158 -0.474 . . . . 71.34 110.871 -179.919 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 84' ' ' LYS . . . . . 0.471 ' CD ' ' HG3' ' A' ' 82' ' ' GLU . 10.6 mmmt -123.78 172.0 9.2 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.14 -0.482 . . . . 74.13 110.914 179.956 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 85' ' ' ASN . . . . . 0.422 ' C ' HG22 ' A' ' 86' ' ' VAL . 4.2 m120 62.8 -74.19 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.23 -0.441 . . . . 74.11 110.947 179.971 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 86' ' ' VAL . . . . . 0.522 HG12 HD21 ' A' ' 94' ' ' LEU . 3.5 m 41.54 91.15 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.158 -0.473 . . . . 74.44 111.078 179.859 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -97.19 -85.72 0.35 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.179 -0.464 . . . . 72.54 110.893 179.979 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -52.58 -46.38 66.87 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.222 -0.444 . . . . 74.3 110.865 -179.943 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 89' ' ' VAL . . . . . 0.479 HG21 ' CD2' ' A' ' 94' ' ' LEU . 0.7 OUTLIER -60.45 141.38 17.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.221 -0.445 . . . . 71.12 111.154 179.926 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 90' ' ' MET . . . . . 0.432 ' C ' ' OD1' ' A' ' 91' ' ' ASP . 7.6 mtm -95.71 -54.76 3.24 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.181 -0.463 . . . . 75.14 110.895 179.979 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 91' ' ' ASP . . . . . 0.432 ' OD1' ' C ' ' A' ' 90' ' ' MET . 1.3 p-10 175.36 -34.58 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.184 -0.462 . . . . 63.5 110.874 179.911 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -54.55 -40.27 68.53 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.238 -0.437 . . . . 74.22 110.826 -179.77 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 93' ' ' GLN . . . . . 0.577 ' HG3' ' CZ ' ' A' ' 128' ' ' PHE . 0.0 OUTLIER -70.98 -37.46 72.74 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.134 -0.484 . . . . 70.43 110.95 -179.979 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 94' ' ' LEU . . . . . 0.522 HD21 HG12 ' A' ' 86' ' ' VAL . 39.5 mt -65.58 -49.21 69.68 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.187 -0.461 . . . . 75.12 110.941 179.95 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 41.2 mt-30 -65.91 -34.02 77.17 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.141 -0.481 . . . . 65.15 110.904 179.937 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 96' ' ' MET . . . . . . . . . . . . . 2.3 ttp -60.08 -41.15 91.83 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.194 -0.457 . . . . 75.23 110.839 -179.971 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 97' ' ' LEU . . . . . 0.855 HD22 HG22 ' A' ' 121' ' ' THR . 34.3 mt -65.99 -39.69 90.52 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.201 -0.454 . . . . 63.43 110.871 -179.941 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 98' ' ' LYS . . . . . 0.411 ' HD3' ' CZ ' ' A' ' 83' ' ' PHE . 3.2 mmtp -55.31 -39.33 69.8 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.19 -0.459 . . . . 74.22 110.892 179.846 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -66.24 -37.84 86.46 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.239 -0.437 . . . . 44.22 110.89 -179.917 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 100' ' ' GLU . . . . . 0.611 ' O ' HD12 ' A' ' 104' ' ' ILE . 2.4 mm-40 -74.14 -24.57 59.44 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.113 -0.494 . . . . 64.24 110.818 -179.924 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 101' ' ' PHE . . . . . 0.621 ' CD2' HD11 ' A' ' 117' ' ' ILE . 10.8 m-30 -59.38 -26.88 65.48 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.222 -0.444 . . . . 73.12 110.935 -179.929 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.27 -42.98 64.97 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.107 -0.497 . . . . 64.51 110.899 179.968 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.76 -40.87 84.0 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.213 -0.449 . . . . 64.34 110.917 179.862 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 104' ' ' ILE . . . . . 0.66 HD11 ' CD2' ' A' ' 120' ' ' PHE . 2.6 mt -63.55 -47.6 90.74 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.225 -0.443 . . . . 72.35 111.111 179.863 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 105' ' ' HIS . . . . . 0.478 ' O ' ' N ' ' A' ' 109' ' ' ARG . 28.2 t-80 -62.89 -42.51 99.8 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.148 -0.478 . . . . 71.51 110.888 179.912 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -56.52 -40.9 75.81 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.164 -0.471 . . . . 74.02 110.865 -179.924 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 107' ' ' THR . . . . . 0.449 HG22 ' O ' ' A' ' 104' ' ' ILE . 8.0 t -80.47 -31.18 37.42 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.222 -0.444 . . . . 55.34 111.146 -179.97 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 108' ' ' SER . . . . . 0.706 ' HB3' HG22 ' A' ' 113' ' ' ILE . 0.5 OUTLIER -103.9 21.91 15.48 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.201 -0.454 . . . . 43.44 110.877 -179.901 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 109' ' ' ARG . . . . . 0.478 ' N ' ' O ' ' A' ' 105' ' ' HIS . 0.0 OUTLIER -62.0 84.9 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.125 -0.488 . . . . 71.34 110.846 -179.93 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 110' ' ' GLY . . . . . 0.443 ' HA2' ' CB ' ' A' ' 75' ' ' PRO . . . 134.19 -23.15 3.7 Favored Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.705 -0.759 . . . . 65.22 112.452 179.988 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 111' ' ' GLN . . . . . . . . . . . . . 2.6 pt20 -109.06 -171.81 1.92 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.757 0.313 . . . . 73.53 110.894 -179.858 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 20.1 mt-10 -66.03 134.55 53.13 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.181 -0.463 . . . . 75.54 110.905 -179.987 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 113' ' ' ILE . . . . . 0.806 HD11 ' HG3' ' A' ' 79' ' ' PRO . 24.8 pt -123.23 -7.8 7.88 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.172 -0.467 . . . . 75.23 111.154 179.915 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 114' ' ' ILE . . . . . 0.83 ' O ' HG23 ' A' ' 118' ' ' THR . 28.6 mm -64.18 -44.19 97.46 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.161 -0.472 . . . . 73.21 111.101 179.865 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 115' ' ' PHE . . . . . 0.716 ' CD1' HD13 ' A' ' 25' ' ' ILE . 28.2 t80 -72.08 -36.9 69.65 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.194 -0.457 . . . . 71.44 110.864 179.99 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 50.2 mm-40 -65.93 -47.63 74.08 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.165 -0.47 . . . . 72.13 110.868 -179.927 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 117' ' ' ILE . . . . . 0.621 HD11 ' CD2' ' A' ' 101' ' ' PHE . 0.9 OUTLIER -64.26 -41.55 92.74 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.19 -0.459 . . . . 51.34 111.127 179.965 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 118' ' ' THR . . . . . 0.83 HG23 ' O ' ' A' ' 114' ' ' ILE . 71.1 p -68.03 -42.55 80.44 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.192 -0.458 . . . . 74.33 111.14 179.975 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 2.8 m -66.88 -43.48 83.4 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.249 -0.432 . . . . 54.25 110.861 -179.859 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 120' ' ' PHE . . . . . 0.66 ' CD2' HD11 ' A' ' 104' ' ' ILE . 0.3 OUTLIER -61.78 -47.65 84.23 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.115 -0.493 . . . . 73.22 110.871 -179.941 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 121' ' ' THR . . . . . 0.855 HG22 HD22 ' A' ' 97' ' ' LEU . 73.4 p -67.81 -40.76 83.83 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.13 -0.486 . . . . 61.14 111.116 -179.893 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 47.6 tt0 -64.3 -48.8 74.26 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.203 -0.453 . . . . 55.35 110.896 -179.94 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 123' ' ' GLU . . . . . 0.54 ' CG ' ' N ' ' A' ' 124' ' ' LYS . 3.5 pt-20 -61.84 -50.54 71.85 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.194 -0.457 . . . . 74.24 110.855 -179.929 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 124' ' ' LYS . . . . . 0.54 ' N ' ' CG ' ' A' ' 123' ' ' GLU . 0.0 OUTLIER -65.6 -37.18 85.88 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.159 -0.473 . . . . 63.34 110.871 -179.991 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 125' ' ' LEU . . . . . 0.659 HD21 ' N ' ' A' ' 54' ' ' SER . 1.1 tp -64.34 -51.5 63.09 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.249 -0.432 . . . . 71.54 110.912 179.901 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -57.2 -45.4 83.82 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.212 -0.449 . . . . 62.41 110.878 179.86 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 127' ' ' GLU . . . . . 0.448 ' HG3' ' N ' ' A' ' 128' ' ' PHE . 0.4 OUTLIER -61.27 -29.39 69.82 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.218 -0.446 . . . . 74.22 110.851 -179.885 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 128' ' ' PHE . . . . . 0.577 ' CZ ' ' HG3' ' A' ' 93' ' ' GLN . 0.3 OUTLIER -61.05 -69.04 0.25 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.18 -0.463 . . . . 71.31 110.863 -179.942 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 129' ' ' GLN . . . . . 0.641 ' CG ' HG22 ' A' ' 60' ' ' VAL . 0.9 OUTLIER -34.38 -37.01 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.155 -0.475 . . . . 74.14 110.902 -179.906 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 130' ' ' ASN . . . . . 0.42 ' N ' ' O ' ' A' ' 128' ' ' PHE . 2.5 t-20 -69.17 -48.47 62.11 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.247 -0.433 . . . . 61.22 110.859 -179.967 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 131' ' ' VAL . . . . . 0.489 ' N ' ' O ' ' A' ' 128' ' ' PHE . 4.4 m -126.45 80.23 0.67 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.144 -0.48 . . . . 75.45 111.109 179.97 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 132' ' ' VAL . . . . . . . . . . . . . 7.9 p -115.82 141.83 31.55 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.177 -0.465 . . . . 64.24 111.161 179.911 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 133' ' ' ASN . . . . . . . . . . . . . 34.1 t30 -69.78 82.06 0.45 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.214 -0.448 . . . . 64.4 110.841 -179.963 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 134' ' ' THR . . . . . . . . . . . . . 14.8 t -64.52 152.34 42.09 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.211 -0.45 . . . . 65.04 111.107 -179.97 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 27.9 tt0 -154.55 -39.44 0.09 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.24 -0.436 . . . . 62.43 110.883 -179.999 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 55.1 m 60.97 149.97 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.215 -0.448 . . . . 74.22 110.841 -179.803 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 137' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER 43.4 87.86 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.142 -0.481 . . . . 72.34 110.874 179.985 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--N 1.33 -0.264 0 CA-C-N 116.188 -0.46 . . . . 63.24 110.898 179.905 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.231 0.079 0 CA-C-O 120.753 0.311 . . . . 61.14 110.922 . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 19.4 t -105.78 86.95 2.48 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.208 -0.451 . . . . 72.3 110.867 -179.764 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -120.17 -175.95 3.1 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.135 -0.484 . . . . 64.25 110.932 -179.985 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 3.6 m -111.44 120.88 43.64 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.242 -0.436 . . . . 71.44 110.874 -179.946 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 5' ' ' HIS . . . . . 0.419 ' NE2' ' CE1' ' A' ' 11' ' ' TYR . 23.6 t-80 -80.29 109.1 14.45 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.112 -0.495 . . . . 74.42 110.862 179.987 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -155.73 -48.95 0.08 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.225 -0.443 . . . . 71.14 110.935 -179.97 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 7' ' ' THR . . . . . 0.415 ' CG2' ' HB3' ' A' ' 9' ' ' ASP . 12.2 t -86.56 162.65 17.9 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.228 -0.442 . . . . 74.1 111.173 179.89 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.532 HD13 ' O ' ' A' ' 72' ' ' PRO . 24.4 mt -68.73 -26.19 65.12 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.193 -0.458 . . . . 61.24 110.93 179.964 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 9' ' ' ASP . . . . . 0.415 ' HB3' ' CG2' ' A' ' 7' ' ' THR . 0.1 OUTLIER -49.93 -34.08 19.47 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.195 -0.457 . . . . 73.12 110.868 179.794 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 7.0 mm100 -68.11 -39.26 82.84 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.181 -0.463 . . . . 53.52 110.847 -179.863 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 11' ' ' TYR . . . . . 0.419 ' CE1' ' NE2' ' A' ' 5' ' ' HIS . 18.2 m-85 -58.9 -27.41 65.2 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.229 -0.441 . . . . 70.41 110.927 -179.858 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -60.72 -37.12 80.66 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.146 -0.479 . . . . 74.12 110.907 -179.906 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 3.1 mm-40 -58.58 -43.35 89.44 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.142 -0.481 . . . . 72.12 110.901 179.974 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 3.1 mp -66.06 -43.02 92.56 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.123 -0.489 . . . . 75.11 111.157 179.963 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 15' ' ' GLN . . . . . 0.49 ' HB3' HG21 ' A' ' 46' ' ' ILE . 73.0 mt-30 -62.62 -42.2 99.45 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.165 -0.47 . . . . 71.32 110.907 179.943 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -61.1 -42.02 97.76 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.187 -0.46 . . . . 73.23 110.89 -179.948 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 1.5 m-20 -59.04 -33.72 71.08 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.165 -0.47 . . . . 43.43 110.9 -179.889 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 1.7 mt-10 -64.74 -37.89 89.15 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.18 -0.464 . . . . 73.24 110.866 -179.966 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.407 ' CD2' HG13 ' A' ' 46' ' ' ILE . 7.2 mp -66.15 -51.61 56.27 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.159 -0.473 . . . . 73.33 110.93 -179.989 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -68.74 -33.35 73.76 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.171 -0.468 . . . . 73.52 110.925 179.923 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -66.44 -50.57 62.92 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.109 -0.496 . . . . 63.33 111.121 179.919 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 22' ' ' ILE . . . . . 0.75 HD11 ' HB2' ' A' ' 115' ' ' PHE . 0.5 OUTLIER -73.37 -37.15 50.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.201 -0.454 . . . . 72.52 111.176 179.968 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 30.8 mtp180 -52.79 -34.5 53.72 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.131 -0.486 . . . . 71.4 110.918 179.937 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -66.75 -31.2 71.69 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.187 -0.461 . . . . 61.2 110.844 -179.799 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 25' ' ' ILE . . . . . 0.771 HG21 ' HE1' ' A' ' 115' ' ' PHE . 3.5 mt -85.08 -44.5 17.33 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.142 -0.481 . . . . 52.34 111.123 179.926 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 27.7 m-85 -107.06 42.76 1.25 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.202 -0.453 . . . . 74.34 110.888 -179.925 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 1.9 mtm -41.29 -45.82 3.06 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.096 -0.502 . . . . 65.35 110.902 179.891 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -101.68 -14.23 17.46 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.202 -0.453 . . . . 70.2 110.878 179.928 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 3.1 m-20 -97.66 21.03 10.92 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.182 -0.463 . . . . 72.52 110.873 179.984 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 30' ' ' PHE . . . . . 0.75 ' HA ' HD13 ' A' ' 50' ' ' ILE . 5.4 t80 -109.87 137.23 47.95 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.204 -0.453 . . . . 73.31 110.878 -179.916 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 59.3 m -116.51 134.8 54.43 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.134 -0.485 . . . . 70.31 111.156 -179.914 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 32' ' ' ASP . . . . . 0.456 ' O ' ' CG ' ' A' ' 32' ' ' ASP . 0.0 OUTLIER -99.22 117.34 33.47 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.225 -0.443 . . . . 74.42 110.867 179.89 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.916 HD21 HG12 ' A' ' 47' ' ' ILE . 0.2 OUTLIER -121.19 -21.4 6.42 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.194 -0.457 . . . . 71.24 110.918 -179.972 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 34' ' ' THR . . . . . 0.896 ' N ' HD23 ' A' ' 33' ' ' LEU . 0.6 OUTLIER -45.76 153.02 0.3 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.204 -0.453 . . . . 71.12 111.108 179.918 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -91.48 67.41 5.6 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.175 -0.466 . . . . 73.51 110.943 179.835 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 36' ' ' ARG . . . . . 0.409 ' CG ' ' HB ' ' A' ' 34' ' ' THR . 0.0 OUTLIER -116.71 152.52 34.14 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.233 -0.439 . . . . 70.22 110.854 -179.975 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 37' ' ' LYS . . . . . 0.402 ' O ' ' O ' ' A' ' 38' ' ' SER . 2.0 mmpt? 54.85 -92.57 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.19 -0.459 . . . . 73.45 110.947 179.977 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 38' ' ' SER . . . . . 0.402 ' O ' ' O ' ' A' ' 37' ' ' LYS . 0.2 OUTLIER -52.29 -172.86 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.192 -0.458 . . . . 72.21 110.859 -179.936 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 3.1 m 75.64 -173.76 0.11 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.133 -0.485 . . . . 71.41 110.86 -179.811 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 40' ' ' TRP . . . . . . . . . . . . . 34.1 p90 -114.71 -4.04 12.78 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.143 -0.48 . . . . 70.01 110.911 -179.981 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -132.79 157.37 45.15 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.222 -0.444 . . . . 62.15 110.872 179.924 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 42' ' ' LYS . . . . . 0.431 ' C ' ' CD ' ' A' ' 44' ' ' PRO . 0.0 OUTLIER -121.28 72.88 1.01 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.191 -0.458 . . . . 63.24 110.877 179.993 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 43' ' ' GLN . . . . . 0.552 ' N ' ' CD ' ' A' ' 44' ' ' PRO . 0.8 OUTLIER -120.51 47.96 1.22 Allowed Pre-proline 0 C--N 1.329 -0.313 0 CA-C-O 121.577 0.703 . . . . 75.13 110.95 179.935 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 44' ' ' PRO . . . . . 0.552 ' CD ' ' N ' ' A' ' 43' ' ' GLN . 54.0 Cg_endo -69.74 128.32 15.87 Favored 'Trans proline' 0 C--N 1.341 0.171 0 C-N-CA 122.656 2.237 . . . . 74.24 112.34 -179.998 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 45' ' ' GLN . . . . . 0.567 ' O ' HG22 ' A' ' 46' ' ' ILE . 15.7 tt0 -107.79 11.46 28.2 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.24 -0.436 . . . . 70.12 110.908 179.999 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 46' ' ' ILE . . . . . 0.567 HG22 ' O ' ' A' ' 45' ' ' GLN . 0.2 OUTLIER 83.57 -29.55 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.21 -0.45 . . . . 73.44 111.163 -179.991 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 47' ' ' ILE . . . . . 0.916 HG12 HD21 ' A' ' 33' ' ' LEU . 0.2 OUTLIER -45.1 146.14 0.44 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.151 -0.477 . . . . 63.2 111.145 179.827 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 48' ' ' PHE . . . . . 0.854 ' HA ' HD22 ' A' ' 33' ' ' LEU . 5.3 p90 -150.82 163.09 39.47 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.157 -0.474 . . . . 55.01 110.881 179.964 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 49' ' ' GLU . . . . . 0.818 ' HG3' HD13 ' A' ' 33' ' ' LEU . 33.5 mt-10 -108.87 149.57 28.93 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.147 -0.478 . . . . 60.14 110.863 -179.9 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 50' ' ' ILE . . . . . 0.75 HD13 ' HA ' ' A' ' 30' ' ' PHE . 6.2 mm -131.74 136.27 57.35 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.138 -0.483 . . . . 65.23 111.098 179.982 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 50.7 m -83.75 130.96 34.95 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.172 -0.467 . . . . 54.21 111.157 179.947 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 52' ' ' LEU . . . . . 0.673 HD12 HD12 ' A' ' 66' ' ' LEU . 12.6 mt -133.46 156.44 47.73 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.221 -0.445 . . . . 73.23 110.898 179.962 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -175.09 168.06 3.45 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.207 -0.451 . . . . 71.31 110.916 179.977 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 1.7 m -60.88 168.21 2.47 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.207 -0.452 . . . . 74.53 110.859 -179.837 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 35.0 m -80.54 -29.58 12.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.137 -0.483 . . . . 74.31 111.089 179.943 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -114.56 -169.69 1.59 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.214 -0.448 . . . . 44.2 110.873 179.944 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 5.1 mmmt -115.64 -21.93 9.45 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.2 -0.455 . . . . 73.53 110.92 179.998 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 58' ' ' GLU . . . . . 0.548 ' HA ' ' C ' ' A' ' 59' ' ' PRO . 8.3 pt-20 -113.6 144.49 31.47 Favored Pre-proline 0 C--N 1.33 -0.258 0 CA-C-O 121.65 0.738 . . . . 54.03 110.913 179.932 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 59' ' ' PRO . . . . . 0.548 ' C ' ' HA ' ' A' ' 58' ' ' GLU . 53.6 Cg_endo -69.77 -7.39 9.97 Favored 'Cis proline' 0 C--N 1.341 0.144 0 C-N-CA 122.646 -1.814 . . . . 75.31 112.348 -0.036 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 60' ' ' VAL . . . . . 0.641 HG22 ' HG2' ' A' ' 129' ' ' GLN . 13.2 m -154.37 -179.92 0.3 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.176 -0.465 . . . . 74.31 111.122 179.877 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 61' ' ' GLU . . . . . 0.464 ' O ' ' C ' ' A' ' 62' ' ' SER . 1.2 pt-20 -112.83 -16.25 12.77 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.171 -0.468 . . . . 62.32 110.909 -179.953 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 62' ' ' SER . . . . . 0.464 ' C ' ' O ' ' A' ' 61' ' ' GLU . 0.3 OUTLIER 33.14 91.54 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.126 -0.488 . . . . 52.03 110.867 -179.825 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 3.9 m -102.93 123.13 45.97 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.106 -0.497 . . . . 60.42 110.88 -179.832 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 64' ' ' ILE . . . . . 0.602 HD13 HD11 ' A' ' 94' ' ' LEU . 13.9 mt -138.15 150.94 24.74 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.142 -0.481 . . . . 73.04 111.156 179.944 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 65' ' ' THR . . . . . 0.573 HG23 ' O ' ' A' ' 50' ' ' ILE . 39.1 m -120.89 115.17 22.71 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.18 -0.464 . . . . 71.03 111.124 179.942 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 66' ' ' LEU . . . . . 0.716 HD11 HG21 ' A' ' 121' ' ' THR . 19.2 mt -90.95 110.77 22.02 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.192 -0.458 . . . . 54.22 110.944 179.96 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 9.1 t60 -100.92 114.52 28.46 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.21 -0.45 . . . . 74.33 110.855 179.892 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 68' ' ' PHE . . . . . 0.579 ' CG ' HD12 ' A' ' 114' ' ' ILE . 0.0 OUTLIER -105.17 141.13 37.26 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.195 -0.457 . . . . 73.4 110.885 -179.953 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -120.5 117.14 26.89 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.133 -0.485 . . . . 63.35 111.066 179.94 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 70' ' ' MET . . . . . 0.451 ' HE2' HD11 ' A' ' 114' ' ' ILE . 1.4 mmt -84.11 93.72 8.19 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.192 -0.458 . . . . 70.13 110.881 179.986 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -51.13 159.2 1.08 Allowed Pre-proline 0 C--N 1.329 -0.283 0 CA-C-O 121.582 0.706 . . . . 71.14 111.154 -179.922 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 72' ' ' PRO . . . . . 0.532 ' O ' HD13 ' A' ' 8' ' ' LEU . 53.9 Cg_endo -69.72 -4.5 14.12 Favored 'Trans proline' 0 C--O 1.231 0.174 0 C-N-CA 122.711 2.274 . . . . 65.02 112.339 179.973 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 73' ' ' MET . . . . . 0.527 ' HB3' HG23 ' A' ' 77' ' ' THR . 0.0 OUTLIER -109.28 -24.21 11.2 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.203 -0.453 . . . . 72.3 110.852 179.942 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 74' ' ' TYR . . . . . 0.651 ' CD1' ' C ' ' A' ' 74' ' ' TYR . 0.0 OUTLIER -48.29 150.75 2.1 Favored Pre-proline 0 C--N 1.328 -0.342 0 CA-C-O 121.688 0.756 . . . . 62.43 110.931 -179.859 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 75' ' ' PRO . . . . . 0.556 ' C ' ' HA ' ' A' ' 74' ' ' TYR . 54.2 Cg_endo -69.72 -11.69 11.89 Favored 'Cis proline' 0 C--N 1.341 0.171 0 C-N-CA 122.698 -1.792 . . . . 72.21 112.367 -0.124 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 76' ' ' TYR . . . . . 0.476 ' CB ' ' O ' ' A' ' 73' ' ' MET . 10.4 t80 -35.27 -52.88 0.62 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.221 -0.445 . . . . 64.01 110.969 -179.943 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 77' ' ' THR . . . . . 0.527 HG23 ' HB3' ' A' ' 73' ' ' MET . 53.2 p -101.39 175.3 5.62 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.087 -0.506 . . . . 75.51 111.139 -179.961 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -98.86 131.36 25.74 Favored Pre-proline 0 C--N 1.329 -0.288 0 CA-C-O 121.554 0.692 . . . . 72.14 111.079 179.884 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 79' ' ' PRO . . . . . 0.747 ' HG3' HD11 ' A' ' 113' ' ' ILE . 53.7 Cg_endo -69.77 176.84 6.23 Favored 'Trans proline' 0 C--N 1.341 0.171 0 C-N-CA 122.668 2.246 . . . . 74.05 112.369 179.957 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 2.0 tt0 -111.66 133.44 53.91 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.234 -0.439 . . . . 70.31 110.951 179.996 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 81' ' ' ILE . . . . . 0.473 HD13 ' HA ' ' A' ' 68' ' ' PHE . 10.0 mm -124.08 127.25 73.37 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.157 -0.474 . . . . 61.54 111.182 179.988 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 82' ' ' GLU . . . . . 0.478 ' HG3' ' CD ' ' A' ' 84' ' ' LYS . 7.3 pt-20 -135.07 142.13 46.24 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.22 -0.445 . . . . 74.14 110.902 179.975 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 83' ' ' PHE . . . . . 0.663 ' CE1' HD21 ' A' ' 66' ' ' LEU . 31.1 m-85 -93.23 140.88 29.04 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.165 -0.471 . . . . 71.22 110.839 -179.884 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 84' ' ' LYS . . . . . 0.478 ' CD ' ' HG3' ' A' ' 82' ' ' GLU . 9.7 mmmt -123.66 170.36 10.55 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.137 -0.483 . . . . 53.53 110.936 179.964 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 85' ' ' ASN . . . . . 0.44 ' O ' ' C ' ' A' ' 86' ' ' VAL . 6.1 m120 62.92 -73.38 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.22 -0.446 . . . . 73.31 110.891 179.946 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 86' ' ' VAL . . . . . 1.096 HG11 HD21 ' A' ' 94' ' ' LEU . 6.4 m 34.94 90.67 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.131 -0.486 . . . . 75.1 111.166 179.942 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -101.92 -84.74 0.44 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.17 -0.468 . . . . 72.4 110.911 -179.954 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 88' ' ' ASN . . . . . 0.479 ' ND2' ' HB ' ' A' ' 60' ' ' VAL . 27.8 m120 -49.5 -40.21 36.72 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.185 -0.461 . . . . 74.35 110.856 -179.913 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 89' ' ' VAL . . . . . 0.813 HG21 HD13 ' A' ' 94' ' ' LEU . 2.4 p -68.17 139.08 21.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.167 -0.47 . . . . 43.21 111.119 179.909 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 90' ' ' MET . . . . . . . . . . . . . 5.4 mtm -87.22 -67.43 0.82 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.155 -0.475 . . . . 73.45 110.892 179.91 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -178.77 -30.44 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.21 -0.45 . . . . 73.33 110.832 179.954 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -53.79 -42.72 68.63 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.198 -0.456 . . . . 74.3 110.861 -179.775 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -69.92 -40.11 75.73 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.136 -0.484 . . . . 73.45 110.94 -179.985 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 94' ' ' LEU . . . . . 1.096 HD21 HG11 ' A' ' 86' ' ' VAL . 0.1 OUTLIER -59.52 -46.3 89.26 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.208 -0.451 . . . . 63.4 110.95 179.997 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 9.9 mm-40 -64.89 -38.88 92.45 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.129 -0.487 . . . . 64.54 110.951 179.907 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 96' ' ' MET . . . . . 0.561 ' SD ' ' CE1' ' A' ' 128' ' ' PHE . 19.8 ttp -61.06 -36.96 80.99 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.178 -0.465 . . . . 64.41 110.856 179.965 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 97' ' ' LEU . . . . . 1.015 HD22 HG22 ' A' ' 121' ' ' THR . 90.3 mt -62.2 -42.45 99.3 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.221 -0.445 . . . . 54.24 110.902 -179.942 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 98' ' ' LYS . . . . . 0.578 ' HA ' ' CD2' ' A' ' 101' ' ' PHE . 13.2 mmtm -54.86 -44.56 74.11 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.181 -0.463 . . . . 72.22 110.872 179.845 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 66.3 m -57.63 -39.23 76.5 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.253 -0.43 . . . . 60.13 110.836 -179.897 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 100' ' ' GLU . . . . . 0.569 ' O ' HD12 ' A' ' 104' ' ' ILE . 3.6 mm-40 -71.36 -26.67 62.9 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.177 -0.465 . . . . 72.4 110.879 -179.928 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 101' ' ' PHE . . . . . 0.591 ' CD1' ' O ' ' A' ' 97' ' ' LEU . 8.7 m-30 -59.38 -30.36 68.37 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.147 -0.479 . . . . 65.44 110.937 -179.963 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 1.4 tmpt? -71.56 -40.76 69.77 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.113 -0.494 . . . . 75.53 110.882 179.98 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 3.2 tmmm? -70.35 -43.25 70.57 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.227 -0.442 . . . . 65.22 110.88 179.913 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 104' ' ' ILE . . . . . 0.569 HD12 ' O ' ' A' ' 100' ' ' GLU . 3.0 mt -62.36 -47.5 92.74 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.202 -0.454 . . . . 72.42 111.159 179.861 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 105' ' ' HIS . . . . . 0.409 ' O ' ' N ' ' A' ' 109' ' ' ARG . 14.4 t-80 -62.53 -41.78 99.09 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.151 -0.477 . . . . 72.41 110.874 179.851 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 1.1 t-20 -58.03 -42.35 85.13 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.218 -0.446 . . . . 73.34 110.902 -179.978 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 107' ' ' THR . . . . . 0.457 HG22 ' O ' ' A' ' 104' ' ' ILE . 8.0 t -77.95 -35.55 50.24 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.157 -0.474 . . . . 71.32 111.159 -179.996 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 108' ' ' SER . . . . . 0.524 ' HB2' HG22 ' A' ' 113' ' ' ILE . 19.8 m -103.97 29.96 5.51 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.21 -0.45 . . . . 73.33 110.865 -179.871 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 109' ' ' ARG . . . . . 0.409 ' N ' ' O ' ' A' ' 105' ' ' HIS . 26.1 ttt180 -72.13 80.64 0.96 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.133 -0.485 . . . . 60.14 110.872 -179.956 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 141.15 -9.23 2.72 Favored Glycine 0 N--CA 1.452 -0.254 0 C-N-CA 120.699 -0.763 . . . . 44.44 112.477 -179.971 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 111' ' ' GLN . . . . . . . . . . . . . 9.2 pt20 -126.44 -161.68 1.08 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.761 0.315 . . . . 52.22 110.921 -179.873 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 33.7 mt-10 -70.86 134.22 47.12 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.219 -0.446 . . . . 72.53 110.862 -179.95 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 113' ' ' ILE . . . . . 0.747 HD11 ' HG3' ' A' ' 79' ' ' PRO . 31.1 pt -126.65 -11.31 4.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.149 -0.478 . . . . 24.33 111.161 179.972 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 114' ' ' ILE . . . . . 0.776 ' O ' HG23 ' A' ' 118' ' ' THR . 33.7 mm -61.87 -45.72 98.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.156 -0.475 . . . . 53.3 111.136 179.855 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 115' ' ' PHE . . . . . 0.771 ' HE1' HG21 ' A' ' 25' ' ' ILE . 13.1 t80 -72.51 -32.65 66.32 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.171 -0.468 . . . . 74.44 110.932 179.9 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 42.9 mm-40 -67.45 -47.65 69.53 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.105 -0.498 . . . . 43.3 110.901 -179.971 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 117' ' ' ILE . . . . . 0.478 ' CG2' ' N ' ' A' ' 118' ' ' THR . 0.8 OUTLIER -64.15 -41.92 93.95 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.142 -0.481 . . . . 71.43 111.111 179.979 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 118' ' ' THR . . . . . 0.776 HG23 ' O ' ' A' ' 114' ' ' ILE . 46.7 p -67.85 -42.43 81.37 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.201 -0.454 . . . . 71.23 111.158 179.958 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 6.8 m -66.14 -43.96 85.54 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.245 -0.434 . . . . 70.42 110.838 -179.842 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 120' ' ' PHE . . . . . 0.506 ' CG ' HD11 ' A' ' 104' ' ' ILE . 0.2 OUTLIER -62.11 -49.97 73.8 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.161 -0.472 . . . . 73.33 110.883 -179.979 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 121' ' ' THR . . . . . 1.015 HG22 HD22 ' A' ' 97' ' ' LEU . 53.5 p -63.28 -39.3 94.21 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.141 -0.481 . . . . 61.45 111.169 -179.96 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -64.49 -46.33 83.49 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.201 -0.454 . . . . 72.34 110.945 179.999 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 4.8 pt-20 -70.99 -38.19 72.71 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.219 -0.446 . . . . 73.45 110.842 -179.968 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 124' ' ' LYS . . . . . 0.441 ' HA ' ' CE ' ' A' ' 124' ' ' LYS . 0.2 OUTLIER -74.51 -29.93 61.59 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.218 -0.446 . . . . 53.42 110.902 -179.999 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 125' ' ' LEU . . . . . 0.847 ' O ' HD12 ' A' ' 125' ' ' LEU . 0.9 OUTLIER -68.34 -46.36 70.38 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.221 -0.445 . . . . 74.22 110.92 179.945 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 6.4 m-20 -59.84 -37.43 79.23 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.214 -0.448 . . . . 70.24 110.85 179.819 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 3.0 mm-40 -60.41 -49.74 76.36 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.198 -0.455 . . . . 72.24 110.947 -179.931 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 128' ' ' PHE . . . . . 0.561 ' CE1' ' SD ' ' A' ' 96' ' ' MET . 11.3 m-85 -65.85 -58.39 5.71 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.124 -0.489 . . . . 73.1 110.856 -179.949 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 129' ' ' GLN . . . . . 0.641 ' HG2' HG22 ' A' ' 60' ' ' VAL . 1.3 tm0? -45.43 -30.91 1.49 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.119 -0.491 . . . . 63.43 110.922 -179.911 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 130' ' ' ASN . . . . . . . . . . . . . 2.0 t-20 -66.6 -70.67 0.23 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.179 -0.464 . . . . 72.31 110.846 -179.958 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 4.5 p 177.15 -37.43 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.173 -0.467 . . . . 52.21 111.127 179.947 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 132' ' ' VAL . . . . . . . . . . . . . 54.5 t 63.31 93.73 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.141 -0.482 . . . . 74.44 111.123 179.946 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 133' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -157.42 158.89 36.7 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.183 -0.462 . . . . 65.13 110.881 179.981 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 134' ' ' THR . . . . . . . . . . . . . 75.6 p -76.36 87.23 3.14 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.178 -0.464 . . . . 61.43 111.125 -179.947 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 30.0 tt0 -156.8 -57.67 0.09 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.237 -0.438 . . . . 61.02 110.924 179.982 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 46.8 t -129.51 131.82 46.73 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.21 -0.45 . . . . 73.11 110.898 -179.818 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 137' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -165.11 160.28 18.59 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.162 -0.472 . . . . 65.02 110.87 179.985 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 24.7 tt0 . . . . . 0 C--N 1.33 -0.259 0 CA-C-N 116.145 -0.479 . . . . 75.11 110.933 179.913 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.231 0.11 0 CA-C-O 120.779 0.323 . . . . 61.54 110.854 . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -139.73 70.33 1.36 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.26 -0.427 . . . . 74.45 110.9 -179.787 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 2.0 mm? 61.04 83.14 0.15 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.141 -0.481 . . . . 74.02 110.949 -179.964 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 25.2 t -151.65 92.3 1.74 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.188 -0.46 . . . . 72.3 110.864 -179.892 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 5' ' ' HIS . . . . . 0.412 ' O ' ' CG ' ' A' ' 5' ' ' HIS . 3.3 p-80 -109.37 125.29 52.22 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.189 -0.46 . . . . 71.1 110.826 179.967 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -142.19 -48.61 0.36 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.171 -0.468 . . . . 54.13 110.976 179.981 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 5.5 t -104.55 160.01 15.28 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.158 -0.473 . . . . 64.44 111.116 179.922 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 44.2 mt -66.13 -23.98 66.59 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.186 -0.461 . . . . 62.51 110.93 179.921 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -49.96 -30.6 10.72 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.217 -0.447 . . . . 73.14 110.847 179.863 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 5.1 mm100 -68.09 -40.01 82.72 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.213 -0.449 . . . . 73.05 110.884 -179.902 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 22.8 m-85 -61.9 -26.95 68.47 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.197 -0.456 . . . . 74.33 110.88 -179.805 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -58.96 -37.66 77.28 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.158 -0.474 . . . . 72.11 110.937 -179.958 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 2.2 mm-40 -63.07 -42.9 99.78 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.167 -0.47 . . . . 71.31 110.877 -179.97 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 3.8 mp -65.92 -41.99 91.03 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.163 -0.471 . . . . 73.23 111.126 179.989 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 15' ' ' GLN . . . . . 0.444 ' HB3' HG21 ' A' ' 46' ' ' ILE . 47.5 mt-30 -65.42 -44.02 88.68 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.199 -0.455 . . . . 73.23 110.897 179.944 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 1.7 t -62.35 -38.29 88.93 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.203 -0.453 . . . . 75.15 110.924 -179.952 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 1.6 m-20 -58.08 -33.9 69.56 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.126 -0.488 . . . . 65.41 110.896 -179.921 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 4.1 mt-10 -67.14 -39.1 86.51 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.165 -0.471 . . . . 73.11 110.859 -179.946 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.438 ' CD2' HG13 ' A' ' 46' ' ' ILE . 8.7 mp -63.87 -51.25 65.48 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.203 -0.453 . . . . 53.13 110.869 -179.941 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -68.51 -35.84 78.04 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.184 -0.462 . . . . 73.33 110.886 179.938 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -66.64 -50.36 63.21 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.133 -0.485 . . . . 74.43 111.137 179.907 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 22' ' ' ILE . . . . . 0.525 ' HA ' HD12 ' A' ' 25' ' ' ILE . 0.8 OUTLIER -73.12 -34.67 45.73 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.235 -0.439 . . . . 74.12 111.132 179.927 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -52.8 -35.46 56.91 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.17 -0.468 . . . . 64.11 110.891 179.977 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 53.3 p -67.18 -31.44 71.84 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.155 -0.475 . . . . 54.12 110.855 -179.782 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 25' ' ' ILE . . . . . 0.708 HD13 ' CE1' ' A' ' 115' ' ' PHE . 3.5 mt -83.84 -44.16 18.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.134 -0.484 . . . . 65.32 111.119 179.954 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 26' ' ' TYR . . . . . 0.44 ' CD2' HD12 ' A' ' 50' ' ' ILE . 19.8 m-85 -106.7 45.68 0.97 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.174 -0.466 . . . . 71.11 110.941 -179.982 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER -46.7 -54.88 8.73 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.117 -0.492 . . . . 74.41 110.9 179.919 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -96.49 -11.79 25.06 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.198 -0.456 . . . . 75.43 110.882 179.975 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -101.86 25.79 8.23 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.2 -0.454 . . . . 75.51 110.875 179.99 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 30' ' ' PHE . . . . . 0.483 ' HA ' HD13 ' A' ' 50' ' ' ILE . 3.9 t80 -111.41 134.65 52.84 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.205 -0.452 . . . . 63.1 110.865 -179.9 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 24.2 m -110.7 132.46 54.18 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.138 -0.483 . . . . 70.3 111.175 -179.947 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -95.73 114.28 26.0 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.228 -0.442 . . . . 71.2 110.89 179.936 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.645 HD12 ' N ' ' A' ' 34' ' ' THR . 0.2 OUTLIER -124.95 -0.13 7.92 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.174 -0.467 . . . . 51.41 110.88 -179.891 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 34' ' ' THR . . . . . 0.645 ' N ' HD12 ' A' ' 33' ' ' LEU . 1.4 m -59.9 162.46 5.48 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.187 -0.461 . . . . 71.4 111.151 179.915 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 42.9 mttt -80.29 45.96 0.79 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.177 -0.465 . . . . 75.12 110.879 179.948 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 2.9 mmt85 -78.63 -62.05 1.81 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.257 -0.428 . . . . 70.2 110.904 179.937 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -105.02 31.15 5.02 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.175 -0.466 . . . . 64.34 110.894 179.967 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -86.17 -173.97 4.83 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.25 -0.432 . . . . 54.11 110.883 -179.906 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 8.8 m -125.5 95.14 4.35 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.148 -0.478 . . . . 53.1 110.868 -179.853 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 40' ' ' TRP . . . . . . . . . . . . . 0.1 OUTLIER -168.94 -66.91 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.11 -0.496 . . . . 63.33 110.883 179.986 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 41' ' ' ASP . . . . . 0.581 ' O ' ' C ' ' A' ' 42' ' ' LYS . 0.5 OUTLIER 176.18 57.5 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.221 -0.445 . . . . 72.43 110.857 179.91 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 42' ' ' LYS . . . . . 0.581 ' C ' ' O ' ' A' ' 41' ' ' ASP . 0.0 OUTLIER 22.07 68.5 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.181 -0.463 . . . . 74.14 110.927 180.0 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 1.5 tt0 -113.9 62.04 1.03 Allowed Pre-proline 0 C--N 1.329 -0.295 0 CA-C-O 121.571 0.701 . . . . 62.44 110.875 -179.998 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 44' ' ' PRO . . . . . 0.454 ' HD3' ' C ' ' A' ' 42' ' ' LYS . 54.2 Cg_endo -69.77 130.89 20.13 Favored 'Trans proline' 0 C--N 1.34 0.126 0 C-N-CA 122.718 2.279 . . . . 73.32 112.342 179.962 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 45' ' ' GLN . . . . . 0.649 ' HB3' HD12 ' A' ' 47' ' ' ILE . 24.3 tt0 -107.31 11.03 29.56 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.206 -0.452 . . . . 62.32 110.937 179.989 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 46' ' ' ILE . . . . . 0.486 HG22 ' O ' ' A' ' 45' ' ' GLN . 0.0 OUTLIER 82.43 -34.19 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.179 -0.464 . . . . 74.31 111.166 179.978 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 47' ' ' ILE . . . . . 0.649 HD12 ' HB3' ' A' ' 45' ' ' GLN . 0.2 OUTLIER -34.94 148.66 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.181 -0.463 . . . . 31.15 111.101 179.843 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 48' ' ' PHE . . . . . 0.617 ' CZ ' HG21 ' A' ' 114' ' ' ILE . 14.3 p90 -159.43 158.0 31.25 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.165 -0.47 . . . . 54.22 110.909 179.889 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 49' ' ' GLU . . . . . 0.462 ' CG ' ' HB2' ' A' ' 67' ' ' HIS . 5.7 mt-10 -109.61 160.74 16.01 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.157 -0.474 . . . . 75.04 110.94 -179.949 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 50' ' ' ILE . . . . . 0.483 HD13 ' HA ' ' A' ' 30' ' ' PHE . 19.0 mm -137.61 139.04 43.93 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 116.148 -0.478 . . . . 75.31 111.161 179.987 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 24.1 m -85.26 117.07 23.98 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.186 -0.461 . . . . 75.1 111.134 179.979 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 52' ' ' LEU . . . . . 0.598 HD12 HD22 ' A' ' 66' ' ' LEU . 17.1 mt -121.59 161.08 23.03 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.234 -0.439 . . . . 75.13 110.939 179.932 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -177.51 178.79 1.0 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.23 -0.441 . . . . 64.1 110.915 179.906 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -64.89 175.48 1.5 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.201 -0.454 . . . . 74.21 110.85 -179.75 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 16.4 m -80.69 -29.45 11.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.155 -0.475 . . . . 62.12 111.081 179.962 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 1.7 t0 -117.02 -169.13 1.59 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.201 -0.454 . . . . 43.53 110.901 179.954 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 57' ' ' LYS . . . . . 0.472 ' CD ' ' N ' ' A' ' 57' ' ' LYS . 0.0 OUTLIER -117.55 -12.62 10.34 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.257 -0.429 . . . . 71.34 110.88 -179.985 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 58' ' ' GLU . . . . . 0.543 ' HA ' ' C ' ' A' ' 59' ' ' PRO . 9.8 pt-20 -126.06 150.98 71.0 Favored Pre-proline 0 C--N 1.329 -0.294 0 CA-C-O 121.639 0.733 . . . . 73.42 110.924 179.895 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 59' ' ' PRO . . . . . 0.543 ' C ' ' HA ' ' A' ' 58' ' ' GLU . 53.7 Cg_endo -69.77 -5.94 9.17 Favored 'Cis proline' 0 C--N 1.342 0.191 0 C-N-CA 122.686 -1.798 . . . . 75.23 112.349 0.041 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 60' ' ' VAL . . . . . 0.879 HG11 ' ND2' ' A' ' 88' ' ' ASN . 33.4 m -140.75 172.32 11.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.25 -0.432 . . . . 74.14 111.165 179.93 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 61' ' ' GLU . . . . . 0.447 ' O ' ' C ' ' A' ' 62' ' ' SER . 5.4 tt0 -102.45 -21.97 14.14 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.163 -0.471 . . . . 73.42 110.86 -179.979 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 62' ' ' SER . . . . . 0.816 ' HB3' HD11 ' A' ' 125' ' ' LEU . 41.7 m 34.0 90.78 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.181 -0.463 . . . . 55.01 110.889 -179.784 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 10.4 p -118.61 123.05 44.04 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.124 -0.489 . . . . 64.21 110.869 -179.836 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 64' ' ' ILE . . . . . 1.066 HD11 HG21 ' A' ' 89' ' ' VAL . 30.1 mt -133.05 139.31 49.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.093 -0.503 . . . . 73.23 111.125 179.976 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 20.4 m -104.53 116.87 32.85 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.176 -0.465 . . . . 74.02 111.157 179.959 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 66' ' ' LEU . . . . . 1.027 HD21 HG21 ' A' ' 121' ' ' THR . 1.4 mp -94.48 109.97 21.81 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.247 -0.433 . . . . 75.41 110.915 179.977 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 67' ' ' HIS . . . . . 0.531 ' CE1' HD21 ' A' ' 33' ' ' LEU . 1.9 t60 -97.4 109.96 22.61 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.18 -0.464 . . . . 73.14 110.833 179.875 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 68' ' ' PHE . . . . . 0.572 ' CE2' ' HB3' ' A' ' 66' ' ' LEU . 0.0 OUTLIER -105.11 139.97 38.98 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.206 -0.452 . . . . 73.3 110.839 -179.896 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -123.87 128.39 49.42 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.148 -0.478 . . . . 61.42 111.07 179.943 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 70' ' ' MET . . . . . 0.738 ' CE ' HD11 ' A' ' 114' ' ' ILE . 0.0 OUTLIER -96.32 103.42 15.32 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.23 -0.441 . . . . 65.21 110.882 179.953 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -57.33 161.17 5.82 Favored Pre-proline 0 C--N 1.33 -0.272 0 CA-C-O 121.564 0.697 . . . . 62.33 111.134 -179.935 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.8 -4.19 13.55 Favored 'Trans proline' 0 C--N 1.342 0.195 0 C-N-CA 122.692 2.261 . . . . 64.03 112.346 179.93 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 73' ' ' MET . . . . . 0.5 ' O ' ' CB ' ' A' ' 76' ' ' TYR . 0.0 OUTLIER -111.85 -24.26 10.09 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.199 -0.455 . . . . 74.32 110.891 179.92 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 74' ' ' TYR . . . . . 0.635 ' CD1' ' C ' ' A' ' 74' ' ' TYR . 0.0 OUTLIER -47.98 149.9 2.25 Favored Pre-proline 0 C--N 1.329 -0.319 0 CA-C-O 121.638 0.732 . . . . 75.44 110.924 -179.865 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 75' ' ' PRO . . . . . 0.542 ' C ' ' HA ' ' A' ' 74' ' ' TYR . 53.7 Cg_endo -69.79 -12.34 12.22 Favored 'Cis proline' 0 C--N 1.341 0.165 0 C-N-CA 122.696 -1.793 . . . . 75.12 112.302 -0.041 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 76' ' ' TYR . . . . . 0.5 ' CB ' ' O ' ' A' ' 73' ' ' MET . 9.4 t80 -33.95 -47.31 0.26 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.264 -0.425 . . . . 71.32 110.934 -179.925 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 77' ' ' THR . . . . . 0.41 HG23 ' CB ' ' A' ' 73' ' ' MET . 72.0 p -105.8 179.68 4.2 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.121 -0.491 . . . . 70.32 111.105 -179.964 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -100.74 129.95 26.44 Favored Pre-proline 0 C--N 1.329 -0.309 0 CA-C-O 121.638 0.733 . . . . 45.04 111.108 179.84 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 79' ' ' PRO . . . . . 0.616 ' HG3' HD11 ' A' ' 113' ' ' ILE . 53.9 Cg_endo -69.75 -175.18 1.07 Allowed 'Trans proline' 0 C--N 1.342 0.203 0 C-N-CA 122.685 2.256 . . . . 64.31 112.353 179.992 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 80' ' ' GLU . . . . . 0.58 ' O ' HD13 ' A' ' 81' ' ' ILE . 0.4 OUTLIER -124.18 141.2 52.26 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.26 -0.427 . . . . 73.23 110.871 -179.981 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 81' ' ' ILE . . . . . 0.58 HD13 ' O ' ' A' ' 80' ' ' GLU . 8.0 mm -133.02 143.89 38.12 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.141 -0.481 . . . . 61.54 111.096 179.983 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 82' ' ' GLU . . . . . 0.509 ' HG3' ' CD ' ' A' ' 84' ' ' LYS . 4.4 pt-20 -149.02 143.65 26.22 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.156 -0.475 . . . . 70.43 110.916 179.906 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 83' ' ' PHE . . . . . 0.465 ' CZ ' ' HD3' ' A' ' 98' ' ' LYS . 10.3 m-85 -96.21 136.85 36.13 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.167 -0.469 . . . . 74.22 110.898 -179.904 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 84' ' ' LYS . . . . . 0.509 ' CD ' ' HG3' ' A' ' 82' ' ' GLU . 12.8 mmmt -123.99 169.02 12.05 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.201 -0.454 . . . . 73.33 110.941 179.964 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 85' ' ' ASN . . . . . 0.455 ' O ' ' C ' ' A' ' 86' ' ' VAL . 3.2 m120 64.26 -72.46 0.06 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.249 -0.432 . . . . 74.05 110.888 179.942 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 86' ' ' VAL . . . . . 0.513 HG11 HD11 ' A' ' 94' ' ' LEU . 6.8 m 33.76 90.84 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.18 -0.464 . . . . 74.14 111.101 179.904 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -99.95 -53.65 3.1 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.173 -0.467 . . . . 71.21 110.934 179.995 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 88' ' ' ASN . . . . . 0.879 ' ND2' HG11 ' A' ' 60' ' ' VAL . 25.3 t-20 -85.4 20.88 1.89 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.206 -0.452 . . . . 63.34 110.866 -179.954 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 89' ' ' VAL . . . . . 1.066 HG21 HD11 ' A' ' 64' ' ' ILE . 2.8 t -130.81 154.62 40.96 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.175 -0.466 . . . . 74.02 111.133 179.918 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 90' ' ' MET . . . . . . . . . . . . . 3.0 mtm -108.31 -69.44 0.85 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.19 -0.459 . . . . 72.3 110.933 179.874 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 9.8 p-10 -170.82 -33.41 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.183 -0.462 . . . . 72.31 110.88 179.959 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 4.1 m -54.34 -46.47 72.93 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.197 -0.456 . . . . 64.1 110.869 -179.788 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 93' ' ' GLN . . . . . 0.441 ' HB2' ' CG1' ' A' ' 89' ' ' VAL . 4.1 mp0 -68.74 -38.78 80.39 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.131 -0.486 . . . . 74.32 110.897 -179.942 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 94' ' ' LEU . . . . . 0.521 ' CD1' HG11 ' A' ' 89' ' ' VAL . 8.2 mp -57.86 -49.16 77.63 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.185 -0.461 . . . . 64.34 110.931 179.977 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 74.2 mt-30 -66.08 -37.33 85.53 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.144 -0.48 . . . . 61.32 110.9 179.956 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 96' ' ' MET . . . . . . . . . . . . . 32.8 ttp -59.76 -41.27 90.66 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.205 -0.452 . . . . 62.24 110.884 179.958 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 97' ' ' LEU . . . . . 0.609 HD22 ' HA ' ' A' ' 121' ' ' THR . 87.6 mt -61.76 -44.8 96.18 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.21 -0.45 . . . . 75.13 110.945 -179.982 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 98' ' ' LYS . . . . . 0.48 ' HA ' ' CD2' ' A' ' 101' ' ' PHE . 5.5 mmtp -58.47 -34.98 71.48 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.169 -0.469 . . . . 74.24 110.893 179.81 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -63.89 -42.76 97.4 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.183 -0.462 . . . . 73.44 110.86 -179.847 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 100' ' ' GLU . . . . . 0.558 ' O ' HD12 ' A' ' 104' ' ' ILE . 69.5 mm-40 -71.0 -24.56 62.41 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.114 -0.494 . . . . 73.22 110.837 -179.948 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 101' ' ' PHE . . . . . 0.576 ' CD2' HD11 ' A' ' 117' ' ' ILE . 10.5 m-30 -59.57 -38.23 80.61 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.146 -0.479 . . . . 75.52 110.864 -179.905 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.28 -44.0 95.72 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.166 -0.47 . . . . 75.02 110.867 -179.988 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -67.36 -42.88 82.73 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.247 -0.433 . . . . 73.02 110.888 179.881 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 104' ' ' ILE . . . . . 0.904 HD11 ' CG ' ' A' ' 120' ' ' PHE . 3.4 mt -61.82 -47.68 92.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.245 -0.434 . . . . 60.42 111.158 179.855 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 105' ' ' HIS . . . . . 0.454 ' O ' ' N ' ' A' ' 109' ' ' ARG . 64.6 t-80 -62.97 -41.2 99.47 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.135 -0.484 . . . . 65.15 110.888 179.864 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 1.4 m-80 -56.82 -40.47 76.06 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.199 -0.455 . . . . 62.21 110.87 -179.941 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 107' ' ' THR . . . . . 0.413 ' CG2' ' O ' ' A' ' 104' ' ' ILE . 5.2 t -81.26 -26.31 35.88 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.212 -0.449 . . . . 72.23 111.112 -179.971 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 108' ' ' SER . . . . . 0.58 ' OG ' HG22 ' A' ' 113' ' ' ILE . 39.3 p -111.31 26.84 10.26 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.251 -0.431 . . . . 42.44 110.848 -179.813 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 109' ' ' ARG . . . . . 0.454 ' N ' ' O ' ' A' ' 105' ' ' HIS . 13.4 ttt-85 -68.34 76.55 0.26 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.154 -0.476 . . . . 74.24 110.868 -179.928 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 145.09 -20.22 1.94 Allowed Glycine 0 N--CA 1.451 -0.343 0 C-N-CA 120.78 -0.724 . . . . 55.44 112.501 -179.986 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 111' ' ' GLN . . . . . . . . . . . . . 7.3 pt20 -114.54 -170.2 1.69 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.749 0.309 . . . . 74.42 110.91 -179.877 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 32.8 mt-10 -62.3 128.92 38.34 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.204 -0.453 . . . . 75.42 110.874 -179.962 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 113' ' ' ILE . . . . . 0.616 HD11 ' HG3' ' A' ' 79' ' ' PRO . 21.2 pt -120.67 -15.08 7.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.133 -0.485 . . . . 63.25 111.098 179.999 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 114' ' ' ILE . . . . . 0.92 ' O ' HG23 ' A' ' 118' ' ' THR . 35.0 mm -60.11 -43.64 93.33 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.175 -0.466 . . . . 73.43 111.166 179.816 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 115' ' ' PHE . . . . . 0.708 ' CE1' HD13 ' A' ' 25' ' ' ILE . 22.0 t80 -72.31 -35.35 68.61 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.176 -0.465 . . . . 65.34 110.925 179.929 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 56.6 mm-40 -67.89 -47.62 68.3 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.096 -0.502 . . . . 74.43 110.929 -179.97 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 117' ' ' ILE . . . . . 0.576 HD11 ' CD2' ' A' ' 101' ' ' PHE . 1.1 tt -64.27 -40.45 89.11 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.133 -0.485 . . . . 61.31 111.15 179.947 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 118' ' ' THR . . . . . 0.92 HG23 ' O ' ' A' ' 114' ' ' ILE . 62.5 p -67.43 -43.38 81.32 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.181 -0.463 . . . . 74.02 111.149 179.978 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 1.7 t -67.83 -32.02 72.27 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.189 -0.459 . . . . 62.44 110.841 -179.867 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 120' ' ' PHE . . . . . 0.904 ' CG ' HD11 ' A' ' 104' ' ' ILE . 0.4 OUTLIER -76.01 -39.64 55.32 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.155 -0.475 . . . . 75.5 110.893 -179.932 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 121' ' ' THR . . . . . 1.027 HG21 HD21 ' A' ' 66' ' ' LEU . 14.8 p -69.36 -41.65 76.29 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.14 -0.482 . . . . 75.51 111.134 -179.933 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 122' ' ' GLN . . . . . 0.442 ' CG ' ' N ' ' A' ' 123' ' ' GLU . 9.0 pt20 -68.25 -46.97 69.01 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.227 -0.442 . . . . 65.15 110.904 -179.976 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 123' ' ' GLU . . . . . 0.442 ' N ' ' CG ' ' A' ' 122' ' ' GLN . 5.7 pt-20 -60.36 -36.61 78.41 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.197 -0.456 . . . . 73.25 110.869 -179.916 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 124' ' ' LYS . . . . . 0.459 ' HA ' ' CE ' ' A' ' 124' ' ' LYS . 0.0 OUTLIER -77.03 -38.54 52.62 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.146 -0.479 . . . . 74.42 110.921 179.969 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 125' ' ' LEU . . . . . 0.816 HD11 ' HB3' ' A' ' 62' ' ' SER . 2.3 tp -67.69 -43.2 80.69 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.203 -0.453 . . . . 64.23 110.938 179.927 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -63.19 -43.13 99.08 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.157 -0.474 . . . . 63.11 110.836 179.875 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 127' ' ' GLU . . . . . 0.446 ' HG3' ' N ' ' A' ' 128' ' ' PHE . 0.0 OUTLIER -67.22 -29.25 68.86 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.208 -0.451 . . . . 73.43 110.915 -179.912 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 128' ' ' PHE . . . . . 0.53 ' O ' HG23 ' A' ' 132' ' ' VAL . 0.2 OUTLIER -73.77 -59.72 2.59 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.117 -0.492 . . . . 73.44 110.916 -179.966 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 129' ' ' GLN . . . . . 0.549 ' CG ' ' CG2' ' A' ' 60' ' ' VAL . 1.5 tm0? -39.54 -41.25 0.98 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.13 -0.487 . . . . 74.41 110.921 -179.97 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 130' ' ' ASN . . . . . . . . . . . . . 1.4 t-20 -60.85 -41.71 96.41 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.183 -0.462 . . . . 53.51 110.896 -179.95 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 131' ' ' VAL . . . . . 0.45 HG23 ' O ' ' A' ' 131' ' ' VAL . 10.0 m -128.53 83.31 0.77 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.166 -0.47 . . . . 73.11 111.15 179.903 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 132' ' ' VAL . . . . . 0.53 HG23 ' O ' ' A' ' 128' ' ' PHE . 41.2 t -116.12 145.81 21.37 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.152 -0.476 . . . . 55.13 111.14 179.941 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 133' ' ' ASN . . . . . . . . . . . . . 7.5 p-10 -52.81 122.43 9.15 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.197 -0.456 . . . . 73.53 110.91 179.983 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 134' ' ' THR . . . . . . . . . . . . . 24.9 m 47.56 98.52 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.198 -0.456 . . . . 51.54 111.098 179.973 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -59.97 163.11 4.92 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.253 -0.431 . . . . 75.2 110.912 179.975 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -153.87 162.04 41.54 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.212 -0.449 . . . . 74.11 110.892 -179.851 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 137' ' ' LEU . . . . . . . . . . . . . 3.1 mt -127.32 142.17 51.52 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.165 -0.47 . . . . 73.41 110.886 -179.956 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 3.8 tt0 . . . . . 0 C--N 1.33 -0.278 0 CA-C-N 116.202 -0.454 . . . . 74.43 110.899 179.947 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 2.9 mpp? . . . . . 0 C--O 1.231 0.091 0 CA-C-O 120.794 0.33 . . . . 73.05 110.877 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 32.7 p -160.28 120.63 2.92 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.215 -0.448 . . . . 74.3 110.887 -179.782 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 10.7 tp 68.44 120.43 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.169 -0.469 . . . . 72.44 110.884 -179.992 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 16.8 t 178.31 58.03 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.199 -0.455 . . . . 62.1 110.843 -179.93 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 5' ' ' HIS . . . . . 0.45 ' O ' ' C ' ' A' ' 6' ' ' LEU . 6.7 m170 69.02 92.11 0.09 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.164 -0.471 . . . . 74.02 110.836 179.975 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 6' ' ' LEU . . . . . 0.45 ' C ' ' O ' ' A' ' 5' ' ' HIS . 0.5 OUTLIER 34.4 52.08 0.5 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.182 -0.463 . . . . 71.23 110.947 -179.966 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 7' ' ' THR . . . . . 0.555 HG23 ' H ' ' A' ' 9' ' ' ASP . 10.0 t -79.68 175.83 10.26 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.199 -0.455 . . . . 72.2 111.131 -180.0 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 36.6 mt -54.39 -22.66 12.96 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.236 -0.438 . . . . 73.11 110.965 179.947 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 9' ' ' ASP . . . . . 0.555 ' H ' HG23 ' A' ' 7' ' ' THR . 33.6 t70 -54.89 -30.04 57.14 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.191 -0.459 . . . . 72.44 110.819 179.843 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 9.1 mm100 -66.27 -33.81 76.59 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.207 -0.451 . . . . 73.12 110.916 -179.915 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 11' ' ' TYR . . . . . 0.55 ' CE1' ' HD2' ' A' ' 75' ' ' PRO . 14.1 m-85 -64.37 -26.93 68.68 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.211 -0.45 . . . . 74.12 110.904 -179.864 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -59.58 -37.01 77.39 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.15 -0.477 . . . . 75.11 110.899 -179.854 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 2.9 mm-40 -61.45 -45.94 92.17 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.152 -0.476 . . . . 73.41 110.92 179.976 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 14' ' ' ILE . . . . . 0.487 ' H ' HD12 ' A' ' 14' ' ' ILE . 4.9 mp -67.79 -45.05 85.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.141 -0.481 . . . . 73.13 111.163 179.945 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 15' ' ' GLN . . . . . 0.498 ' NE2' ' O ' ' A' ' 71' ' ' THR . 86.8 mt-30 -61.29 -45.36 94.8 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.124 -0.489 . . . . 74.31 110.907 179.966 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 2.8 t -61.18 -41.92 97.64 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.182 -0.463 . . . . 74.12 110.891 -179.941 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 2.5 m-20 -57.63 -33.51 68.34 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.196 -0.456 . . . . 74.1 110.913 -179.919 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 18' ' ' GLU . . . . . 0.571 ' HG2' HD13 ' A' ' 114' ' ' ILE . 2.9 mt-10 -65.51 -41.2 93.45 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.181 -0.463 . . . . 75.41 110.897 179.987 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 8.9 mp -61.74 -51.84 66.72 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.109 -0.496 . . . . 74.15 110.921 -179.958 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -68.85 -37.41 79.11 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.192 -0.458 . . . . 74.25 110.901 179.912 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -61.01 -50.58 72.77 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.162 -0.472 . . . . 32.21 111.109 179.916 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 22' ' ' ILE . . . . . 0.407 HD11 ' HB2' ' A' ' 115' ' ' PHE . 0.6 OUTLIER -75.0 -36.09 37.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.236 -0.438 . . . . 73.3 111.168 179.968 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 18.7 mtp180 -52.63 -34.22 50.3 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.16 -0.473 . . . . 72.22 110.858 179.973 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -66.29 -33.55 75.99 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.219 -0.446 . . . . 65.11 110.847 -179.782 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 25' ' ' ILE . . . . . 0.745 HG21 ' HE1' ' A' ' 115' ' ' PHE . 3.3 mt -81.71 -44.9 20.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.12 -0.491 . . . . 73.22 111.139 179.97 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 21.4 m-85 -109.01 46.03 1.0 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.182 -0.463 . . . . 74.12 110.883 -179.948 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 3.2 mtm -41.7 -59.32 1.69 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.138 -0.483 . . . . 71.55 110.902 179.895 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 1.5 t70 -84.38 -25.12 29.35 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.197 -0.456 . . . . 73.13 110.834 179.968 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -85.38 30.75 0.6 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.234 -0.439 . . . . 73.42 110.851 -179.998 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 30' ' ' PHE . . . . . 0.579 ' HA ' HD13 ' A' ' 50' ' ' ILE . 6.0 t80 -117.14 139.47 50.7 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.205 -0.452 . . . . 72.33 110.835 -179.879 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 60.5 m -118.33 135.12 54.5 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.092 -0.504 . . . . 63.42 111.168 -179.916 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 12.6 t70 -99.92 117.17 33.66 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.256 -0.429 . . . . 75.31 110.891 179.872 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.895 HD21 HG12 ' A' ' 47' ' ' ILE . 1.2 pt? -118.58 -28.69 5.61 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.182 -0.463 . . . . 73.01 110.935 -179.98 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 34' ' ' THR . . . . . 0.651 ' H ' HD23 ' A' ' 33' ' ' LEU . 0.2 OUTLIER -41.39 161.18 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.209 -0.45 . . . . 60.55 111.128 179.957 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 35' ' ' LYS . . . . . 0.441 ' O ' ' CD ' ' A' ' 35' ' ' LYS . 0.0 OUTLIER -75.6 50.39 0.54 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.168 -0.469 . . . . 71.03 110.927 179.877 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 1.8 mmt180 -72.22 -68.92 0.43 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.214 -0.448 . . . . 71.13 110.93 179.983 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 3.8 mmtp -118.79 39.61 3.47 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.205 -0.452 . . . . 71.14 110.9 179.917 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -121.51 119.41 31.9 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.216 -0.447 . . . . 73.13 110.842 -179.903 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 14.6 m -87.53 99.49 12.07 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.132 -0.485 . . . . 64.53 110.843 -179.823 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 40' ' ' TRP . . . . . . . . . . . . . 57.8 t-105 -172.58 -44.48 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.17 -0.468 . . . . 70.3 110.911 -179.991 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 26.0 t0 -139.37 146.43 40.2 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.246 -0.433 . . . . 75.12 110.887 179.928 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 9.6 mttt -123.93 60.21 1.12 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.196 -0.457 . . . . 54.43 110.888 -179.986 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 29.2 mt-30 -153.31 73.09 6.89 Favored Pre-proline 0 C--N 1.329 -0.306 0 CA-C-O 121.61 0.719 . . . . 60.44 110.941 179.952 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.78 163.15 39.36 Favored 'Trans proline' 0 C--N 1.341 0.179 0 C-N-CA 122.646 2.23 . . . . 74.43 112.354 -179.983 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 45' ' ' GLN . . . . . 0.657 ' HB3' HG23 ' A' ' 47' ' ' ILE . 11.7 tt0 -140.29 10.45 2.32 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.231 -0.44 . . . . 62.41 110.911 -179.982 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 46' ' ' ILE . . . . . 0.534 HG22 ' O ' ' A' ' 45' ' ' GLN . 0.0 OUTLIER 78.71 -7.87 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.225 -0.443 . . . . 75.13 111.132 179.976 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 47' ' ' ILE . . . . . 0.895 HG12 HD21 ' A' ' 33' ' ' LEU . 0.2 OUTLIER -53.12 147.1 2.27 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.18 -0.464 . . . . 54.03 111.119 179.829 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 48' ' ' PHE . . . . . 0.659 ' HA ' HD22 ' A' ' 33' ' ' LEU . 25.6 p90 -153.06 153.03 32.03 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.178 -0.464 . . . . 63.24 110.878 179.954 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 49' ' ' GLU . . . . . 0.459 ' CG ' HD13 ' A' ' 33' ' ' LEU . 12.4 mt-10 -108.36 150.83 26.82 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.158 -0.474 . . . . 71.45 110.904 -179.954 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 50' ' ' ILE . . . . . 0.579 HD13 ' HA ' ' A' ' 30' ' ' PHE . 11.5 mm -132.43 138.58 51.89 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.127 -0.488 . . . . 73.14 111.145 -179.991 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 96.8 m -85.86 127.36 34.56 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.177 -0.465 . . . . 63.14 111.141 179.984 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 52' ' ' LEU . . . . . 0.619 HD12 HD12 ' A' ' 66' ' ' LEU . 17.7 mt -128.02 164.5 22.22 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.19 -0.459 . . . . 63.13 110.883 179.965 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -178.62 172.21 1.44 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.134 -0.484 . . . . 64.01 110.886 179.933 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -66.53 173.71 3.21 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.187 -0.461 . . . . 74.21 110.836 -179.798 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 29.0 m -85.22 -27.35 6.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.146 -0.479 . . . . 61.32 111.14 179.92 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -114.72 -172.7 2.17 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.13 -0.486 . . . . 73.42 110.859 179.938 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 4.1 mmmm -116.24 -22.4 8.88 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.177 -0.465 . . . . 63.25 110.897 179.979 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 58' ' ' GLU . . . . . 0.541 ' HA ' ' C ' ' A' ' 59' ' ' PRO . 1.5 pt-20 -113.06 143.05 28.41 Favored Pre-proline 0 C--N 1.329 -0.31 0 CA-C-O 121.701 0.762 . . . . 75.45 110.899 179.931 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 59' ' ' PRO . . . . . 0.541 ' C ' ' HA ' ' A' ' 58' ' ' GLU . 53.5 Cg_endo -69.79 -13.2 12.43 Favored 'Cis proline' 0 C--N 1.342 0.189 0 C-N-CA 122.624 -1.823 . . . . 72.44 112.31 0.033 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 60' ' ' VAL . . . . . 0.491 HG22 ' CG ' ' A' ' 129' ' ' GLN . 8.5 m -149.49 176.26 0.92 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.263 -0.426 . . . . 71.23 111.076 179.939 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 61' ' ' GLU . . . . . 0.458 ' O ' ' C ' ' A' ' 62' ' ' SER . 0.9 OUTLIER -112.46 -16.24 12.93 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.128 -0.487 . . . . 75.54 110.882 179.994 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 62' ' ' SER . . . . . 0.539 ' CB ' HD21 ' A' ' 125' ' ' LEU . 0.4 OUTLIER 33.67 91.12 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.174 -0.467 . . . . 54.43 110.849 -179.806 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 32.8 t -103.31 122.79 45.53 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.143 -0.48 . . . . 75.34 110.821 -179.803 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 64' ' ' ILE . . . . . 0.732 HD13 HD21 ' A' ' 94' ' ' LEU . 17.7 mt -137.19 143.05 35.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.164 -0.471 . . . . 71.45 111.121 179.937 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 15.4 m -107.84 115.03 29.4 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.207 -0.451 . . . . 75.12 111.13 179.945 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 66' ' ' LEU . . . . . 1.076 HD11 HG21 ' A' ' 121' ' ' THR . 12.3 mt -91.02 110.14 21.4 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.218 -0.446 . . . . 75.42 110.88 179.962 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 8.7 t60 -100.78 114.64 28.6 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.191 -0.459 . . . . 64.52 110.866 179.849 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 68' ' ' PHE . . . . . 0.523 ' HA ' HD13 ' A' ' 81' ' ' ILE . 0.0 OUTLIER -103.66 139.79 38.46 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.254 -0.43 . . . . 75.22 110.909 -179.942 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -120.04 120.81 37.37 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.182 -0.463 . . . . 73.24 111.131 179.933 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 70' ' ' MET . . . . . 0.662 ' HE3' HD11 ' A' ' 114' ' ' ILE . 12.6 mmt -85.45 104.3 15.12 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.241 -0.436 . . . . 72.15 110.875 179.995 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 71' ' ' THR . . . . . 0.498 ' O ' ' NE2' ' A' ' 15' ' ' GLN . 0.7 OUTLIER -59.93 158.12 26.83 Favored Pre-proline 0 C--N 1.329 -0.303 0 CA-C-O 121.593 0.711 . . . . 64.02 111.163 -179.938 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.76 1.05 4.78 Favored 'Trans proline' 0 C--N 1.342 0.213 0 C-N-CA 122.646 2.231 . . . . 55.55 112.356 179.94 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 73' ' ' MET . . . . . 0.479 ' O ' ' CB ' ' A' ' 76' ' ' TYR . 0.5 OUTLIER -116.67 -25.57 7.32 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.248 -0.433 . . . . 74.33 110.894 179.934 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 74' ' ' TYR . . . . . 0.62 ' CD1' ' C ' ' A' ' 74' ' ' TYR . 0.1 OUTLIER -46.6 147.61 2.02 Favored Pre-proline 0 C--N 1.329 -0.324 0 CA-C-O 121.664 0.745 . . . . 73.21 110.956 -179.933 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 75' ' ' PRO . . . . . 0.557 ' C ' ' HA ' ' A' ' 74' ' ' TYR . 53.4 Cg_endo -69.77 -14.86 12.55 Favored 'Cis proline' 0 C--N 1.342 0.184 0 C-N-CA 122.636 -1.818 . . . . 75.2 112.333 -0.049 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 76' ' ' TYR . . . . . 0.479 ' CB ' ' O ' ' A' ' 73' ' ' MET . 9.0 t80 -34.16 -45.33 0.21 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.202 -0.454 . . . . 65.41 110.938 -179.941 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 77' ' ' THR . . . . . 0.473 HG23 ' CB ' ' A' ' 73' ' ' MET . 51.9 p -114.97 163.45 15.56 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.099 -0.5 . . . . 73.32 111.163 -179.976 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -85.7 132.64 43.72 Favored Pre-proline 0 C--N 1.329 -0.326 0 CA-C-O 121.585 0.707 . . . . 72.34 111.09 179.865 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 79' ' ' PRO . . . . . 0.844 ' HG3' HD11 ' A' ' 113' ' ' ILE . 54.0 Cg_endo -69.71 -170.72 0.41 Allowed 'Trans proline' 0 C--N 1.341 0.165 0 C-N-CA 122.714 2.276 . . . . 75.13 112.367 -179.993 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 80' ' ' GLU . . . . . 0.429 ' HG3' ' N ' ' A' ' 81' ' ' ILE . 0.3 OUTLIER -124.36 140.11 53.26 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.242 -0.435 . . . . 72.23 110.924 179.955 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 81' ' ' ILE . . . . . 0.523 HD13 ' HA ' ' A' ' 68' ' ' PHE . 6.4 mm -130.42 137.07 57.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.127 -0.488 . . . . 64.52 111.152 179.957 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 82' ' ' GLU . . . . . 0.48 ' HG3' ' CD ' ' A' ' 84' ' ' LYS . 6.0 pt-20 -140.04 144.09 36.71 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.174 -0.466 . . . . 74.05 110.888 179.942 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 83' ' ' PHE . . . . . 0.692 ' CG ' HD22 ' A' ' 94' ' ' LEU . 58.6 m-85 -94.3 140.63 29.54 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.142 -0.481 . . . . 72.41 110.892 -179.918 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 84' ' ' LYS . . . . . 0.48 ' CD ' ' HG3' ' A' ' 82' ' ' GLU . 10.4 mmmt -124.2 169.62 11.55 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.172 -0.467 . . . . 72.12 110.904 179.932 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 85' ' ' ASN . . . . . 0.424 ' C ' HG22 ' A' ' 86' ' ' VAL . 3.2 m120 61.78 -74.69 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.216 -0.447 . . . . 64.45 110.95 179.982 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 86' ' ' VAL . . . . . 0.497 ' CG1' HD11 ' A' ' 94' ' ' LEU . 3.4 m 41.73 90.87 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.167 -0.469 . . . . 74.43 111.147 179.896 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -104.06 -95.92 0.32 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.167 -0.47 . . . . 74.54 110.989 179.957 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 88' ' ' ASN . . . . . 0.445 ' CG ' ' HB ' ' A' ' 60' ' ' VAL . 32.0 m120 -45.76 -36.04 4.79 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.183 -0.462 . . . . 62.01 110.891 -180.0 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 89' ' ' VAL . . . . . 0.541 HG21 ' HG ' ' A' ' 94' ' ' LEU . 3.2 p -63.94 149.97 10.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.16 -0.473 . . . . 62.14 111.106 179.942 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 90' ' ' MET . . . . . . . . . . . . . 29.8 mtm -98.75 -74.29 0.59 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.194 -0.457 . . . . 74.32 110.887 179.914 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 7.7 p-10 176.4 -32.34 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.276 -0.42 . . . . 71.33 110.85 179.932 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -54.43 -45.86 73.12 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.213 -0.449 . . . . 73.4 110.823 -179.759 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -70.84 -38.97 73.22 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.165 -0.47 . . . . 74.44 110.893 -179.928 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 94' ' ' LEU . . . . . 0.732 HD21 HD13 ' A' ' 64' ' ' ILE . 21.4 mt -58.87 -47.43 84.93 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.208 -0.451 . . . . 70.44 110.912 -179.979 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 26.4 mt-30 -61.06 -34.56 75.08 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.166 -0.47 . . . . 64.25 110.91 179.941 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 96' ' ' MET . . . . . 0.498 ' SD ' ' CE1' ' A' ' 128' ' ' PHE . 9.2 ttp -61.25 -37.94 84.89 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.212 -0.449 . . . . 75.24 110.838 -179.992 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 97' ' ' LEU . . . . . 0.571 ' O ' ' CD1' ' A' ' 101' ' ' PHE . 27.8 mt -64.32 -43.07 95.8 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.224 -0.444 . . . . 64.3 110.93 179.994 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 5.0 mmtp -55.06 -38.51 68.12 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.227 -0.442 . . . . 73.41 110.91 179.82 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -70.19 -42.14 72.8 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.196 -0.456 . . . . 73.13 110.854 -179.903 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 100' ' ' GLU . . . . . 0.566 ' O ' HD12 ' A' ' 104' ' ' ILE . 6.0 mt-10 -66.69 -24.3 66.24 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.149 -0.478 . . . . 61.51 110.899 -179.953 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 101' ' ' PHE . . . . . 0.65 ' CD2' HD11 ' A' ' 117' ' ' ILE . 9.4 m-30 -60.1 -31.12 69.74 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.138 -0.483 . . . . 74.23 110.905 -179.95 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.01 -40.76 87.37 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.148 -0.478 . . . . 71.11 110.877 179.948 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 1.6 mppt? -67.9 -42.95 80.39 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.226 -0.443 . . . . 74.4 110.92 179.853 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 104' ' ' ILE . . . . . 0.566 HD12 ' O ' ' A' ' 100' ' ' GLU . 2.3 mt -62.17 -47.59 92.39 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.218 -0.446 . . . . 72.21 111.1 179.879 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 105' ' ' HIS . . . . . . . . . . . . . 7.7 t-80 -62.93 -42.83 99.93 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.16 -0.473 . . . . 74.44 110.815 179.94 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -56.49 -41.76 77.18 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.218 -0.446 . . . . 64.15 110.927 -179.954 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 9.3 t -81.74 -23.63 36.58 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.147 -0.479 . . . . 74.23 111.157 -179.999 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 108' ' ' SER . . . . . 0.429 ' HB2' HG22 ' A' ' 113' ' ' ILE . 24.2 m -107.93 26.39 10.41 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.236 -0.438 . . . . 74.2 110.883 -179.89 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -65.73 86.04 0.08 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.113 -0.494 . . . . 73.2 110.845 -179.907 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 119.75 38.89 0.68 Allowed Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.779 -0.724 . . . . 62.42 112.464 -179.996 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 111' ' ' GLN . . . . . . . . . . . . . 10.9 pt20 -171.42 -176.43 1.85 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.735 0.302 . . . . 70.45 110.893 -179.914 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 63.1 mt-10 -60.57 131.59 51.2 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.214 -0.448 . . . . 62.13 110.911 -179.966 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 113' ' ' ILE . . . . . 0.844 HD11 ' HG3' ' A' ' 79' ' ' PRO . 7.6 pt -127.02 -5.53 4.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.187 -0.461 . . . . 62.31 111.137 179.969 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 114' ' ' ILE . . . . . 0.852 ' H ' HD12 ' A' ' 114' ' ' ILE . 3.6 mp -68.3 -46.61 80.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.185 -0.461 . . . . 73.24 111.134 179.828 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 115' ' ' PHE . . . . . 0.745 ' HE1' HG21 ' A' ' 25' ' ' ILE . 12.5 t80 -69.13 -33.83 74.07 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.187 -0.46 . . . . 65.12 110.853 179.954 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 51.9 mm-40 -68.06 -44.72 75.72 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.191 -0.459 . . . . 70.53 110.886 -179.949 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 117' ' ' ILE . . . . . 0.65 HD11 ' CD2' ' A' ' 101' ' ' PHE . 0.4 OUTLIER -66.41 -41.2 88.37 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 116.192 -0.458 . . . . 71.25 111.147 179.982 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 118' ' ' THR . . . . . 0.712 HG23 ' O ' ' A' ' 114' ' ' ILE . 69.8 p -67.88 -43.08 80.16 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.162 -0.472 . . . . 73.15 111.177 179.906 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -66.49 -31.59 72.41 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.209 -0.451 . . . . 71.13 110.907 -179.878 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 120' ' ' PHE . . . . . 0.441 ' CG ' HD11 ' A' ' 104' ' ' ILE . 0.3 OUTLIER -77.73 -44.73 26.86 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.091 -0.504 . . . . 75.12 110.912 -179.988 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 121' ' ' THR . . . . . 1.076 HG21 HD11 ' A' ' 66' ' ' LEU . 18.8 p -66.17 -45.42 80.97 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.167 -0.47 . . . . 55.13 111.203 -179.979 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 3.6 pp0? -60.91 -38.12 84.64 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.187 -0.46 . . . . 62.21 110.894 179.978 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 123' ' ' GLU . . . . . 0.497 ' CG ' ' N ' ' A' ' 124' ' ' LYS . 1.6 pt-20 -74.12 -48.26 30.7 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.228 -0.442 . . . . 73.43 110.894 -179.944 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 124' ' ' LYS . . . . . 0.497 ' N ' ' CG ' ' A' ' 123' ' ' GLU . 0.0 OUTLIER -63.5 -28.51 70.0 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.084 -0.507 . . . . 73.4 110.865 179.986 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 125' ' ' LEU . . . . . 0.668 ' O ' HD23 ' A' ' 125' ' ' LEU . 1.4 tt -68.36 -51.64 42.12 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.208 -0.451 . . . . 53.15 110.928 179.947 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 26.8 t70 -60.31 -37.19 79.79 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.208 -0.451 . . . . 50.53 110.882 179.837 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 1.6 mm-40 -60.18 -48.68 80.69 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.185 -0.461 . . . . 73.41 110.838 -179.895 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 128' ' ' PHE . . . . . 0.498 ' CE1' ' SD ' ' A' ' 96' ' ' MET . 7.4 m-85 -64.19 -61.51 2.2 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.152 -0.477 . . . . 73.51 110.874 -179.907 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 129' ' ' GLN . . . . . 0.491 ' CG ' HG22 ' A' ' 60' ' ' VAL . 1.4 tm0? -42.86 -35.48 1.2 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.157 -0.474 . . . . 63.31 110.886 -179.916 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 130' ' ' ASN . . . . . . . . . . . . . 1.9 m-20 -69.57 -38.84 77.55 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.205 -0.452 . . . . 45.2 110.891 -179.949 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 131' ' ' VAL . . . . . 0.501 HG23 ' O ' ' A' ' 131' ' ' VAL . 3.2 m -110.81 26.66 2.75 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.166 -0.47 . . . . 55.23 111.136 179.883 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 132' ' ' VAL . . . . . 0.418 ' N ' ' O ' ' A' ' 128' ' ' PHE . 1.8 p -90.85 158.87 2.86 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.189 -0.459 . . . . 64.41 111.111 179.936 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 133' ' ' ASN . . . . . . . . . . . . . 1.6 m-20 -115.23 86.67 2.5 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.183 -0.462 . . . . 75.52 110.853 -179.964 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 134' ' ' THR . . . . . . . . . . . . . 43.1 p -139.38 157.25 46.19 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.144 -0.48 . . . . 72.3 111.127 -179.982 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -139.63 103.56 4.71 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.198 -0.456 . . . . 50.14 110.888 179.994 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 42.2 t -43.26 139.46 1.91 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.216 -0.447 . . . . 64.2 110.878 -179.843 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 137' ' ' LEU . . . . . . . . . . . . . 32.5 tp -170.32 133.75 1.12 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.12 -0.491 . . . . 73.14 110.958 179.993 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 C--N 1.329 -0.298 0 CA-C-N 116.214 -0.448 . . . . 65.53 110.885 179.949 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--O 1.231 0.118 0 CA-C-O 120.762 0.315 . . . . 73.05 110.873 . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 2' ' ' SER . . . . . 0.687 ' O ' HD12 ' A' ' 3' ' ' LEU . 58.3 m -166.38 111.11 0.8 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.257 -0.429 . . . . 63.24 110.866 -179.761 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 3' ' ' LEU . . . . . 0.687 HD12 ' O ' ' A' ' 2' ' ' SER . 0.2 OUTLIER -160.77 177.97 9.9 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.13 -0.486 . . . . 74.44 110.923 179.954 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -111.73 -71.54 0.75 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.174 -0.466 . . . . 50.4 110.878 -179.954 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 32.4 m-70 -55.09 -179.51 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.101 -0.5 . . . . 72.34 110.877 179.979 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 3.2 mt -42.84 123.3 2.67 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.251 -0.432 . . . . 71.34 110.906 -179.953 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 9.7 t -163.8 172.34 14.25 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.158 -0.474 . . . . 74.0 111.156 179.949 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.409 HD22 ' O ' ' A' ' 72' ' ' PRO . 23.4 mt -52.6 -32.96 44.07 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.247 -0.433 . . . . 65.45 110.912 179.958 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 6.3 m-20 -50.96 -34.59 29.51 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.251 -0.432 . . . . 73.41 110.86 179.827 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 36.6 mm-40 -66.33 -36.38 82.76 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.178 -0.465 . . . . 51.21 110.897 -179.892 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 17.9 m-85 -65.2 -26.05 67.97 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.168 -0.469 . . . . 74.24 110.919 -179.857 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -58.73 -37.59 76.51 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.106 -0.497 . . . . 54.42 110.927 -179.871 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 1.1 mm-40 -58.26 -41.68 84.78 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.104 -0.498 . . . . 70.23 110.898 179.987 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 2.3 mp -68.08 -40.16 82.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.208 -0.451 . . . . 73.22 111.141 179.939 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 15' ' ' GLN . . . . . 0.602 ' OE1' ' CE1' ' A' ' 74' ' ' TYR . 12.6 mm-40 -62.76 -45.04 94.55 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.133 -0.485 . . . . 64.12 110.87 179.989 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 3.2 t -58.52 -44.51 89.57 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.163 -0.471 . . . . 62.13 110.889 -179.925 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 17' ' ' ASN . . . . . 0.4 ' O ' ' HG3' ' A' ' 20' ' ' GLU . 0.6 OUTLIER -57.58 -33.51 68.25 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.217 -0.447 . . . . 71.04 110.911 -179.931 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 2.0 mm-40 -66.05 -37.69 86.47 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.179 -0.464 . . . . 63.3 110.896 -179.979 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.647 HD21 HG13 ' A' ' 46' ' ' ILE . 9.2 mp -65.7 -51.39 59.71 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.128 -0.487 . . . . 53.44 110.929 -179.995 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 20' ' ' GLU . . . . . 0.4 ' HG3' ' O ' ' A' ' 17' ' ' ASN . 2.0 pt-20 -68.25 -32.58 72.87 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.207 -0.452 . . . . 51.33 110.902 179.902 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -66.05 -49.92 65.99 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.143 -0.48 . . . . 73.33 111.103 179.952 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 22' ' ' ILE . . . . . 0.421 ' HA ' HD12 ' A' ' 25' ' ' ILE . 0.7 OUTLIER -77.01 -34.58 22.03 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.226 -0.443 . . . . 72.41 111.153 179.966 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 23' ' ' ARG . . . . . 0.403 ' CG ' ' O ' ' A' ' 19' ' ' LEU . 26.6 mtp180 -52.34 -34.45 47.37 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.184 -0.462 . . . . 75.13 110.913 179.935 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -67.16 -35.02 78.79 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.187 -0.461 . . . . 74.33 110.86 -179.758 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 25' ' ' ILE . . . . . 0.678 HG21 ' HE1' ' A' ' 115' ' ' PHE . 3.2 mt -80.61 -44.4 21.65 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.093 -0.503 . . . . 75.12 111.132 179.895 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 19.9 m-85 -110.73 45.89 1.11 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.208 -0.451 . . . . 62.31 110.92 -179.941 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 3.1 mtm -43.49 -57.23 3.2 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.127 -0.488 . . . . 74.21 110.887 179.884 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 5.4 m-20 -81.84 -35.94 28.85 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.203 -0.453 . . . . 71.41 110.883 179.949 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -80.62 44.03 0.7 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.218 -0.446 . . . . 73.43 110.827 -179.983 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 30' ' ' PHE . . . . . 0.542 ' HA ' HD13 ' A' ' 50' ' ' ILE . 10.1 t80 -129.15 123.72 32.85 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.233 -0.44 . . . . 71.14 110.921 -179.937 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 20.3 m -113.17 135.03 54.26 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.171 -0.468 . . . . 64.53 111.101 -179.882 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -95.94 113.99 25.67 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.216 -0.447 . . . . 52.11 110.868 179.924 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 1.115 HD23 ' N ' ' A' ' 34' ' ' THR . 0.1 OUTLIER -113.36 -18.74 11.96 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.162 -0.472 . . . . 73.22 110.93 -179.935 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 34' ' ' THR . . . . . 1.115 ' N ' HD23 ' A' ' 33' ' ' LEU . 2.5 m -37.99 156.66 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.163 -0.471 . . . . 73.33 111.143 179.94 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -73.89 62.82 0.87 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.198 -0.456 . . . . 75.13 110.905 179.924 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 2.1 mmm180 -129.06 -32.57 2.04 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.17 -0.468 . . . . 72.11 110.843 -179.984 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 37' ' ' LYS . . . . . 0.466 ' O ' ' CB ' ' A' ' 38' ' ' SER . 0.0 OUTLIER -72.05 122.51 21.03 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.216 -0.447 . . . . 72.53 110.896 179.967 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 38' ' ' SER . . . . . 0.466 ' CB ' ' O ' ' A' ' 37' ' ' LYS . 3.7 t 80.57 -48.54 0.3 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.214 -0.448 . . . . 74.43 110.825 -179.942 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 14.5 m -101.83 172.08 7.15 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.147 -0.479 . . . . 64.5 110.842 -179.817 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 40' ' ' TRP . . . . . 0.52 ' CG ' ' N ' ' A' ' 41' ' ' ASP . 8.9 p90 -88.29 -48.09 7.93 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.141 -0.481 . . . . 75.53 110.963 179.988 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 41' ' ' ASP . . . . . 0.52 ' N ' ' CG ' ' A' ' 40' ' ' TRP . 0.2 OUTLIER 172.97 132.98 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.166 -0.47 . . . . 71.42 110.846 179.944 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 18.1 mttt -120.24 -90.41 0.58 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.194 -0.457 . . . . 74.15 110.907 179.959 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 43' ' ' GLN . . . . . 0.654 ' N ' ' CD ' ' A' ' 44' ' ' PRO . 4.3 mp0 -129.35 41.48 0.74 Allowed Pre-proline 0 C--N 1.328 -0.329 0 CA-C-O 121.598 0.713 . . . . 64.11 110.941 179.912 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 44' ' ' PRO . . . . . 0.654 ' CD ' ' N ' ' A' ' 43' ' ' GLN . 53.9 Cg_endo -69.77 -172.73 0.61 Allowed 'Trans proline' 0 C--N 1.341 0.178 0 C-N-CA 122.685 2.257 . . . . 74.42 112.333 179.994 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 45' ' ' GLN . . . . . 0.997 ' HG2' HG23 ' A' ' 47' ' ' ILE . 0.3 OUTLIER -178.74 29.81 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.208 -0.451 . . . . 74.24 110.907 -179.973 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 46' ' ' ILE . . . . . 0.661 HG22 ' O ' ' A' ' 45' ' ' GLN . 0.1 OUTLIER 87.52 -18.01 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.214 -0.448 . . . . 73.15 111.184 -179.971 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 47' ' ' ILE . . . . . 0.997 HG23 ' HG2' ' A' ' 45' ' ' GLN . 0.1 OUTLIER -38.28 147.2 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.164 -0.471 . . . . 64.23 111.139 179.811 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 48' ' ' PHE . . . . . 0.86 ' HA ' HD22 ' A' ' 33' ' ' LEU . 1.9 p90 -162.02 160.93 28.19 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.149 -0.478 . . . . 64.12 110.871 179.975 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 49' ' ' GLU . . . . . 0.676 ' CG ' HD13 ' A' ' 33' ' ' LEU . 18.8 mt-10 -110.61 155.61 22.12 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.153 -0.476 . . . . 72.33 110.929 -179.948 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 50' ' ' ILE . . . . . 0.542 HD13 ' HA ' ' A' ' 30' ' ' PHE . 9.2 mm -135.44 142.28 40.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.2 -0.454 . . . . 64.12 111.142 179.935 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 89.7 m -88.12 139.18 30.77 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.168 -0.469 . . . . 74.22 111.167 179.938 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 52' ' ' LEU . . . . . 0.679 HD12 HD12 ' A' ' 66' ' ' LEU . 17.4 mt -141.12 162.63 35.04 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.232 -0.44 . . . . 64.31 110.918 179.957 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 53' ' ' ARG . . . . . 0.491 ' C ' HD21 ' A' ' 125' ' ' LEU . 0.0 OUTLIER -178.27 173.76 1.38 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.179 -0.464 . . . . 74.42 110.817 179.969 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 54' ' ' SER . . . . . 0.535 ' N ' HD21 ' A' ' 125' ' ' LEU . 10.9 p -67.46 -173.6 0.32 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.192 -0.458 . . . . 61.1 110.888 -179.801 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 55' ' ' VAL . . . . . 0.47 HG13 ' OD1' ' A' ' 126' ' ' ASP . 34.0 m -94.13 -28.94 4.21 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.169 -0.468 . . . . 62.02 111.148 179.935 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -113.54 -173.8 2.34 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.123 -0.489 . . . . 62.35 110.861 179.941 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -117.61 -13.56 10.25 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.188 -0.46 . . . . 74.32 110.878 179.986 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 58' ' ' GLU . . . . . 0.556 ' HA ' ' C ' ' A' ' 59' ' ' PRO . 5.9 pt-20 -122.67 144.11 41.69 Favored Pre-proline 0 C--N 1.329 -0.296 0 CA-C-O 121.637 0.732 . . . . 75.31 110.85 -179.975 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 59' ' ' PRO . . . . . 0.556 ' C ' ' HA ' ' A' ' 58' ' ' GLU . 53.9 Cg_endo -69.76 -5.18 8.73 Favored 'Cis proline' 0 C--N 1.342 0.2 0 C-N-CA 122.663 -1.807 . . . . 74.15 112.316 -0.042 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 60' ' ' VAL . . . . . 0.604 HG22 ' CG ' ' A' ' 129' ' ' GLN . 14.9 m -154.9 -179.5 0.25 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.256 -0.429 . . . . 72.1 111.17 179.912 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 61' ' ' GLU . . . . . 0.429 ' O ' ' C ' ' A' ' 62' ' ' SER . 1.2 pt-20 -118.91 -12.8 9.53 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.193 -0.458 . . . . 71.43 110.843 179.989 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 62' ' ' SER . . . . . 0.919 ' HB3' HD11 ' A' ' 125' ' ' LEU . 7.8 t 35.51 90.78 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.206 -0.452 . . . . 74.31 110.841 -179.811 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 6.4 t -104.87 123.04 47.02 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.117 -0.492 . . . . 75.01 110.85 -179.83 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 64' ' ' ILE . . . . . 0.625 HD11 HG11 ' A' ' 89' ' ' VAL . 20.7 mt -136.2 132.18 49.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.121 -0.491 . . . . 74.52 111.088 179.992 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 87.0 m -95.84 113.96 25.65 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.218 -0.446 . . . . 75.44 111.1 179.95 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 66' ' ' LEU . . . . . 0.774 HD11 HG21 ' A' ' 121' ' ' THR . 11.8 mt -94.54 112.62 24.39 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.236 -0.438 . . . . 75.44 110.913 179.906 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 67' ' ' HIS . . . . . 0.508 ' CE1' HD11 ' A' ' 33' ' ' LEU . 2.6 t60 -108.78 112.0 24.05 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.188 -0.46 . . . . 44.02 110.811 179.864 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 68' ' ' PHE . . . . . 0.556 ' CE1' HG23 ' A' ' 114' ' ' ILE . 0.0 OUTLIER -102.95 145.11 30.34 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.181 -0.463 . . . . 51.35 110.878 -179.946 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 69' ' ' ALA . . . . . 0.628 ' HA ' HG22 ' A' ' 47' ' ' ILE . . . -122.32 110.74 16.05 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.135 -0.484 . . . . 54.32 111.124 179.911 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 70' ' ' MET . . . . . 0.503 ' CE ' HD11 ' A' ' 114' ' ' ILE . 3.9 mmt -76.04 86.46 2.94 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.222 -0.444 . . . . 65.32 110.848 -179.998 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -40.34 156.57 0.18 Allowed Pre-proline 0 C--N 1.33 -0.274 0 CA-C-O 121.579 0.704 . . . . 70.14 111.145 -179.944 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 72' ' ' PRO . . . . . 0.409 ' O ' HD22 ' A' ' 8' ' ' LEU . 54.0 Cg_endo -69.73 1.47 4.38 Favored 'Trans proline' 0 C--N 1.341 0.161 0 C-N-CA 122.687 2.258 . . . . 41.22 112.368 179.923 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 73' ' ' MET . . . . . 0.501 ' O ' ' CB ' ' A' ' 76' ' ' TYR . 0.0 OUTLIER -118.25 -26.14 6.4 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.192 -0.458 . . . . 73.31 110.909 179.908 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 74' ' ' TYR . . . . . 0.656 ' CD1' ' C ' ' A' ' 74' ' ' TYR . 0.0 OUTLIER -48.05 150.65 1.98 Allowed Pre-proline 0 C--N 1.328 -0.346 0 CA-C-O 121.659 0.742 . . . . 75.24 110.91 -179.864 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 75' ' ' PRO . . . . . 0.546 ' C ' ' HA ' ' A' ' 74' ' ' TYR . 54.3 Cg_endo -69.76 -11.12 11.79 Favored 'Cis proline' 0 C--N 1.34 0.129 0 C-N-CA 122.684 -1.798 . . . . 75.23 112.365 -0.09 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 76' ' ' TYR . . . . . 0.501 ' CB ' ' O ' ' A' ' 73' ' ' MET . 16.4 t80 -32.82 -53.9 0.35 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.199 -0.455 . . . . 72.25 110.949 -179.96 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 77' ' ' THR . . . . . 0.427 HG23 ' HB3' ' A' ' 73' ' ' MET . 29.6 p -106.98 171.44 7.37 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.075 -0.511 . . . . 43.42 111.162 -179.947 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -85.09 130.19 53.09 Favored Pre-proline 0 C--N 1.329 -0.325 0 CA-C-O 121.566 0.698 . . . . 43.21 111.107 179.881 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 79' ' ' PRO . . . . . 0.573 ' HG3' HD11 ' A' ' 113' ' ' ILE . 53.4 Cg_endo -69.8 174.13 9.99 Favored 'Trans proline' 0 C--N 1.341 0.168 0 C-N-CA 122.675 2.25 . . . . 43.52 112.338 -179.965 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -120.45 137.69 54.2 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.223 -0.444 . . . . 62.23 110.857 -179.962 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 81' ' ' ILE . . . . . 0.598 HD13 HD13 ' A' ' 117' ' ' ILE . 13.7 mt -143.68 150.13 17.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.136 -0.484 . . . . 62.35 111.163 179.953 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 82' ' ' GLU . . . . . 0.492 ' HG3' ' CD ' ' A' ' 84' ' ' LYS . 9.5 pt-20 -149.0 147.48 28.61 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.21 -0.45 . . . . 75.43 110.915 179.959 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 83' ' ' PHE . . . . . 0.584 ' CG ' HD22 ' A' ' 94' ' ' LEU . 15.2 m-85 -90.51 140.96 29.24 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.154 -0.476 . . . . 74.02 110.851 -179.901 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 84' ' ' LYS . . . . . 0.512 ' O ' ' N ' ' A' ' 86' ' ' VAL . 8.9 mmmt -124.57 174.43 7.83 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.166 -0.47 . . . . 71.04 110.91 179.919 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 85' ' ' ASN . . . . . 0.413 ' O ' ' CG2' ' A' ' 86' ' ' VAL . 6.0 m120 59.3 -75.75 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.215 -0.448 . . . . 73.14 110.915 179.998 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 86' ' ' VAL . . . . . 0.595 HG11 HD11 ' A' ' 94' ' ' LEU . 3.5 m 41.73 92.65 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.19 -0.459 . . . . 72.22 111.104 179.901 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -96.22 -77.82 0.47 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.189 -0.46 . . . . 64.5 110.861 -179.958 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -59.71 -56.82 17.09 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.202 -0.454 . . . . 61.25 110.881 -179.937 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 89' ' ' VAL . . . . . 0.664 HG21 ' HG ' ' A' ' 94' ' ' LEU . 2.1 p -51.07 136.68 9.95 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.19 -0.459 . . . . 74.31 111.158 179.887 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 90' ' ' MET . . . . . 0.625 ' SD ' HG22 ' A' ' 134' ' ' THR . 6.8 mtm -88.97 -70.37 0.65 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.121 -0.491 . . . . 44.23 110.912 179.906 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 91' ' ' ASP . . . . . 0.433 ' HA ' HD12 ' A' ' 94' ' ' LEU . 10.3 t0 -175.19 -31.62 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.217 -0.447 . . . . 73.31 110.867 179.957 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -53.98 -46.76 71.78 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.191 -0.459 . . . . 71.4 110.85 -179.722 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 93' ' ' GLN . . . . . 0.545 ' HG3' ' CE1' ' A' ' 128' ' ' PHE . 1.7 mp0 -70.24 -37.69 75.01 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.158 -0.474 . . . . 63.23 110.908 -179.978 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 94' ' ' LEU . . . . . 0.664 ' HG ' HG21 ' A' ' 89' ' ' VAL . 48.1 mt -59.2 -47.54 84.94 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.203 -0.453 . . . . 74.33 110.96 179.995 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 1.7 mt-30 -61.42 -35.74 78.39 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.181 -0.463 . . . . 62.34 110.857 179.932 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 96' ' ' MET . . . . . . . . . . . . . 31.7 ttp -61.44 -42.25 98.46 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.21 -0.45 . . . . 74.4 110.827 -179.964 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 97' ' ' LEU . . . . . 0.643 HD22 HG22 ' A' ' 121' ' ' THR . 79.8 mt -60.02 -43.82 95.02 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.243 -0.435 . . . . 71.53 110.965 -179.995 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 98' ' ' LYS . . . . . 0.499 ' HD3' ' CE2' ' A' ' 83' ' ' PHE . 6.0 mmtp -55.49 -39.06 69.96 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.18 -0.464 . . . . 73.32 110.867 179.809 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 57.1 m -64.11 -40.2 95.69 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.25 -0.432 . . . . 60.43 110.862 -179.888 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 100' ' ' GLU . . . . . 0.575 ' OE1' ' CZ ' ' A' ' 120' ' ' PHE . 19.5 mm-40 -71.44 -27.24 63.14 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.116 -0.493 . . . . 73.31 110.91 -179.983 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 101' ' ' PHE . . . . . 0.745 ' CG ' HD11 ' A' ' 117' ' ' ILE . 10.5 m-30 -60.19 -31.12 69.84 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.173 -0.467 . . . . 64.35 110.856 -179.867 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 14.1 ttmt -73.92 -41.54 61.92 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.165 -0.47 . . . . 73.2 110.898 179.958 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 17.4 ttpp -69.82 -41.25 75.24 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.167 -0.469 . . . . 74.12 110.905 179.856 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 104' ' ' ILE . . . . . 0.562 HD12 ' O ' ' A' ' 100' ' ' GLU . 3.9 mt -64.45 -47.59 88.72 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 116.257 -0.429 . . . . 55.25 111.131 179.86 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 105' ' ' HIS . . . . . . . . . . . . . 2.1 t60 -62.82 -43.62 98.33 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.197 -0.456 . . . . 73.42 110.86 179.861 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -56.53 -43.3 79.69 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.196 -0.456 . . . . 72.22 110.872 -179.913 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 107' ' ' THR . . . . . 0.432 HG22 ' O ' ' A' ' 104' ' ' ILE . 9.9 t -77.87 -30.12 50.7 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.166 -0.47 . . . . 61.13 111.161 -179.991 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 108' ' ' SER . . . . . 0.425 ' CB ' HG22 ' A' ' 113' ' ' ILE . 27.0 m -107.05 33.08 4.15 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.221 -0.445 . . . . 71.32 110.846 -179.867 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 34.1 ttt180 -76.57 80.65 3.24 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.149 -0.478 . . . . 71.41 110.859 -179.93 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 151.21 -29.44 0.98 Allowed Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.694 -0.765 . . . . 51.11 112.484 -179.953 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 111' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -111.41 -164.43 0.92 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.784 0.326 . . . . 63.5 110.956 -179.909 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 12.2 mt-10 -67.23 133.87 50.56 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.234 -0.439 . . . . 63.22 110.839 -179.924 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 113' ' ' ILE . . . . . 0.573 HD11 ' HG3' ' A' ' 79' ' ' PRO . 2.8 pt -122.95 -16.94 5.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.096 -0.502 . . . . 44.21 111.121 179.986 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 114' ' ' ILE . . . . . 0.698 ' O ' HG23 ' A' ' 118' ' ' THR . 9.5 mm -57.18 -43.12 81.09 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 116.152 -0.476 . . . . 61.45 111.065 179.879 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 115' ' ' PHE . . . . . 0.678 ' HE1' HG21 ' A' ' 25' ' ' ILE . 20.0 t80 -70.58 -31.94 69.14 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.167 -0.47 . . . . 72.43 110.89 179.991 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 9.1 mm-40 -68.21 -47.79 66.9 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.144 -0.48 . . . . 72.01 110.862 -179.892 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 117' ' ' ILE . . . . . 0.745 HD11 ' CG ' ' A' ' 101' ' ' PHE . 0.7 OUTLIER -66.02 -42.34 91.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.134 -0.484 . . . . 71.03 111.117 -179.999 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 118' ' ' THR . . . . . 0.698 HG23 ' O ' ' A' ' 114' ' ' ILE . 70.8 p -68.01 -41.69 81.85 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.192 -0.458 . . . . 74.31 111.169 179.98 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 29.5 t -67.33 -39.71 85.84 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.199 -0.455 . . . . 71.41 110.858 -179.873 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 120' ' ' PHE . . . . . 0.575 ' CZ ' ' OE1' ' A' ' 100' ' ' GLU . 1.0 OUTLIER -67.13 -47.75 70.17 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.147 -0.479 . . . . 74.41 110.894 -179.923 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 121' ' ' THR . . . . . 0.774 HG21 HD11 ' A' ' 66' ' ' LEU . 34.8 p -65.44 -39.72 92.42 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.141 -0.481 . . . . 74.21 111.133 -179.955 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 37.6 tt0 -65.03 -47.04 78.85 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.223 -0.444 . . . . 75.4 110.907 -180.0 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 123' ' ' GLU . . . . . 0.438 ' CG ' ' N ' ' A' ' 124' ' ' LYS . 3.6 pt-20 -67.05 -44.42 80.19 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.231 -0.44 . . . . 64.45 110.88 -179.949 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 124' ' ' LYS . . . . . 0.59 ' O ' ' CE1' ' A' ' 128' ' ' PHE . 0.0 OUTLIER -70.78 -32.32 69.39 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.141 -0.481 . . . . 74.34 110.848 -180.0 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 125' ' ' LEU . . . . . 0.919 HD11 ' HB3' ' A' ' 62' ' ' SER . 1.9 tp -63.25 -42.42 99.17 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.221 -0.445 . . . . 75.24 110.91 179.933 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 126' ' ' ASP . . . . . 0.47 ' OD1' HG13 ' A' ' 55' ' ' VAL . 9.3 m-20 -59.65 -38.65 81.98 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.186 -0.461 . . . . 62.41 110.855 179.834 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 1.6 mt-10 -62.68 -36.12 81.88 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.142 -0.481 . . . . 74.42 110.862 -179.858 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 128' ' ' PHE . . . . . 0.59 ' CE1' ' O ' ' A' ' 124' ' ' LYS . 7.0 m-30 -48.58 -64.55 0.77 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.221 -0.445 . . . . 73.44 110.894 -179.93 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 129' ' ' GLN . . . . . 0.604 ' CG ' HG22 ' A' ' 60' ' ' VAL . 4.4 mt-30 -48.46 -33.31 9.12 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.115 -0.493 . . . . 74.54 110.965 -179.972 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 130' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -62.26 -48.4 80.09 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.207 -0.451 . . . . 60.3 110.892 179.998 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 131' ' ' VAL . . . . . 0.597 HG23 ' O ' ' A' ' 131' ' ' VAL . 19.3 m -137.3 92.94 0.93 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.178 -0.464 . . . . 62.14 111.13 179.937 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 132' ' ' VAL . . . . . 0.559 HG23 ' O ' ' A' ' 128' ' ' PHE . 98.8 t -106.64 147.0 12.44 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.159 -0.473 . . . . 70.34 111.142 179.927 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 133' ' ' ASN . . . . . . . . . . . . . 2.9 t-20 -122.83 97.45 5.45 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.157 -0.474 . . . . 51.31 110.903 -179.992 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 134' ' ' THR . . . . . 0.625 HG22 ' SD ' ' A' ' 90' ' ' MET . 71.6 p -124.12 -61.05 1.38 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.181 -0.463 . . . . 73.21 111.135 -179.968 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 135' ' ' GLN . . . . . 0.438 ' C ' ' O ' ' A' ' 134' ' ' THR . 0.0 OUTLIER 34.79 44.68 0.13 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.222 -0.445 . . . . 63.25 110.901 -179.948 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -165.11 39.66 0.07 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.229 -0.442 . . . . 72.33 110.881 -179.831 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 137' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -157.14 -53.33 0.08 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.136 -0.483 . . . . 70.32 110.931 179.993 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--N 1.329 -0.296 0 CA-C-N 116.187 -0.46 . . . . 65.34 110.915 179.909 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 14.4 ttm . . . . . 0 C--O 1.231 0.117 0 CA-C-O 120.761 0.315 . . . . 60.21 110.859 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 54.1 p -146.64 143.36 28.75 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.209 -0.451 . . . . 62.1 110.826 -179.821 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 28.8 mt 60.94 149.77 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.146 -0.479 . . . . 70.13 110.9 179.964 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 50.5 m -156.35 109.07 2.6 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.22 -0.446 . . . . 65.04 110.849 -179.904 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER 177.72 154.53 0.31 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.168 -0.469 . . . . 71.41 110.855 179.982 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -68.98 90.57 0.45 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.204 -0.453 . . . . 75.43 110.933 -179.974 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 1.9 t -165.45 171.63 13.09 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.202 -0.454 . . . . 74.22 111.138 179.945 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 60.5 mt -51.96 -26.15 9.85 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.197 -0.456 . . . . 74.1 110.924 179.978 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 9' ' ' ASP . . . . . 0.45 ' N ' ' OD1' ' A' ' 9' ' ' ASP . 0.8 OUTLIER -51.82 -35.23 43.63 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.18 -0.463 . . . . 55.11 110.844 179.886 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 22.3 mm100 -65.23 -40.42 94.03 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.238 -0.437 . . . . 74.44 110.914 -179.952 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 13.6 m-85 -54.69 -23.15 16.21 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.199 -0.455 . . . . 74.12 110.909 -179.862 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER -57.48 -36.39 71.41 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.124 -0.489 . . . . 71.43 110.974 -179.938 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 13' ' ' GLU . . . . . 0.496 ' HG3' ' N ' ' A' ' 14' ' ' ILE . 4.8 pt-20 -62.24 -42.09 99.01 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.084 -0.507 . . . . 72.33 110.898 179.957 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 14' ' ' ILE . . . . . 0.496 ' N ' ' HG3' ' A' ' 13' ' ' GLU . 3.9 mp -68.52 -42.75 83.88 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-N 116.147 -0.478 . . . . 75.11 111.142 179.989 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 15' ' ' GLN . . . . . 0.585 ' OE1' ' CE1' ' A' ' 74' ' ' TYR . 10.8 mm-40 -66.06 -45.9 79.71 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.184 -0.462 . . . . 35.51 110.906 179.931 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 43.2 t -59.56 -41.53 90.33 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.185 -0.461 . . . . 45.34 110.882 -179.929 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -59.71 -33.65 71.89 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.208 -0.451 . . . . 73.13 110.918 -179.925 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 7.6 mt-10 -62.67 -38.09 89.0 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.162 -0.472 . . . . 74.32 110.906 -179.997 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.464 ' CD2' HG13 ' A' ' 46' ' ' ILE . 9.9 mp -66.65 -51.64 53.86 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.122 -0.49 . . . . 53.32 110.887 -179.955 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 3.0 pt-20 -68.74 -32.7 72.67 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.18 -0.464 . . . . 72.33 110.881 179.94 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -66.66 -48.33 69.72 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.186 -0.461 . . . . 53.52 111.113 179.923 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 22' ' ' ILE . . . . . 0.638 HD11 ' HB2' ' A' ' 115' ' ' PHE . 0.9 OUTLIER -75.85 -34.68 28.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.22 -0.446 . . . . 74.41 111.116 179.984 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -55.55 -34.44 64.74 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.169 -0.469 . . . . 65.03 110.833 -179.993 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -64.96 -35.73 82.12 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.254 -0.43 . . . . 61.4 110.861 -179.816 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 25' ' ' ILE . . . . . 0.663 HG21 ' HE1' ' A' ' 115' ' ' PHE . 3.1 mt -82.86 -41.23 17.16 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.125 -0.489 . . . . 63.11 111.139 179.967 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 23.0 m-85 -109.9 45.36 1.1 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.158 -0.474 . . . . 65.34 110.899 -179.97 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 1.8 mtm -43.55 -53.64 5.45 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.144 -0.48 . . . . 54.32 110.891 179.884 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -94.85 -20.86 19.08 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.18 -0.464 . . . . 71.22 110.836 -179.985 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -88.32 19.76 3.62 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.166 -0.47 . . . . 72.04 110.887 -179.984 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 30' ' ' PHE . . . . . 0.66 ' HA ' HD13 ' A' ' 50' ' ' ILE . 1.9 t80 -105.97 145.96 30.66 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.23 -0.441 . . . . 74.53 110.887 -179.887 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 40.1 m -125.71 133.41 52.13 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.121 -0.491 . . . . 52.55 111.077 -179.849 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 1.1 t0 -97.94 115.5 28.27 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.188 -0.46 . . . . 73.54 110.891 179.882 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 1.107 HD23 ' N ' ' A' ' 34' ' ' THR . 0.1 OUTLIER -118.91 -21.21 7.85 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.2 -0.454 . . . . 71.11 110.908 -179.92 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 34' ' ' THR . . . . . 1.107 ' N ' HD23 ' A' ' 33' ' ' LEU . 2.1 m -33.91 108.81 0.06 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.183 -0.462 . . . . 53.43 111.158 179.922 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -39.46 94.74 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.244 -0.435 . . . . 73.13 110.891 179.923 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 36' ' ' ARG . . . . . 0.456 ' N ' ' O ' ' A' ' 34' ' ' THR . 83.1 mtt180 -128.8 -77.22 0.56 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.199 -0.455 . . . . 73.33 110.85 179.996 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 37' ' ' LYS . . . . . 0.419 ' O ' ' C ' ' A' ' 38' ' ' SER . 0.4 OUTLIER -107.5 151.88 24.98 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.25 -0.432 . . . . 70.32 110.913 179.948 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 38' ' ' SER . . . . . 0.419 ' C ' ' O ' ' A' ' 37' ' ' LYS . 0.6 OUTLIER 36.74 84.54 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.214 -0.448 . . . . 71.12 110.848 -179.852 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 49.5 m -147.42 -174.11 4.44 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.125 -0.489 . . . . 71.32 110.878 -179.842 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 40' ' ' TRP . . . . . . . . . . . . . 54.9 t-105 -108.78 -37.49 5.87 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.124 -0.489 . . . . 74.43 110.926 179.992 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 41.0 m-20 -124.35 156.92 36.21 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.2 -0.454 . . . . 75.23 110.892 179.943 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -125.54 73.09 1.3 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.211 -0.45 . . . . 71.24 110.913 179.984 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -152.51 58.21 2.42 Favored Pre-proline 0 C--N 1.329 -0.321 0 CA-C-O 121.589 0.709 . . . . 75.13 110.91 179.974 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.75 -166.9 0.2 Allowed 'Trans proline' 0 C--N 1.342 0.196 0 C-N-CA 122.674 2.249 . . . . 63.32 112.383 179.999 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 45' ' ' GLN . . . . . 0.961 ' HG2' HG23 ' A' ' 47' ' ' ILE . 0.1 OUTLIER -179.87 33.52 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.262 -0.426 . . . . 74.21 110.959 -179.963 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 46' ' ' ILE . . . . . 0.649 HG22 ' O ' ' A' ' 45' ' ' GLN . 0.1 OUTLIER 86.75 -12.55 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.199 -0.455 . . . . 75.45 111.136 179.964 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 47' ' ' ILE . . . . . 0.961 HG23 ' HG2' ' A' ' 45' ' ' GLN . 0.1 OUTLIER -52.41 149.18 1.36 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.157 -0.474 . . . . 72.1 111.143 179.836 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 48' ' ' PHE . . . . . 0.925 ' HA ' HD22 ' A' ' 33' ' ' LEU . 30.2 p90 -161.88 162.8 29.41 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.197 -0.456 . . . . 75.52 110.909 179.945 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 49' ' ' GLU . . . . . 0.768 ' CG ' HD13 ' A' ' 33' ' ' LEU . 5.8 mt-10 -111.91 159.74 18.09 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.146 -0.479 . . . . 74.32 110.908 -179.911 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 50' ' ' ILE . . . . . 0.66 HD13 ' HA ' ' A' ' 30' ' ' PHE . 13.1 mm -135.25 142.7 39.1 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 116.191 -0.459 . . . . 74.13 111.143 179.961 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 83.9 m -84.88 129.58 34.79 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.185 -0.461 . . . . 63.43 111.116 179.984 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 52' ' ' LEU . . . . . 0.464 ' HA ' HD23 ' A' ' 52' ' ' LEU . 12.0 mt -135.74 155.58 50.15 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.18 -0.464 . . . . 71.3 110.916 179.948 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -175.15 165.56 3.4 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.213 -0.449 . . . . 73.31 110.853 179.93 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -54.93 170.65 0.17 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.191 -0.459 . . . . 71.44 110.847 -179.785 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 18.7 m -84.43 -22.65 7.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.133 -0.485 . . . . 74.41 111.105 179.978 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -115.9 -176.99 3.05 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.151 -0.477 . . . . 75.24 110.846 179.995 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 6.1 mmmm -115.63 -7.28 12.17 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.192 -0.458 . . . . 72.43 110.927 179.955 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 58' ' ' GLU . . . . . 0.551 ' HA ' ' C ' ' A' ' 59' ' ' PRO . 44.6 mt-10 -129.01 148.17 67.89 Favored Pre-proline 0 C--N 1.33 -0.269 0 CA-C-O 121.652 0.739 . . . . 74.52 110.867 179.986 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 59' ' ' PRO . . . . . 0.551 ' C ' ' HA ' ' A' ' 58' ' ' GLU . 54.0 Cg_endo -69.73 -3.51 7.7 Favored 'Cis proline' 0 C--N 1.342 0.185 0 C-N-CA 122.686 -1.798 . . . . 63.44 112.369 -0.035 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 60' ' ' VAL . . . . . 0.501 HG22 ' CG ' ' A' ' 129' ' ' GLN . 18.6 m -148.44 179.06 0.74 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.235 -0.439 . . . . 70.32 111.132 179.94 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 61' ' ' GLU . . . . . 0.437 ' O ' ' C ' ' A' ' 62' ' ' SER . 8.7 tt0 -107.28 -17.17 14.21 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.137 -0.483 . . . . 61.54 110.886 -179.988 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 62' ' ' SER . . . . . 0.592 ' CB ' HD21 ' A' ' 125' ' ' LEU . 1.0 OUTLIER 34.15 91.0 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.137 -0.483 . . . . 34.33 110.829 -179.807 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 35.1 t -112.71 122.98 49.26 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.127 -0.488 . . . . 45.13 110.86 -179.856 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 64' ' ' ILE . . . . . 0.799 HD13 HD21 ' A' ' 94' ' ' LEU . 17.8 mt -136.53 138.63 46.36 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.121 -0.49 . . . . 63.44 111.141 179.959 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 90.5 m -104.38 113.89 27.75 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.2 -0.455 . . . . 75.15 111.112 179.974 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 66' ' ' LEU . . . . . 0.98 HD11 HG21 ' A' ' 121' ' ' THR . 7.1 mt -93.06 113.26 25.48 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.197 -0.456 . . . . 71.14 110.883 179.972 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 67' ' ' HIS . . . . . 0.624 ' CE1' HD11 ' A' ' 33' ' ' LEU . 12.6 t60 -105.13 112.56 25.73 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.179 -0.464 . . . . 72.11 110.859 179.872 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 68' ' ' PHE . . . . . 0.598 ' CZ ' HG23 ' A' ' 114' ' ' ILE . 0.0 OUTLIER -103.65 139.88 38.33 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.183 -0.462 . . . . 54.11 110.889 -179.927 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 69' ' ' ALA . . . . . 0.457 ' HA ' HG22 ' A' ' 47' ' ' ILE . . . -114.47 115.67 27.62 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.14 -0.482 . . . . 65.13 111.081 179.949 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 70' ' ' MET . . . . . 0.48 ' HE2' HD11 ' A' ' 114' ' ' ILE . 5.9 mmt -79.11 102.25 8.34 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.229 -0.441 . . . . 62.35 110.84 179.99 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -60.84 153.95 61.49 Favored Pre-proline 0 C--N 1.33 -0.255 0 CA-C-O 121.632 0.729 . . . . 74.32 111.123 -179.956 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_endo -69.73 0.47 5.57 Favored 'Trans proline' 0 C--N 1.341 0.18 0 C-N-CA 122.643 2.229 . . . . 64.15 112.342 179.906 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 73' ' ' MET . . . . . 0.657 ' HB3' HG23 ' A' ' 77' ' ' THR . 0.0 OUTLIER -114.38 -26.92 7.77 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.236 -0.438 . . . . 55.14 110.932 179.858 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 74' ' ' TYR . . . . . 0.639 ' CD1' ' C ' ' A' ' 74' ' ' TYR . 0.0 OUTLIER -47.3 149.38 1.86 Allowed Pre-proline 0 C--N 1.328 -0.349 0 CA-C-O 121.673 0.749 . . . . 74.34 110.881 -179.853 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 75' ' ' PRO . . . . . 0.551 ' C ' ' HA ' ' A' ' 74' ' ' TYR . 53.2 Cg_endo -69.78 -13.12 12.39 Favored 'Cis proline' 0 C--N 1.341 0.175 0 C-N-CA 122.709 -1.788 . . . . 61.02 112.342 -0.031 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 76' ' ' TYR . . . . . 0.476 ' CB ' ' O ' ' A' ' 73' ' ' MET . 3.3 t80 -33.44 -52.4 0.38 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.211 -0.449 . . . . 75.41 110.934 -179.91 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 77' ' ' THR . . . . . 0.657 HG23 ' HB3' ' A' ' 73' ' ' MET . 43.1 p -106.37 -176.6 3.12 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.099 -0.5 . . . . 52.43 111.189 179.99 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -105.88 130.39 23.09 Favored Pre-proline 0 C--N 1.328 -0.338 0 CA-C-O 121.597 0.713 . . . . 53.53 111.113 179.865 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 79' ' ' PRO . . . . . 0.842 ' HG3' HD11 ' A' ' 113' ' ' ILE . 53.6 Cg_endo -69.79 -170.88 0.42 Allowed 'Trans proline' 0 C--N 1.342 0.228 0 C-N-CA 122.66 2.24 . . . . 72.32 112.344 -179.949 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 80' ' ' GLU . . . . . 0.468 ' HG3' ' N ' ' A' ' 81' ' ' ILE . 0.4 OUTLIER -123.88 142.12 51.41 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.246 -0.434 . . . . 71.41 110.922 -179.957 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 81' ' ' ILE . . . . . 0.736 ' CG2' HD22 ' A' ' 66' ' ' LEU . 2.3 mm -131.37 143.25 41.15 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.176 -0.465 . . . . 74.11 111.147 179.972 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 82' ' ' GLU . . . . . 0.481 ' HG3' ' CD ' ' A' ' 84' ' ' LYS . 4.3 pt-20 -148.58 142.07 25.35 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.182 -0.463 . . . . 74.24 110.856 179.973 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 83' ' ' PHE . . . . . 0.792 ' CG ' HD22 ' A' ' 94' ' ' LEU . 36.4 m-85 -95.19 141.37 28.88 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.13 -0.487 . . . . 72.11 110.902 -179.972 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 84' ' ' LYS . . . . . 0.484 ' O ' ' N ' ' A' ' 86' ' ' VAL . 7.7 mmmt -124.17 170.26 10.9 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.116 -0.493 . . . . 73.45 110.896 179.967 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 3.3 m120 60.55 -75.68 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.209 -0.451 . . . . 73.32 110.904 179.954 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 86' ' ' VAL . . . . . 1.125 HG11 HD11 ' A' ' 94' ' ' LEU . 2.5 m 40.3 93.42 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-N 116.21 -0.45 . . . . 64.24 111.146 179.91 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -93.72 -93.61 0.17 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.1 -0.5 . . . . 63.03 110.923 -179.992 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 88' ' ' ASN . . . . . 0.424 ' CG ' HG21 ' A' ' 60' ' ' VAL . 1.3 t30 -44.44 -48.45 9.96 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.197 -0.456 . . . . 75.03 110.907 -179.931 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 89' ' ' VAL . . . . . 0.675 HG11 HD11 ' A' ' 64' ' ' ILE . 2.0 p -60.1 141.11 17.16 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.171 -0.468 . . . . 72.24 111.119 179.908 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 90' ' ' MET . . . . . . . . . . . . . 5.5 mtm -92.55 -63.98 1.16 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.182 -0.463 . . . . 72.32 110.883 179.911 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 1.4 t0 173.88 -27.44 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.231 -0.441 . . . . 74.54 110.907 -179.997 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -54.38 -47.05 73.12 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.194 -0.457 . . . . 70.22 110.859 -179.745 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 93' ' ' GLN . . . . . 0.435 ' HB2' ' CD2' ' A' ' 128' ' ' PHE . 0.8 OUTLIER -71.08 -36.94 72.44 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.14 -0.482 . . . . 75.24 110.934 179.999 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 94' ' ' LEU . . . . . 1.125 HD11 HG11 ' A' ' 86' ' ' VAL . 21.9 mt -57.95 -44.21 86.87 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.198 -0.456 . . . . 72.31 110.922 -179.983 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 2.9 mm-40 -63.76 -35.26 80.0 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.203 -0.453 . . . . 72.51 110.873 179.954 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 96' ' ' MET . . . . . . . . . . . . . 23.1 ttp -59.99 -44.35 94.58 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.226 -0.443 . . . . 75.13 110.918 179.935 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 97' ' ' LEU . . . . . 0.525 HD22 ' HA ' ' A' ' 121' ' ' THR . 34.5 mt -57.79 -41.95 83.13 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.246 -0.434 . . . . 54.34 110.903 179.987 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 98' ' ' LYS . . . . . 0.436 ' HD3' ' CE2' ' A' ' 83' ' ' PHE . 12.9 mmtm -54.64 -37.09 65.26 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.151 -0.477 . . . . 62.44 110.927 179.819 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -68.81 -41.97 77.92 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.249 -0.432 . . . . 73.21 110.877 -179.894 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -69.17 -26.01 64.64 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.105 -0.498 . . . . 62.41 110.869 -179.98 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 101' ' ' PHE . . . . . 0.796 ' CD2' HD11 ' A' ' 117' ' ' ILE . 10.6 m-30 -59.7 -33.12 71.19 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.161 -0.472 . . . . 72.23 110.895 -179.92 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -63.99 -44.13 93.62 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.155 -0.475 . . . . 73.33 110.899 179.948 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.86 -36.17 77.79 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.238 -0.437 . . . . 73.01 110.934 179.846 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 104' ' ' ILE . . . . . 0.429 ' O ' HG22 ' A' ' 107' ' ' THR . 5.2 mt -63.22 -47.65 91.25 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.216 -0.447 . . . . 64.42 111.128 179.865 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 105' ' ' HIS . . . . . . . . . . . . . 5.9 t60 -62.96 -41.8 99.64 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.209 -0.45 . . . . 75.43 110.872 179.86 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -58.91 -43.6 91.1 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.231 -0.44 . . . . 72.31 110.896 -179.958 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 107' ' ' THR . . . . . 0.429 HG22 ' O ' ' A' ' 104' ' ' ILE . 10.2 t -76.75 -27.9 55.54 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.144 -0.48 . . . . 74.33 111.152 -179.973 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 60.2 m -114.37 37.44 3.37 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.188 -0.46 . . . . 71.44 110.883 -179.83 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 18.7 ttt180 -81.6 77.44 8.45 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.088 -0.506 . . . . 64.04 110.88 -179.949 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 154.1 -15.12 0.58 Allowed Glycine 0 N--CA 1.451 -0.334 0 C-N-CA 120.757 -0.735 . . . . 51.22 112.493 -179.97 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 111' ' ' GLN . . . . . . . . . . . . . 14.3 pt20 -130.0 -166.21 1.64 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.754 0.311 . . . . 74.41 110.901 -179.886 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 66.1 mt-10 -61.4 131.87 51.65 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.158 -0.474 . . . . 65.4 110.918 -179.921 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 113' ' ' ILE . . . . . 0.842 HD11 ' HG3' ' A' ' 79' ' ' PRO . 20.6 pt -121.25 -8.11 9.91 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-N 116.163 -0.472 . . . . 73.15 111.128 179.966 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 114' ' ' ILE . . . . . 0.603 ' O ' HG23 ' A' ' 118' ' ' THR . 27.7 mm -66.52 -44.77 90.05 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-N 116.153 -0.476 . . . . 75.44 111.175 179.867 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 115' ' ' PHE . . . . . 0.663 ' HE1' HG21 ' A' ' 25' ' ' ILE . 28.8 t80 -68.04 -33.47 74.64 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.195 -0.457 . . . . 73.24 110.856 179.894 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 -67.79 -47.02 70.32 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.195 -0.457 . . . . 42.52 110.937 -179.928 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 117' ' ' ILE . . . . . 0.796 HD11 ' CD2' ' A' ' 101' ' ' PHE . 0.4 OUTLIER -64.18 -39.4 85.35 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.103 -0.499 . . . . 74.23 111.151 179.946 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 118' ' ' THR . . . . . 0.603 HG23 ' O ' ' A' ' 114' ' ' ILE . 74.2 p -68.19 -43.38 78.23 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.158 -0.474 . . . . 73.2 111.144 179.956 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -63.0 -44.09 96.99 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.258 -0.428 . . . . 72.32 110.906 -179.88 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -68.29 -46.62 69.83 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.103 -0.498 . . . . 72.13 110.883 -179.964 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 121' ' ' THR . . . . . 0.98 HG21 HD11 ' A' ' 66' ' ' LEU . 14.7 p -62.97 -39.18 93.91 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.089 -0.505 . . . . 75.41 111.148 -179.905 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 7.2 tp-100 -65.71 -45.14 83.87 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.218 -0.446 . . . . 64.14 110.958 179.999 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 6.4 pt-20 -74.0 -29.89 62.19 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.148 -0.478 . . . . 72.14 110.881 -179.952 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 124' ' ' LYS . . . . . 0.501 ' HA ' ' CE ' ' A' ' 124' ' ' LYS . 0.0 OUTLIER -75.51 -45.48 37.95 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.165 -0.47 . . . . 74.53 110.894 179.971 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 125' ' ' LEU . . . . . 0.98 HD13 ' N ' ' A' ' 126' ' ' ASP . 0.0 OUTLIER -69.5 -42.84 74.22 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.205 -0.452 . . . . 73.44 110.957 179.917 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 126' ' ' ASP . . . . . 0.98 ' N ' HD13 ' A' ' 125' ' ' LEU . 14.3 t0 -60.25 -45.69 92.39 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.181 -0.463 . . . . 73.02 110.893 179.804 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 127' ' ' GLU . . . . . 0.489 ' HG3' ' N ' ' A' ' 128' ' ' PHE . 0.3 OUTLIER -60.94 -27.86 68.53 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.227 -0.442 . . . . 72.53 110.87 -179.922 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 128' ' ' PHE . . . . . 0.6 ' CD1' HG23 ' A' ' 132' ' ' VAL . 0.1 OUTLIER -73.96 -50.34 20.42 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.194 -0.457 . . . . 55.1 110.922 -179.95 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 129' ' ' GLN . . . . . 0.501 ' CG ' HG22 ' A' ' 60' ' ' VAL . 1.5 tm0? -58.18 -14.61 7.38 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.181 -0.463 . . . . 71.34 110.941 -179.967 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 130' ' ' ASN . . . . . . . . . . . . . 13.0 t30 -58.29 -62.52 1.78 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.158 -0.474 . . . . 64.32 110.892 -179.973 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 131' ' ' VAL . . . . . 0.471 ' O ' ' O ' ' A' ' 132' ' ' VAL . 14.9 m -128.98 -27.35 0.99 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.144 -0.48 . . . . 72.14 111.13 179.902 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 132' ' ' VAL . . . . . 0.856 HG13 ' N ' ' A' ' 133' ' ' ASN . 0.4 OUTLIER 38.2 -162.34 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.19 -0.459 . . . . 75.3 111.107 179.86 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 133' ' ' ASN . . . . . 0.856 ' N ' HG13 ' A' ' 132' ' ' VAL . 0.6 OUTLIER -89.74 -58.02 2.66 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.159 -0.473 . . . . 71.23 110.868 179.992 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 134' ' ' THR . . . . . . . . . . . . . 58.8 m -133.8 141.56 47.51 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.198 -0.456 . . . . 73.54 111.122 -179.985 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -178.54 135.85 0.15 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.182 -0.463 . . . . 62.43 110.961 179.972 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 11.0 t -163.08 173.36 13.63 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.219 -0.446 . . . . 74.21 110.88 -179.781 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 137' ' ' LEU . . . . . . . . . . . . . 2.0 mp -107.48 142.81 36.77 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.156 -0.475 . . . . 64.35 110.928 -179.981 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.33 -0.271 0 CA-C-N 116.218 -0.446 . . . . 73.54 110.866 179.932 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.232 0.134 0 CA-C-O 120.735 0.302 . . . . 73.11 110.882 . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 24.3 m -41.0 121.15 1.47 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.235 -0.438 . . . . 52.44 110.87 -179.797 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 3.7 pp -50.48 -18.0 0.58 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.108 -0.496 . . . . 42.14 110.917 179.995 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 87.4 p -73.27 152.55 40.95 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.199 -0.455 . . . . 64.54 110.882 -179.963 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 5' ' ' HIS . . . . . 0.422 ' O ' ' C ' ' A' ' 6' ' ' LEU . 1.6 m80 56.07 167.67 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.159 -0.473 . . . . 73.25 110.855 179.995 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 6' ' ' LEU . . . . . 0.422 ' C ' ' O ' ' A' ' 5' ' ' HIS . 0.3 OUTLIER 36.29 84.72 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.23 -0.441 . . . . 74.44 110.919 -179.983 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 11.3 t -87.44 158.84 18.88 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.228 -0.442 . . . . 71.12 111.161 179.953 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.636 HD13 ' O ' ' A' ' 72' ' ' PRO . 19.3 mt -61.54 -22.53 65.24 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.208 -0.451 . . . . 75.32 110.917 179.945 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 9' ' ' ASP . . . . . 0.42 ' OD1' ' N ' ' A' ' 9' ' ' ASP . 0.4 OUTLIER -55.63 -28.0 52.84 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.188 -0.46 . . . . 75.44 110.903 179.842 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 75.1 mm-40 -68.05 -36.79 80.45 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.227 -0.442 . . . . 45.4 110.895 -179.931 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 23.8 m-85 -63.94 -25.78 68.29 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.206 -0.452 . . . . 73.13 110.927 -179.879 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -59.4 -37.55 78.28 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.144 -0.48 . . . . 73.55 110.913 -179.916 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 2.2 mm-40 -60.23 -45.42 93.28 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.149 -0.478 . . . . 60.02 110.898 -179.985 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 3.7 mp -68.03 -41.06 84.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.098 -0.501 . . . . 70.22 111.166 179.954 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 15' ' ' GLN . . . . . 0.427 ' HG2' ' CB ' ' A' ' 70' ' ' MET . 0.8 OUTLIER -63.16 -47.87 80.84 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.207 -0.451 . . . . 72.41 110.961 179.895 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 3.8 t -58.83 -43.17 90.62 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.179 -0.464 . . . . 71.43 110.859 -179.938 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 1.1 t30 -57.79 -33.65 68.77 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.192 -0.458 . . . . 74.31 110.898 -179.854 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 4.9 mt-10 -66.1 -37.7 86.4 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.155 -0.475 . . . . 70.32 110.87 179.99 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.446 ' CD2' HG13 ' A' ' 46' ' ' ILE . 9.7 mp -64.99 -51.53 61.18 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.199 -0.455 . . . . 75.4 110.897 -179.939 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 1.5 pt-20 -68.58 -33.49 74.16 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.2 -0.455 . . . . 65.11 110.837 179.977 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -65.89 -49.63 67.37 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.214 -0.448 . . . . 74.12 111.116 179.967 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 22' ' ' ILE . . . . . 0.73 HD11 ' HB2' ' A' ' 115' ' ' PHE . 0.6 OUTLIER -74.9 -34.41 32.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.2 -0.455 . . . . 60.41 111.172 179.928 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 4.1 mtp180 -52.32 -36.61 53.74 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.126 -0.488 . . . . 74.02 110.88 179.957 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -63.5 -34.14 77.12 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.188 -0.46 . . . . 64.44 110.837 -179.777 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 25' ' ' ILE . . . . . 0.763 HD13 ' CE1' ' A' ' 115' ' ' PHE . 3.3 mt -82.73 -43.52 18.8 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.145 -0.48 . . . . 71.11 111.155 179.922 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 26.6 m-85 -108.82 46.62 0.96 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.156 -0.475 . . . . 75.04 110.929 -179.972 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 1.2 mtm -46.02 -58.35 3.66 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.099 -0.5 . . . . 73.13 110.846 179.948 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 20.2 m-20 -92.06 -5.65 52.47 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.259 -0.428 . . . . 74.11 110.881 179.952 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 29' ' ' ASP . . . . . 0.448 ' O ' HG23 ' A' ' 50' ' ' ILE . 1.7 m-20 -102.96 30.28 4.9 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.213 -0.449 . . . . 72.33 110.865 179.991 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 30' ' ' PHE . . . . . 0.556 ' CE2' ' HB2' ' A' ' 48' ' ' PHE . 8.8 t80 -117.72 144.09 45.6 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.216 -0.447 . . . . 65.4 110.901 -179.93 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 21.9 m -123.52 133.07 54.05 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.152 -0.477 . . . . 71.44 111.115 -179.905 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -94.36 114.23 26.25 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.197 -0.456 . . . . 73.13 110.879 179.907 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.8 HD21 HG12 ' A' ' 47' ' ' ILE . 1.7 pt? -113.52 -14.49 12.69 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.231 -0.44 . . . . 74.43 110.92 -179.947 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 34' ' ' THR . . . . . 0.477 HG22 ' H ' ' A' ' 35' ' ' LYS . 0.2 OUTLIER -49.11 -179.35 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.148 -0.478 . . . . 42.44 111.147 179.966 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 35' ' ' LYS . . . . . 0.477 ' H ' HG22 ' A' ' 34' ' ' THR . 0.0 OUTLIER -78.08 10.56 2.83 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.221 -0.445 . . . . 64.35 110.871 179.932 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 3.8 mtp85 -46.3 -58.93 3.25 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.239 -0.437 . . . . 75.12 110.843 179.982 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -75.43 152.22 38.0 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.148 -0.478 . . . . 73.31 110.868 -179.984 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER 58.89 174.69 0.07 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.183 -0.462 . . . . 64.21 110.869 -179.892 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 14.4 m -138.95 143.75 38.72 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.135 -0.484 . . . . 74.11 110.88 -179.853 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 40' ' ' TRP . . . . . . . . . . . . . 13.2 t-105 173.9 -39.64 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.141 -0.481 . . . . 72.23 110.894 179.976 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 25.8 t70 -138.99 143.11 38.36 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.274 -0.421 . . . . 75.41 110.905 179.919 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 3.9 mttt -121.16 72.16 0.98 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.21 -0.45 . . . . 74.35 110.872 -179.953 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -152.46 66.39 6.36 Favored Pre-proline 0 C--N 1.328 -0.342 0 CA-C-O 121.59 0.709 . . . . 75.43 110.93 179.937 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 44' ' ' PRO . . . . . 0.404 ' HB3' ' CD ' ' A' ' 35' ' ' LYS . 54.1 Cg_endo -69.77 151.51 69.05 Favored 'Trans proline' 0 N--CA 1.465 -0.162 0 C-N-CA 122.688 2.259 . . . . 52.43 112.385 179.981 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 45' ' ' GLN . . . . . 0.573 ' O ' HG22 ' A' ' 46' ' ' ILE . 31.5 tt0 -112.23 -3.65 14.56 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.219 -0.446 . . . . 75.45 110.918 179.998 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 46' ' ' ILE . . . . . 0.638 ' O ' HG23 ' A' ' 46' ' ' ILE . 0.0 OUTLIER 84.63 5.65 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.247 -0.433 . . . . 65.03 111.125 179.951 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 47' ' ' ILE . . . . . 0.8 HG12 HD21 ' A' ' 33' ' ' LEU . 0.2 OUTLIER -63.54 141.57 17.97 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.159 -0.473 . . . . 64.45 111.15 179.82 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 48' ' ' PHE . . . . . 0.556 ' HB2' ' CE2' ' A' ' 30' ' ' PHE . 8.5 p90 -147.44 150.53 34.8 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.126 -0.488 . . . . 64.52 110.882 179.964 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 49' ' ' GLU . . . . . 0.537 ' CG ' HD13 ' A' ' 33' ' ' LEU . 11.5 mt-10 -108.46 157.15 18.7 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.15 -0.477 . . . . 71.43 110.866 -179.903 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 50' ' ' ILE . . . . . 0.538 HD13 ' HA ' ' A' ' 30' ' ' PHE . 26.0 mm -136.15 141.87 40.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.159 -0.473 . . . . 74.43 111.126 179.969 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 52.8 m -89.39 126.36 35.51 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.197 -0.456 . . . . 71.02 111.125 179.949 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 52' ' ' LEU . . . . . 0.661 HD12 HD12 ' A' ' 66' ' ' LEU . 23.7 mt -130.34 162.05 29.93 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.212 -0.449 . . . . 73.11 110.921 179.95 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -179.26 173.88 1.08 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.207 -0.452 . . . . 72.24 110.859 179.919 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -64.69 166.66 8.42 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.207 -0.451 . . . . 73.32 110.857 -179.78 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 16.4 m -77.73 -28.56 15.74 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.11 -0.495 . . . . 74.12 111.099 179.988 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 3.1 t0 -118.78 -168.16 1.5 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.191 -0.459 . . . . 71.51 110.88 179.878 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 1.3 mmmp? -118.04 -16.81 9.79 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.208 -0.451 . . . . 73.41 110.877 -179.953 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 58' ' ' GLU . . . . . 0.563 ' HA ' ' C ' ' A' ' 59' ' ' PRO . 43.0 mt-10 -118.27 143.05 32.26 Favored Pre-proline 0 C--N 1.329 -0.31 0 CA-C-O 121.597 0.713 . . . . 71.13 110.921 179.969 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 59' ' ' PRO . . . . . 0.563 ' C ' ' HA ' ' A' ' 58' ' ' GLU . 53.6 Cg_endo -69.83 -10.89 11.87 Favored 'Cis proline' 0 C--O 1.232 0.191 0 C-N-CA 122.701 -1.791 . . . . 60.25 112.324 0.095 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 60' ' ' VAL . . . . . 0.483 HG22 ' CG ' ' A' ' 129' ' ' GLN . 9.4 m -149.41 172.11 1.68 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.236 -0.438 . . . . 65.22 111.128 179.91 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 61' ' ' GLU . . . . . 0.447 ' O ' ' C ' ' A' ' 62' ' ' SER . 1.0 OUTLIER -109.23 -16.64 14.02 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.155 -0.475 . . . . 54.02 110.879 -179.929 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 62' ' ' SER . . . . . 0.484 ' HB3' HD11 ' A' ' 125' ' ' LEU . 0.3 OUTLIER 34.2 88.54 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.137 -0.483 . . . . 61.24 110.888 -179.802 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 15.6 t -105.93 123.44 47.99 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.131 -0.486 . . . . 70.02 110.842 -179.799 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 64' ' ' ILE . . . . . 0.529 HD13 HD11 ' A' ' 94' ' ' LEU . 50.3 mt -141.01 137.88 34.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.124 -0.489 . . . . 73.51 111.172 179.937 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 62.5 m -97.68 114.75 26.78 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.173 -0.467 . . . . 71.43 111.206 179.918 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 66' ' ' LEU . . . . . 0.661 HD12 HD12 ' A' ' 52' ' ' LEU . 11.0 mt -91.46 111.85 23.52 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.221 -0.445 . . . . 44.31 110.96 179.951 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 1.1 t60 -107.72 112.29 24.9 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.209 -0.451 . . . . 73.32 110.839 179.899 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 68' ' ' PHE . . . . . 0.593 ' CZ ' HG23 ' A' ' 114' ' ' ILE . 0.0 OUTLIER -103.19 141.06 36.52 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.18 -0.464 . . . . 72.11 110.857 -179.91 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -122.43 128.72 51.26 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.161 -0.472 . . . . 74.33 111.101 179.893 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 70' ' ' MET . . . . . 0.427 ' CB ' ' HG2' ' A' ' 15' ' ' GLN . 0.1 OUTLIER -94.6 110.08 21.93 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.222 -0.445 . . . . 75.12 110.905 179.959 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -62.38 157.98 51.37 Favored Pre-proline 0 C--N 1.33 -0.257 0 CA-C-O 121.61 0.719 . . . . 62.33 111.157 -179.931 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 72' ' ' PRO . . . . . 0.636 ' O ' HD13 ' A' ' 8' ' ' LEU . 53.8 Cg_endo -69.78 2.52 3.47 Favored 'Trans proline' 0 C--N 1.342 0.2 0 C-N-CA 122.695 2.264 . . . . 71.03 112.318 179.989 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 73' ' ' MET . . . . . 0.507 ' O ' ' CB ' ' A' ' 76' ' ' TYR . 1.3 mtp -120.01 -25.39 5.8 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.23 -0.441 . . . . 52.23 110.854 179.952 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 74' ' ' TYR . . . . . 0.648 ' CD1' ' C ' ' A' ' 74' ' ' TYR . 0.1 OUTLIER -47.89 148.65 2.72 Favored Pre-proline 0 C--N 1.329 -0.325 0 CA-C-O 121.699 0.762 . . . . 62.42 110.885 -179.84 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 75' ' ' PRO . . . . . 0.553 ' C ' ' HA ' ' A' ' 74' ' ' TYR . 53.7 Cg_endo -69.8 -14.41 12.56 Favored 'Cis proline' 0 C--N 1.342 0.207 0 C-N-CA 122.631 -1.82 . . . . 75.32 112.348 -0.051 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 76' ' ' TYR . . . . . 0.507 ' CB ' ' O ' ' A' ' 73' ' ' MET . 10.3 t80 -33.36 -45.14 0.15 Allowed 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.215 -0.448 . . . . 75.41 110.928 -179.926 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 77' ' ' THR . . . . . 0.482 HG23 ' CB ' ' A' ' 73' ' ' MET . 59.7 p -110.82 178.12 4.46 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.077 -0.51 . . . . 73.02 111.147 -179.957 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -94.81 133.22 26.9 Favored Pre-proline 0 C--N 1.329 -0.301 0 CA-C-O 121.571 0.7 . . . . 54.2 111.091 179.856 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 79' ' ' PRO . . . . . 0.488 ' HG3' ' CD1' ' A' ' 113' ' ' ILE . 53.9 Cg_endo -69.74 -163.74 0.11 Allowed 'Trans proline' 0 C--N 1.341 0.138 0 C-N-CA 122.687 2.258 . . . . 54.44 112.32 -179.985 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 80' ' ' GLU . . . . . 0.4 ' O ' HG13 ' A' ' 81' ' ' ILE . 3.3 tt0 -148.52 136.61 21.0 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.192 -0.458 . . . . 24.33 110.884 -179.996 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 81' ' ' ILE . . . . . 0.533 HD13 HD13 ' A' ' 117' ' ' ILE . 12.4 mt -143.51 150.53 17.3 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.147 -0.479 . . . . 63.13 111.101 179.995 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 82' ' ' GLU . . . . . 0.494 ' HG3' ' CD ' ' A' ' 84' ' ' LYS . 10.1 pt-20 -147.69 148.25 30.83 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.156 -0.474 . . . . 72.41 110.871 179.956 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 83' ' ' PHE . . . . . 0.508 ' CZ ' ' HD3' ' A' ' 98' ' ' LYS . 8.0 m-85 -88.28 140.84 29.06 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.149 -0.478 . . . . 75.02 110.871 -179.92 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 84' ' ' LYS . . . . . 0.494 ' CD ' ' HG3' ' A' ' 82' ' ' GLU . 7.8 mmmt -125.68 174.57 8.2 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.179 -0.464 . . . . 72.33 110.91 179.927 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 85' ' ' ASN . . . . . 0.419 ' C ' HG22 ' A' ' 86' ' ' VAL . 3.8 m120 61.99 -74.32 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.214 -0.448 . . . . 64.41 110.882 179.938 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 86' ' ' VAL . . . . . 0.867 HG11 HD21 ' A' ' 94' ' ' LEU . 3.5 m 41.42 90.53 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.227 -0.442 . . . . 63.03 111.132 179.924 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -102.89 -67.8 0.86 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.141 -0.481 . . . . 73.21 110.962 -179.992 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 88' ' ' ASN . . . . . 0.445 ' CG ' ' HB ' ' A' ' 60' ' ' VAL . 13.3 m120 -88.24 55.46 3.44 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.212 -0.449 . . . . 74.13 110.857 -179.958 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 89' ' ' VAL . . . . . 0.723 HG21 HD13 ' A' ' 94' ' ' LEU . 1.6 p -156.21 138.48 6.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.171 -0.468 . . . . 73.34 111.102 179.891 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 90' ' ' MET . . . . . . . . . . . . . 11.2 mtm -83.95 -71.17 0.52 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.146 -0.479 . . . . 73.02 110.863 179.949 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 1.1 p30 176.9 -28.67 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.2 -0.454 . . . . 52.34 110.874 179.923 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -53.85 -44.11 70.07 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.228 -0.442 . . . . 74.14 110.824 -179.791 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 93' ' ' GLN . . . . . 0.527 ' HG3' ' CE2' ' A' ' 128' ' ' PHE . 0.1 OUTLIER -70.55 -38.55 74.17 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.129 -0.487 . . . . 73.14 110.892 -179.922 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 94' ' ' LEU . . . . . 0.867 HD21 HG11 ' A' ' 86' ' ' VAL . 0.1 OUTLIER -58.99 -49.2 78.78 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.192 -0.458 . . . . 73.4 110.891 -179.972 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 26.6 mt-30 -62.84 -34.69 77.86 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.203 -0.453 . . . . 65.25 110.938 179.911 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 96' ' ' MET . . . . . . . . . . . . . 24.2 ttp -61.12 -37.7 83.74 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.2 -0.454 . . . . 53.51 110.861 179.949 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 97' ' ' LEU . . . . . 0.945 HD22 HG22 ' A' ' 121' ' ' THR . 83.5 mt -65.33 -43.13 91.93 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.264 -0.425 . . . . 75.11 110.94 179.992 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 98' ' ' LYS . . . . . 0.508 ' HD3' ' CZ ' ' A' ' 83' ' ' PHE . 6.7 mmtp -58.67 -36.68 74.54 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.164 -0.471 . . . . 54.41 110.922 179.853 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -64.2 -44.93 90.46 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.187 -0.46 . . . . 75.23 110.817 -179.899 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 100' ' ' GLU . . . . . 0.511 ' HG2' ' CE1' ' A' ' 120' ' ' PHE . 2.5 mp0 -69.62 -25.39 63.92 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.137 -0.483 . . . . 71.54 110.868 -179.9 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 101' ' ' PHE . . . . . 0.793 ' CG ' HD11 ' A' ' 117' ' ' ILE . 11.9 m-30 -60.06 -34.98 74.16 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.185 -0.461 . . . . 74.34 110.896 -179.927 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 4.2 tppp? -70.79 -38.78 73.39 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.187 -0.461 . . . . 73.51 110.877 179.954 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 25.2 mtmm -70.39 -42.9 71.11 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.187 -0.461 . . . . 72.42 110.881 179.92 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 104' ' ' ILE . . . . . 0.491 HD12 ' O ' ' A' ' 100' ' ' GLU . 3.9 mt -62.19 -47.38 93.39 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.224 -0.444 . . . . 72.12 111.133 179.883 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 105' ' ' HIS . . . . . . . . . . . . . 7.7 t60 -62.65 -42.63 99.71 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.17 -0.468 . . . . 74.21 110.815 179.887 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 1.2 m-20 -59.4 -43.52 92.97 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.195 -0.457 . . . . 75.55 110.888 -179.875 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 107' ' ' THR . . . . . 0.41 HG22 ' O ' ' A' ' 104' ' ' ILE . 8.9 t -76.84 -27.64 55.18 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.192 -0.458 . . . . 62.22 111.12 -179.995 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 108' ' ' SER . . . . . 0.502 ' HB3' HG22 ' A' ' 113' ' ' ILE . 0.4 OUTLIER -114.84 36.21 3.95 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.267 -0.424 . . . . 70.43 110.813 -179.83 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -78.38 75.38 4.9 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.185 -0.461 . . . . 73.24 110.877 -179.972 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 162.06 -27.34 0.26 Allowed Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.765 -0.731 . . . . 73.31 112.504 -179.986 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 111' ' ' GLN . . . . . . . . . . . . . 2.6 pt20 -120.06 -168.38 1.6 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.779 0.323 . . . . 73.21 110.94 -179.917 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 28.4 mt-10 -53.71 135.32 41.33 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.198 -0.456 . . . . 73.22 110.898 -179.961 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 113' ' ' ILE . . . . . 0.502 HG22 ' HB3' ' A' ' 108' ' ' SER . 1.2 pt -126.5 -25.74 1.48 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 116.125 -0.488 . . . . 74.05 111.11 179.981 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 114' ' ' ILE . . . . . 0.654 ' O ' HG23 ' A' ' 118' ' ' THR . 1.1 mp -57.07 -44.46 83.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.188 -0.46 . . . . 73.03 111.129 179.865 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 115' ' ' PHE . . . . . 0.763 ' CE1' HD13 ' A' ' 25' ' ' ILE . 39.8 t80 -64.35 -35.33 80.52 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.155 -0.475 . . . . 73.11 110.875 179.926 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 37.1 mm-40 -67.89 -44.87 76.0 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.13 -0.486 . . . . 75.52 110.903 -179.92 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 117' ' ' ILE . . . . . 0.793 HD11 ' CG ' ' A' ' 101' ' ' PHE . 0.3 OUTLIER -65.94 -40.83 88.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.153 -0.476 . . . . 61.12 111.114 179.987 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 118' ' ' THR . . . . . 0.654 HG23 ' O ' ' A' ' 114' ' ' ILE . 66.6 p -67.6 -43.86 79.46 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.177 -0.465 . . . . 73.53 111.175 179.911 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 45.2 t -68.32 -39.39 81.98 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.218 -0.446 . . . . 72.04 110.829 -179.814 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 120' ' ' PHE . . . . . 0.511 ' CE1' ' HG2' ' A' ' 100' ' ' GLU . 4.1 t80 -68.98 -48.13 63.9 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.115 -0.493 . . . . 63.11 110.904 -179.956 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 121' ' ' THR . . . . . 0.945 HG22 HD22 ' A' ' 97' ' ' LEU . 75.6 p -63.7 -39.98 95.66 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.129 -0.487 . . . . 74.13 111.108 -179.909 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -64.63 -50.66 66.25 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.213 -0.449 . . . . 64.12 110.895 -179.981 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 123' ' ' GLU . . . . . 0.43 ' CG ' ' N ' ' A' ' 124' ' ' LYS . 5.7 pt-20 -65.87 -43.82 87.22 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.191 -0.459 . . . . 62.24 110.929 -179.97 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 124' ' ' LYS . . . . . 0.468 ' HA ' ' CE ' ' A' ' 124' ' ' LYS . 0.1 OUTLIER -68.77 -31.74 70.99 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.167 -0.47 . . . . 65.11 110.917 179.949 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 125' ' ' LEU . . . . . 0.846 ' O ' HD12 ' A' ' 125' ' ' LEU . 1.1 tp -71.47 -43.47 66.56 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.194 -0.457 . . . . 74.11 110.913 179.933 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 6.3 t0 -68.88 -46.6 68.0 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.168 -0.469 . . . . 75.44 110.881 179.843 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 127' ' ' GLU . . . . . 0.445 ' CG ' ' HA ' ' A' ' 124' ' ' LYS . 1.0 OUTLIER -60.26 -27.85 67.58 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.164 -0.471 . . . . 64.04 110.886 -179.901 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 128' ' ' PHE . . . . . 0.527 ' CE2' ' HG3' ' A' ' 93' ' ' GLN . 0.2 OUTLIER -78.99 -52.22 8.53 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.132 -0.485 . . . . 75.54 110.893 -179.909 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 129' ' ' GLN . . . . . 0.483 ' CG ' HG22 ' A' ' 60' ' ' VAL . 1.2 tm0? -54.69 -36.91 65.17 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.152 -0.476 . . . . 73.52 110.912 -179.946 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 130' ' ' ASN . . . . . . . . . . . . . 1.7 m-20 -79.82 -77.61 0.18 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.18 -0.464 . . . . 75.03 110.871 -179.958 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 2.7 p 179.4 -39.66 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.155 -0.475 . . . . 74.42 111.15 179.97 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 132' ' ' VAL . . . . . 0.505 HG13 ' O ' ' A' ' 132' ' ' VAL . 9.4 p -179.63 42.36 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.185 -0.461 . . . . 44.4 111.12 179.925 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 133' ' ' ASN . . . . . . . . . . . . . 1.7 m-20 -106.62 98.36 8.04 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.202 -0.454 . . . . 62.22 110.873 -179.978 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 134' ' ' THR . . . . . . . . . . . . . 32.4 p -98.62 96.68 8.11 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.171 -0.468 . . . . 54.24 111.178 179.966 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 24.4 pt20 -133.85 167.9 19.72 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.215 -0.448 . . . . 71.55 110.915 179.991 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 89.9 p -121.12 114.96 22.19 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.217 -0.447 . . . . 75.55 110.889 -179.856 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 137' ' ' LEU . . . . . . . . . . . . . 2.1 mm? -98.16 173.29 7.09 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.146 -0.479 . . . . 73.23 110.876 -179.939 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 6.4 mm-40 . . . . . 0 C--N 1.33 -0.277 0 CA-C-N 116.193 -0.458 . . . . 74.21 110.891 179.947 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.23 0.073 0 CA-C-O 120.815 0.34 . . . . 71.52 110.838 . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -103.43 155.01 18.82 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.214 -0.448 . . . . 52.12 110.876 -179.83 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -131.17 -62.05 0.9 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.132 -0.486 . . . . 61.31 110.925 179.962 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER 175.07 89.11 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.181 -0.463 . . . . 54.45 110.893 -179.968 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 3.0 m170 56.07 164.32 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.182 -0.463 . . . . 72.15 110.843 -179.966 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER 41.91 86.27 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.179 -0.464 . . . . 50.15 110.889 -179.936 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 7' ' ' THR . . . . . 0.445 ' OG1' ' N ' ' A' ' 8' ' ' LEU . 0.0 OUTLIER -178.72 171.63 1.46 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.2 -0.454 . . . . 73.23 111.137 179.964 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.623 HD13 ' O ' ' A' ' 72' ' ' PRO . 18.3 mt -52.94 -27.45 18.94 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.219 -0.446 . . . . 73.22 110.905 179.972 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 9.8 t70 -53.59 -28.47 32.43 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.157 -0.474 . . . . 42.44 110.891 179.823 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 10' ' ' GLN . . . . . 0.432 ' O ' ' HG2' ' A' ' 13' ' ' GLU . 7.5 mm100 -68.13 -38.65 82.43 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.208 -0.451 . . . . 71.51 110.93 -179.944 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 25.9 m-85 -70.37 -21.85 62.83 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.189 -0.46 . . . . 71.44 110.893 -179.867 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -57.23 -41.17 79.01 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.133 -0.485 . . . . 75.43 110.939 -179.952 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 13' ' ' GLU . . . . . 0.493 ' HG2' HD12 ' A' ' 14' ' ' ILE . 4.1 pt-20 -66.32 -40.23 89.8 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.12 -0.491 . . . . 73.13 110.908 179.995 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 14' ' ' ILE . . . . . 0.493 HD12 ' HG2' ' A' ' 13' ' ' GLU . 3.4 mp -67.76 -39.86 82.76 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-N 116.12 -0.491 . . . . 73.42 111.136 179.961 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 93.5 mt-30 -64.09 -48.37 76.41 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.206 -0.452 . . . . 73.41 110.915 179.933 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -63.9 -36.86 85.33 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.144 -0.48 . . . . 62.33 110.862 -179.918 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -58.05 -33.92 69.53 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.159 -0.473 . . . . 75.31 110.906 -179.872 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 1.2 mp0 -66.04 -38.17 87.73 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.182 -0.463 . . . . 74.13 110.891 179.996 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.405 ' CD1' ' CE1' ' A' ' 48' ' ' PHE . 8.7 mp -65.6 -51.28 60.9 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.117 -0.492 . . . . 71.34 110.923 -179.954 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -68.64 -35.55 77.42 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.201 -0.454 . . . . 73.13 110.879 179.944 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -66.57 -50.53 62.79 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.182 -0.463 . . . . 51.42 111.127 179.884 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 22' ' ' ILE . . . . . 0.771 ' HA ' HD12 ' A' ' 25' ' ' ILE . 0.7 OUTLIER -73.84 -34.19 39.46 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.239 -0.437 . . . . 62.41 111.117 179.971 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 34.4 mtp180 -52.25 -35.58 50.16 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.178 -0.464 . . . . 74.0 110.865 179.973 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -67.18 -35.05 78.83 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.173 -0.467 . . . . 73.35 110.863 -179.78 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 25' ' ' ILE . . . . . 0.811 HD13 ' CE1' ' A' ' 115' ' ' PHE . 3.9 mt -78.11 -45.23 27.33 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.129 -0.487 . . . . 72.11 111.165 179.933 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 30.2 m-85 -109.9 43.32 1.36 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.148 -0.478 . . . . 73.23 110.924 -179.915 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 1.8 mtm -40.72 -55.63 2.35 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.094 -0.503 . . . . 75.44 110.877 179.926 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -86.85 -25.76 24.35 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.249 -0.432 . . . . 72.23 110.812 -179.979 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -92.77 31.21 1.42 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.183 -0.462 . . . . 73.51 110.882 179.989 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 30' ' ' PHE . . . . . 0.615 ' HA ' HD13 ' A' ' 50' ' ' ILE . 10.1 t80 -115.59 130.55 56.91 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.155 -0.475 . . . . 71.32 110.882 -179.913 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 53.8 m -117.46 126.39 52.54 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.131 -0.486 . . . . 61.22 111.133 -179.916 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 4.6 t0 -101.04 114.81 29.09 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.201 -0.454 . . . . 63.23 110.868 179.913 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.854 HD21 ' CE1' ' A' ' 67' ' ' HIS . 0.2 OUTLIER -119.24 5.88 11.23 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.209 -0.451 . . . . 75.41 110.912 -179.943 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 34' ' ' THR . . . . . 0.698 HG22 ' H ' ' A' ' 35' ' ' LYS . 2.1 m -63.88 174.73 1.36 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.18 -0.463 . . . . 61.42 111.14 179.934 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 35' ' ' LYS . . . . . 0.698 ' H ' HG22 ' A' ' 34' ' ' THR . 0.0 OUTLIER -75.08 57.22 0.82 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.188 -0.46 . . . . 70.5 110.894 179.867 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -102.07 142.41 33.38 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.27 -0.423 . . . . 72.05 110.915 179.932 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 37' ' ' LYS . . . . . 0.487 ' O ' ' CB ' ' A' ' 38' ' ' SER . 2.8 mmtt 47.39 36.28 4.8 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.181 -0.463 . . . . 75.32 110.922 179.995 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 38' ' ' SER . . . . . 0.487 ' CB ' ' O ' ' A' ' 37' ' ' LYS . 0.5 OUTLIER 161.07 57.48 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.189 -0.459 . . . . 65.54 110.827 -179.911 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 4.3 m -82.42 156.56 24.08 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.16 -0.473 . . . . 63.44 110.877 -179.821 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 40' ' ' TRP . . . . . . . . . . . . . 8.6 t-105 -102.39 -23.96 13.9 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.139 -0.482 . . . . 71.13 110.924 -179.996 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 41' ' ' ASP . . . . . 0.591 ' O ' ' C ' ' A' ' 42' ' ' LYS . 33.9 t70 -164.8 54.92 0.13 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.227 -0.442 . . . . 74.33 110.899 179.952 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 42' ' ' LYS . . . . . 0.591 ' C ' ' O ' ' A' ' 41' ' ' ASP . 0.0 OUTLIER 21.11 69.0 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.211 -0.45 . . . . 62.22 110.896 -179.972 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 7.8 mt-30 -159.08 61.78 1.94 Allowed Pre-proline 0 C--N 1.33 -0.282 0 CA-C-O 121.568 0.699 . . . . 74.25 110.878 179.95 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 44' ' ' PRO . . . . . 0.45 ' HA ' ' CD ' ' A' ' 35' ' ' LYS . 53.6 Cg_endo -69.77 111.86 2.92 Favored 'Trans proline' 0 C--N 1.341 0.154 0 C-N-CA 122.686 2.257 . . . . 73.32 112.332 179.958 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 45' ' ' GLN . . . . . 0.703 ' HB3' HD12 ' A' ' 47' ' ' ILE . 12.8 tt0 -67.72 -3.15 8.38 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.224 -0.443 . . . . 74.55 110.911 -179.98 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 46' ' ' ILE . . . . . 0.464 ' O ' ' C ' ' A' ' 47' ' ' ILE . 0.0 OUTLIER 81.89 -29.76 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.175 -0.466 . . . . 75.24 111.149 179.966 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 47' ' ' ILE . . . . . 0.703 HD12 ' HB3' ' A' ' 45' ' ' GLN . 0.2 OUTLIER -31.33 147.05 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 116.158 -0.474 . . . . 75.32 111.147 179.815 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 48' ' ' PHE . . . . . 0.478 ' HA ' ' CD1' ' A' ' 33' ' ' LEU . 2.0 p90 -158.9 166.35 32.05 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.207 -0.451 . . . . 74.11 110.843 179.968 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 49' ' ' GLU . . . . . 0.766 ' CD ' HD23 ' A' ' 33' ' ' LEU . 6.3 mt-10 -108.87 161.08 15.47 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.125 -0.489 . . . . 74.23 110.856 -179.926 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 50' ' ' ILE . . . . . 0.615 HD13 ' HA ' ' A' ' 30' ' ' PHE . 8.6 mm -142.92 138.32 27.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-N 116.138 -0.483 . . . . 70.21 111.103 179.972 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 78.2 m -91.05 128.99 37.08 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.201 -0.454 . . . . 73.54 111.137 179.963 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 52' ' ' LEU . . . . . 0.87 HD12 HD22 ' A' ' 66' ' ' LEU . 16.9 mt -130.32 166.02 21.27 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.254 -0.43 . . . . 74.35 110.934 179.946 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 53' ' ' ARG . . . . . 0.436 ' CB ' ' O ' ' A' ' 62' ' ' SER . 5.4 ptt180 -177.48 171.18 1.98 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.2 -0.454 . . . . 72.44 110.876 179.963 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 54' ' ' SER . . . . . 0.492 ' H ' ' HG ' ' A' ' 62' ' ' SER . 6.4 p -63.23 -175.8 0.12 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.196 -0.456 . . . . 73.0 110.829 -179.822 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 22.0 m -91.51 -22.96 5.96 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.118 -0.492 . . . . 71.04 111.13 179.936 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 3.2 t0 -118.55 -172.96 2.38 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.164 -0.471 . . . . 72.43 110.873 179.904 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -118.83 -4.05 10.72 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.166 -0.47 . . . . 73.54 110.886 -179.999 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 58' ' ' GLU . . . . . 0.54 ' HA ' ' C ' ' A' ' 59' ' ' PRO . 5.1 mm-40 -136.33 150.29 70.31 Favored Pre-proline 0 C--N 1.329 -0.287 0 CA-C-O 121.649 0.738 . . . . 73.22 110.911 179.937 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 59' ' ' PRO . . . . . 0.54 ' C ' ' HA ' ' A' ' 58' ' ' GLU . 54.1 Cg_endo -69.73 -1.85 6.81 Favored 'Cis proline' 0 C--N 1.341 0.162 0 C-N-CA 122.707 -1.789 . . . . 65.22 112.361 -0.038 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 60' ' ' VAL . . . . . 0.476 ' CG2' ' CG ' ' A' ' 129' ' ' GLN . 34.5 m -144.86 168.6 9.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.231 -0.44 . . . . 42.11 111.162 179.883 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 61' ' ' GLU . . . . . 0.41 ' O ' ' O ' ' A' ' 62' ' ' SER . 22.3 tt0 -100.03 -29.14 12.7 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.168 -0.469 . . . . 65.42 110.909 -179.966 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 62' ' ' SER . . . . . 0.492 ' HG ' ' H ' ' A' ' 54' ' ' SER . 20.1 p 50.69 102.86 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.155 -0.475 . . . . 74.34 110.852 -179.81 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 49.7 p -129.55 122.93 30.18 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.133 -0.485 . . . . 72.23 110.831 -179.8 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 64' ' ' ILE . . . . . 1.027 HD11 HG21 ' A' ' 89' ' ' VAL . 52.8 mt -143.93 132.03 18.34 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.163 -0.472 . . . . 70.51 111.179 179.9 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 91.7 m -92.93 119.33 32.11 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.228 -0.442 . . . . 74.54 111.168 179.954 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 66' ' ' LEU . . . . . 0.87 HD22 HD12 ' A' ' 52' ' ' LEU . 1.5 mp -97.39 109.82 22.5 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.188 -0.46 . . . . 62.52 110.917 179.989 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 67' ' ' HIS . . . . . 0.854 ' CE1' HD21 ' A' ' 33' ' ' LEU . 39.9 t60 -102.05 109.69 21.47 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.152 -0.476 . . . . 73.41 110.841 179.873 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 68' ' ' PHE . . . . . 0.513 ' CE2' ' HB3' ' A' ' 66' ' ' LEU . 0.0 OUTLIER -104.08 139.91 38.51 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.184 -0.462 . . . . 73.24 110.873 -179.919 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 69' ' ' ALA . . . . . 0.443 ' O ' ' CB ' ' A' ' 79' ' ' PRO . . . -121.23 120.6 35.65 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.168 -0.469 . . . . 65.23 111.116 179.912 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 1.7 mmt -85.34 89.95 7.8 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.241 -0.436 . . . . 61.51 110.875 179.998 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -41.26 160.33 0.15 Allowed Pre-proline 0 C--N 1.33 -0.277 0 CA-C-O 121.595 0.712 . . . . 53.24 111.13 -179.913 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 72' ' ' PRO . . . . . 0.623 ' O ' HD13 ' A' ' 8' ' ' LEU . 53.4 Cg_endo -69.78 2.97 3.06 Favored 'Trans proline' 0 C--N 1.341 0.162 0 C-N-CA 122.704 2.269 . . . . 71.51 112.34 179.953 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 73' ' ' MET . . . . . 0.501 ' O ' ' CB ' ' A' ' 76' ' ' TYR . 0.1 OUTLIER -121.44 -25.24 5.21 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.216 -0.447 . . . . 73.15 110.911 179.869 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 74' ' ' TYR . . . . . 0.632 ' CD1' ' C ' ' A' ' 74' ' ' TYR . 0.0 OUTLIER -46.95 149.86 1.47 Allowed Pre-proline 0 C--N 1.329 -0.315 0 CA-C-O 121.684 0.754 . . . . 70.05 110.945 -179.904 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 75' ' ' PRO . . . . . 0.551 ' C ' ' HA ' ' A' ' 74' ' ' TYR . 53.7 Cg_endo -69.75 -10.79 11.65 Favored 'Cis proline' 0 C--O 1.232 0.186 0 C-N-CA 122.673 -1.803 . . . . 61.45 112.338 -0.103 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 76' ' ' TYR . . . . . 0.501 ' CB ' ' O ' ' A' ' 73' ' ' MET . 20.9 t80 -33.81 -45.46 0.19 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.262 -0.427 . . . . 74.22 110.937 -179.924 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 77' ' ' THR . . . . . 0.404 HG23 ' CB ' ' A' ' 73' ' ' MET . 16.8 p -114.86 -175.03 2.6 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.118 -0.492 . . . . 74.21 111.152 179.998 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -99.94 132.96 22.01 Favored Pre-proline 0 C--N 1.329 -0.291 0 CA-C-O 121.566 0.698 . . . . 72.31 111.123 179.863 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 79' ' ' PRO . . . . . 0.735 ' HG3' HD11 ' A' ' 113' ' ' ILE . 54.0 Cg_endo -69.75 -164.21 0.12 Allowed 'Trans proline' 0 C--N 1.341 0.175 0 C-N-CA 122.71 2.273 . . . . 73.1 112.336 180.0 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 9.4 tt0 -131.73 129.2 40.33 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.171 -0.468 . . . . 63.35 110.857 -179.944 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 81' ' ' ILE . . . . . 0.42 HD13 ' HA ' ' A' ' 68' ' ' PHE . 5.1 mm -120.64 145.58 26.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.157 -0.474 . . . . 74.32 111.085 179.994 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 82' ' ' GLU . . . . . 0.504 ' HG3' ' CD ' ' A' ' 84' ' ' LYS . 4.2 pt-20 -149.01 136.44 20.24 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.162 -0.472 . . . . 64.32 110.898 179.944 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 83' ' ' PHE . . . . . 0.613 ' CB ' HD22 ' A' ' 94' ' ' LEU . 38.5 m-85 -93.08 138.63 31.36 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.156 -0.474 . . . . 75.32 110.836 -179.888 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 84' ' ' LYS . . . . . 0.504 ' CD ' ' HG3' ' A' ' 82' ' ' GLU . 9.7 mmmt -124.93 171.88 9.84 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.113 -0.494 . . . . 63.13 110.915 179.942 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 85' ' ' ASN . . . . . 0.414 ' C ' ' CG2' ' A' ' 86' ' ' VAL . 7.8 m-80 61.24 -74.47 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.2 -0.455 . . . . 63.22 110.923 179.978 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 86' ' ' VAL . . . . . 0.737 HG11 HD11 ' A' ' 94' ' ' LEU . 2.8 m 41.61 84.59 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.179 -0.464 . . . . 61.25 111.092 179.864 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -93.06 -79.66 0.4 Allowed 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.18 -0.464 . . . . 65.13 110.923 -179.984 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -54.41 -44.16 72.12 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.194 -0.457 . . . . 71.0 110.887 -179.988 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 89' ' ' VAL . . . . . 1.027 HG21 HD11 ' A' ' 64' ' ' ILE . 1.7 t -62.21 151.74 7.36 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.163 -0.472 . . . . 42.55 111.136 179.932 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 90' ' ' MET . . . . . . . . . . . . . 14.8 mtm -102.25 -70.35 0.75 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.192 -0.458 . . . . 70.51 110.864 179.897 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 91' ' ' ASP . . . . . 0.432 ' HA ' HD12 ' A' ' 94' ' ' LEU . 3.0 p-10 -172.26 -36.95 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.255 -0.429 . . . . 70.41 110.898 179.989 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -54.28 -41.51 68.95 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.179 -0.464 . . . . 64.13 110.843 -179.802 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 93' ' ' GLN . . . . . 0.478 ' CD ' ' CD2' ' A' ' 128' ' ' PHE . 0.8 OUTLIER -69.03 -42.03 76.91 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.16 -0.473 . . . . 75.02 110.95 -179.965 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 94' ' ' LEU . . . . . 0.737 HD11 HG11 ' A' ' 86' ' ' VAL . 50.8 mt -59.36 -49.03 79.38 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.137 -0.483 . . . . 65.53 110.931 -179.993 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 1.8 mm100 -65.98 -36.13 82.48 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.148 -0.478 . . . . 74.15 110.905 179.921 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 96' ' ' MET . . . . . 0.453 ' SD ' ' CE1' ' A' ' 128' ' ' PHE . 49.8 ttp -60.89 -38.58 86.15 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.168 -0.469 . . . . 71.41 110.851 179.99 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 97' ' ' LEU . . . . . 0.978 HD22 HG22 ' A' ' 121' ' ' THR . 98.4 mt -60.62 -46.8 88.92 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.238 -0.437 . . . . 71.42 110.959 -179.984 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 12.8 mmtm -55.8 -34.66 65.53 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.148 -0.478 . . . . 61.41 110.878 179.822 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 67.1 m -68.7 -45.74 70.82 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.25 -0.432 . . . . 42.32 110.861 -179.87 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 100' ' ' GLU . . . . . 0.47 ' O ' HD12 ' A' ' 104' ' ' ILE . 8.6 pt-20 -75.16 -23.47 57.77 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.106 -0.497 . . . . 72.15 110.885 -179.958 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 101' ' ' PHE . . . . . 0.651 ' CD2' HD11 ' A' ' 117' ' ' ILE . 8.0 m-30 -59.09 -34.37 71.92 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.175 -0.466 . . . . 63.12 110.877 -179.933 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.34 -42.83 98.97 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.114 -0.494 . . . . 63.11 110.929 179.989 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 21.0 mtmm -64.91 -37.81 88.89 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.2 -0.455 . . . . 65.54 110.916 179.818 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 104' ' ' ILE . . . . . 0.621 HD11 ' CD2' ' A' ' 120' ' ' PHE . 3.0 mt -65.01 -47.55 87.58 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 116.236 -0.438 . . . . 51.34 111.132 179.853 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 105' ' ' HIS . . . . . . . . . . . . . 4.3 t60 -62.97 -41.49 99.55 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.172 -0.467 . . . . 74.33 110.868 179.901 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -60.63 -43.3 97.67 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.188 -0.46 . . . . 64.44 110.887 -179.952 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 9.2 t -78.95 -28.74 43.73 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.194 -0.457 . . . . 72.52 111.172 179.986 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 12.5 m -114.77 40.4 2.61 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.239 -0.437 . . . . 63.45 110.845 -179.839 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 34.5 ttt180 -84.8 90.32 7.73 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.14 -0.482 . . . . 74.42 110.837 -179.927 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 110' ' ' GLY . . . . . 0.444 ' HA2' ' CB ' ' A' ' 75' ' ' PRO . . . 110.59 45.33 0.91 Allowed Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.725 -0.75 . . . . 62.32 112.49 -179.973 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 111' ' ' GLN . . . . . 0.422 ' O ' ' CB ' ' A' ' 112' ' ' GLU . 5.1 pt20 -174.33 28.52 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.745 0.307 . . . . 72.42 110.897 -179.918 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 112' ' ' GLU . . . . . 0.422 ' CB ' ' O ' ' A' ' 111' ' ' GLN . 0.2 OUTLIER 78.07 135.73 0.06 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.207 -0.451 . . . . 62.4 110.87 -179.989 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 113' ' ' ILE . . . . . 0.735 HD11 ' HG3' ' A' ' 79' ' ' PRO . 31.9 pt -133.46 -0.31 1.43 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.183 -0.462 . . . . 73.11 111.136 179.968 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 114' ' ' ILE . . . . . 0.831 ' O ' HG23 ' A' ' 118' ' ' THR . 25.6 mm -63.34 -45.43 98.15 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.2 -0.454 . . . . 60.34 111.132 179.876 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 115' ' ' PHE . . . . . 0.811 ' CE1' HD13 ' A' ' 25' ' ' ILE . 26.6 t80 -72.65 -34.63 67.4 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.188 -0.46 . . . . 75.41 110.874 179.93 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 4.3 mm-40 -67.8 -47.63 68.57 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.144 -0.48 . . . . 62.23 110.893 -179.928 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 117' ' ' ILE . . . . . 0.651 HD11 ' CD2' ' A' ' 101' ' ' PHE . 0.9 OUTLIER -63.47 -40.61 89.69 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.14 -0.482 . . . . 73.53 111.103 179.976 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 118' ' ' THR . . . . . 0.831 HG23 ' O ' ' A' ' 114' ' ' ILE . 64.5 p -68.07 -42.77 79.91 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.169 -0.469 . . . . 53.41 111.108 -179.955 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 67.6 m -67.89 -44.25 77.43 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.225 -0.443 . . . . 71.33 110.853 -179.843 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 120' ' ' PHE . . . . . 0.621 ' CD2' HD11 ' A' ' 104' ' ' ILE . 0.2 OUTLIER -60.74 -50.27 74.15 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.139 -0.482 . . . . 74.33 110.888 -179.959 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 121' ' ' THR . . . . . 0.978 HG22 HD22 ' A' ' 97' ' ' LEU . 81.4 p -65.54 -40.71 93.22 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.171 -0.468 . . . . 65.23 111.146 -179.95 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 8.4 tm0? -64.23 -38.85 92.52 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.191 -0.459 . . . . 71.33 110.911 -179.985 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 4.4 pt-20 -77.5 -40.48 42.69 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.216 -0.447 . . . . 72.15 110.916 -179.976 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 124' ' ' LYS . . . . . 0.472 ' HA ' ' CE ' ' A' ' 124' ' ' LYS . 0.0 OUTLIER -68.57 -41.06 80.27 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.128 -0.487 . . . . 74.12 110.815 -179.982 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 125' ' ' LEU . . . . . 0.57 ' O ' HD23 ' A' ' 125' ' ' LEU . 0.5 OUTLIER -68.39 -38.26 81.15 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.253 -0.43 . . . . 74.21 110.926 179.945 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 126' ' ' ASP . . . . . 0.433 ' C ' ' OD1' ' A' ' 126' ' ' ASP . 1.2 t0 -61.78 -45.59 93.22 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.202 -0.454 . . . . 54.33 110.886 179.817 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 127' ' ' GLU . . . . . 0.447 ' HG3' ' N ' ' A' ' 128' ' ' PHE . 7.4 pt-20 -69.68 -31.17 69.06 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.202 -0.454 . . . . 72.45 110.899 -179.892 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 128' ' ' PHE . . . . . 0.478 ' CD2' ' CD ' ' A' ' 93' ' ' GLN . 0.3 OUTLIER -69.14 -44.23 72.73 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.138 -0.483 . . . . 74.42 110.836 -179.886 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 129' ' ' GLN . . . . . 0.476 ' CG ' ' CG2' ' A' ' 60' ' ' VAL . 1.4 tm0? -58.32 -44.74 88.77 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.154 -0.475 . . . . 75.52 110.923 -179.921 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 130' ' ' ASN . . . . . 0.702 ' O ' HG13 ' A' ' 131' ' ' VAL . 1.8 m-20 -75.48 -80.24 0.09 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.197 -0.456 . . . . 64.32 110.906 -179.985 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 131' ' ' VAL . . . . . 0.702 HG13 ' O ' ' A' ' 130' ' ' ASN . 0.0 OUTLIER -177.05 -58.93 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.151 -0.477 . . . . 71.52 111.134 179.908 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 132' ' ' VAL . . . . . . . . . . . . . 72.9 t -143.92 146.57 20.73 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.181 -0.463 . . . . 70.04 111.124 179.938 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 133' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -179.73 90.13 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.166 -0.47 . . . . 60.25 110.914 -179.955 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 134' ' ' THR . . . . . . . . . . . . . 4.1 m -100.92 147.29 26.31 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.169 -0.468 . . . . 40.42 111.125 -179.957 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 8.5 tp60 -150.59 129.5 12.51 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.205 -0.452 . . . . 73.23 110.891 -179.984 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 80.4 p -148.96 90.9 1.8 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.201 -0.454 . . . . 73.24 110.83 -179.827 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 137' ' ' LEU . . . . . 0.454 HD22 ' HA ' ' A' ' 137' ' ' LEU . 0.2 OUTLIER -70.62 111.62 6.25 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.151 -0.477 . . . . 64.5 110.922 179.972 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.33 -0.275 0 CA-C-N 116.192 -0.458 . . . . 31.21 110.893 179.927 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 48.7 mtm . . . . . 0 C--O 1.231 0.087 0 CA-C-O 120.79 0.329 . . . . 72.22 110.895 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER 49.93 46.59 24.17 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.226 -0.443 . . . . 74.24 110.88 -179.793 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 3' ' ' LEU . . . . . 0.588 HD23 ' H ' ' A' ' 5' ' ' HIS . 0.2 OUTLIER -45.15 141.23 2.46 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.159 -0.473 . . . . 51.45 110.923 179.999 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -134.69 27.19 3.67 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.228 -0.442 . . . . 73.21 110.862 -179.926 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 5' ' ' HIS . . . . . 0.588 ' H ' HD23 ' A' ' 3' ' ' LEU . 0.0 OUTLIER 66.57 10.14 7.15 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.131 -0.486 . . . . 72.54 110.834 179.941 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -153.04 111.24 3.65 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.18 -0.464 . . . . 54.5 110.955 179.995 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 5.3 t -179.88 154.66 0.58 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.217 -0.447 . . . . 74.53 111.094 179.964 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 76.0 mt -55.09 -23.41 20.48 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.147 -0.478 . . . . 74.42 110.955 179.938 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -51.62 -34.64 38.43 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.169 -0.469 . . . . 70.31 110.828 179.883 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 10' ' ' GLN . . . . . 0.408 ' O ' HD12 ' A' ' 14' ' ' ILE . 16.1 mm-40 -67.95 -35.11 77.83 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.212 -0.449 . . . . 74.35 110.883 -179.863 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 11' ' ' TYR . . . . . 0.441 ' CD1' ' HD2' ' A' ' 75' ' ' PRO . 15.1 m-85 -65.77 -25.06 67.09 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.2 -0.455 . . . . 64.15 110.916 -179.852 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -64.59 -37.85 88.99 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.105 -0.498 . . . . 72.33 110.911 -179.884 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 2.5 mm-40 -61.56 -44.15 97.56 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.144 -0.48 . . . . 73.12 110.885 179.985 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 14' ' ' ILE . . . . . 0.545 ' H ' HD12 ' A' ' 14' ' ' ILE . 5.2 mp -68.03 -40.12 82.63 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.125 -0.489 . . . . 71.13 111.135 179.971 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 15' ' ' GLN . . . . . 0.419 ' HB3' HG21 ' A' ' 46' ' ' ILE . 59.1 mt-30 -65.22 -46.33 81.09 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.159 -0.473 . . . . 60.34 110.881 179.946 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 7.0 t -63.19 -36.56 84.05 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.254 -0.43 . . . . 73.44 110.881 -179.946 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 17' ' ' ASN . . . . . 0.432 ' OD1' ' N ' ' A' ' 18' ' ' GLU . 0.2 OUTLIER -58.36 -33.72 69.89 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.154 -0.476 . . . . 73.24 110.889 -179.907 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 18' ' ' GLU . . . . . 0.432 ' N ' ' OD1' ' A' ' 17' ' ' ASN . 1.3 mp0 -66.33 -37.78 86.15 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.18 -0.464 . . . . 61.11 110.886 -179.985 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.459 ' CD2' HG13 ' A' ' 46' ' ' ILE . 8.8 mp -64.44 -51.51 62.75 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.18 -0.464 . . . . 75.05 110.908 -179.976 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 1.4 pt-20 -68.5 -35.86 78.1 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.202 -0.454 . . . . 73.43 110.933 179.918 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -66.66 -47.1 73.59 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.124 -0.489 . . . . 74.54 111.068 179.944 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 22' ' ' ILE . . . . . 0.621 ' HA ' HD12 ' A' ' 25' ' ' ILE . 0.7 OUTLIER -76.21 -34.27 25.66 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-N 116.261 -0.427 . . . . 52.32 111.167 179.955 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -52.32 -34.18 45.84 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.144 -0.48 . . . . 73.12 110.87 179.973 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -66.37 -32.15 73.36 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.219 -0.446 . . . . 70.43 110.879 -179.823 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 25' ' ' ILE . . . . . 0.854 HD13 ' CE1' ' A' ' 115' ' ' PHE . 3.3 mt -84.77 -43.84 17.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.118 -0.492 . . . . 62.33 111.121 179.95 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 19.5 m-85 -107.5 45.36 1.0 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.176 -0.465 . . . . 73.45 110.903 -179.95 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 4.1 mtm -46.26 -47.82 18.07 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.132 -0.485 . . . . 73.54 110.869 179.887 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 7.1 m-20 -98.74 -27.2 14.07 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.219 -0.446 . . . . 64.45 110.859 179.952 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 84.6 m-20 -86.11 34.4 0.62 Allowed 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.214 -0.448 . . . . 73.42 110.862 -179.995 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 30' ' ' PHE . . . . . 0.612 ' CD1' ' C ' ' A' ' 30' ' ' PHE . 0.1 OUTLIER -117.46 144.12 45.35 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.176 -0.465 . . . . 71.31 110.923 -179.935 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 24.4 m -127.08 135.07 50.25 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.141 -0.481 . . . . 55.44 111.18 -179.926 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -97.82 114.81 26.94 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.227 -0.442 . . . . 70.14 110.83 179.948 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.941 HD23 ' N ' ' A' ' 34' ' ' THR . 0.1 OUTLIER -121.81 -9.65 8.8 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.216 -0.447 . . . . 74.43 110.95 -179.979 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 34' ' ' THR . . . . . 0.941 ' N ' HD23 ' A' ' 33' ' ' LEU . 0.2 OUTLIER -33.92 127.29 0.41 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.174 -0.466 . . . . 75.2 111.163 179.933 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 6.2 mtmm -56.52 84.48 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.207 -0.452 . . . . 61.53 110.898 179.888 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 36' ' ' ARG . . . . . 0.439 ' N ' ' O ' ' A' ' 34' ' ' THR . 0.2 OUTLIER -104.83 -69.74 0.8 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.239 -0.437 . . . . 73.5 110.824 -179.982 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 45.53 -172.03 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.189 -0.459 . . . . 73.13 110.9 179.982 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 89.5 p -97.91 -173.94 2.74 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.216 -0.447 . . . . 75.01 110.832 -179.897 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 1.4 m -48.85 99.85 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.085 -0.507 . . . . 72.23 110.849 -179.833 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 40' ' ' TRP . . . . . . . . . . . . . 1.5 t-105 -175.05 -68.96 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.097 -0.502 . . . . 74.32 110.904 -179.966 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 1.3 t0 -156.07 128.99 7.94 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.235 -0.439 . . . . 74.11 110.875 179.947 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 42' ' ' LYS . . . . . 0.46 ' C ' ' HD3' ' A' ' 44' ' ' PRO . 0.0 OUTLIER -150.79 85.08 1.35 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.224 -0.443 . . . . 72.35 110.907 179.949 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 43' ' ' GLN . . . . . 0.467 ' N ' ' CD ' ' A' ' 44' ' ' PRO . 15.6 tt0 -116.58 52.73 1.06 Allowed Pre-proline 0 C--N 1.329 -0.309 0 CA-C-O 121.587 0.708 . . . . 61.25 110.896 179.985 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 44' ' ' PRO . . . . . 0.467 ' CD ' ' N ' ' A' ' 43' ' ' GLN . 54.3 Cg_endo -69.77 -163.39 0.11 Allowed 'Trans proline' 0 C--N 1.341 0.168 0 C-N-CA 122.652 2.235 . . . . 72.14 112.39 179.971 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 45' ' ' GLN . . . . . 0.879 ' HG2' HG23 ' A' ' 47' ' ' ILE . 15.1 pt20 -175.4 34.46 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.281 -0.418 . . . . 74.05 110.929 -179.96 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 46' ' ' ILE . . . . . 0.643 HG22 ' O ' ' A' ' 45' ' ' GLN . 0.2 OUTLIER 87.16 -21.88 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.174 -0.466 . . . . 54.4 111.142 -180.0 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 47' ' ' ILE . . . . . 0.879 HG23 ' HG2' ' A' ' 45' ' ' GLN . 0.2 OUTLIER -36.5 144.54 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.205 -0.452 . . . . 65.33 111.171 179.849 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 48' ' ' PHE . . . . . 0.759 ' HA ' HD22 ' A' ' 33' ' ' LEU . 0.9 OUTLIER -161.59 158.37 26.15 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.183 -0.462 . . . . 74.24 110.896 -179.994 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 49' ' ' GLU . . . . . 0.914 ' CG ' HD13 ' A' ' 33' ' ' LEU . 20.4 mt-10 -108.76 160.99 15.52 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.137 -0.483 . . . . 72.53 110.866 -179.922 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 50' ' ' ILE . . . . . 0.547 HD13 ' HA ' ' A' ' 30' ' ' PHE . 15.4 mm -141.66 135.55 30.44 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.151 -0.477 . . . . 64.42 111.131 179.975 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 90.2 m -83.73 137.08 33.92 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.136 -0.484 . . . . 72.52 111.195 179.946 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 52' ' ' LEU . . . . . 0.45 HD12 HD12 ' A' ' 66' ' ' LEU . 14.2 mt -136.69 160.23 39.46 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.216 -0.447 . . . . 74.23 110.92 179.943 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 7.4 ptt85 -176.14 161.6 2.38 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.18 -0.464 . . . . 72.12 110.829 179.965 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -53.63 -176.68 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.154 -0.475 . . . . 75.02 110.886 -179.823 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 15.9 m -94.41 -25.69 4.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.169 -0.469 . . . . 72.43 111.084 179.984 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -124.47 -165.99 1.45 Allowed 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.179 -0.464 . . . . 74.31 110.881 179.92 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -114.76 -14.58 11.97 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.191 -0.458 . . . . 62.25 110.854 -179.954 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 58' ' ' GLU . . . . . 0.554 ' HA ' ' C ' ' A' ' 59' ' ' PRO . 7.5 pt-20 -119.49 143.22 34.15 Favored Pre-proline 0 C--N 1.329 -0.294 0 CA-C-O 121.644 0.735 . . . . 44.23 110.859 -179.995 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 59' ' ' PRO . . . . . 0.554 ' C ' ' HA ' ' A' ' 58' ' ' GLU . 54.3 Cg_endo -69.81 -9.2 10.99 Favored 'Cis proline' 0 C--O 1.232 0.188 0 C-N-CA 122.632 -1.82 . . . . 71.44 112.364 0.025 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 60' ' ' VAL . . . . . 0.581 HG22 ' HG2' ' A' ' 129' ' ' GLN . 12.0 m -153.89 176.54 0.48 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.242 -0.436 . . . . 42.33 111.164 179.903 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 61' ' ' GLU . . . . . 0.461 ' O ' ' C ' ' A' ' 62' ' ' SER . 6.0 tt0 -107.93 -18.0 13.91 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.203 -0.453 . . . . 72.52 110.917 179.963 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 62' ' ' SER . . . . . 0.721 ' HB3' HD11 ' A' ' 125' ' ' LEU . 0.1 OUTLIER 33.7 90.05 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.191 -0.459 . . . . 73.52 110.845 -179.846 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -103.66 122.85 45.87 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.151 -0.477 . . . . 74.21 110.866 -179.801 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 64' ' ' ILE . . . . . 0.775 HD13 HD11 ' A' ' 94' ' ' LEU . 12.5 mt -141.37 150.42 19.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.156 -0.475 . . . . 71.22 111.113 179.972 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 84.0 m -118.96 117.34 28.55 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.153 -0.476 . . . . 64.34 111.135 179.972 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 66' ' ' LEU . . . . . 0.802 HD11 HG21 ' A' ' 121' ' ' THR . 11.4 mt -95.04 111.9 23.66 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.217 -0.447 . . . . 73.53 110.912 179.979 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 67' ' ' HIS . . . . . 0.552 ' CE1' HD11 ' A' ' 33' ' ' LEU . 0.9 OUTLIER -102.11 111.88 24.33 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.152 -0.476 . . . . 61.22 110.843 179.855 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 68' ' ' PHE . . . . . 0.536 ' CE1' HG23 ' A' ' 114' ' ' ILE . 0.0 OUTLIER -103.83 139.95 38.33 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.195 -0.457 . . . . 72.04 110.889 -179.959 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -119.67 118.4 30.83 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.123 -0.49 . . . . 63.23 111.096 179.897 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 70' ' ' MET . . . . . 0.445 ' CE ' HD11 ' A' ' 114' ' ' ILE . 2.3 mmt -84.08 99.13 10.27 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.238 -0.437 . . . . 70.21 110.883 179.942 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -53.25 159.86 1.94 Allowed Pre-proline 0 C--N 1.33 -0.275 0 CA-C-O 121.553 0.692 . . . . 71.04 111.14 -179.912 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.73 -2.22 9.79 Favored 'Trans proline' 0 C--N 1.341 0.167 0 C-N-CA 122.69 2.26 . . . . 71.22 112.376 179.887 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 73' ' ' MET . . . . . 0.496 ' O ' ' CB ' ' A' ' 76' ' ' TYR . 0.1 OUTLIER -115.83 -23.33 8.67 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.234 -0.439 . . . . 73.44 110.914 179.902 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 74' ' ' TYR . . . . . 0.665 ' CD1' ' C ' ' A' ' 74' ' ' TYR . 0.0 OUTLIER -48.49 151.53 1.93 Allowed Pre-proline 0 C--N 1.328 -0.353 0 CA-C-O 121.69 0.757 . . . . 73.13 110.924 -179.907 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 75' ' ' PRO . . . . . 0.544 ' HA ' ' CD2' ' A' ' 74' ' ' TYR . 53.7 Cg_endo -69.73 -9.99 11.23 Favored 'Cis proline' 0 C--N 1.341 0.184 0 C-N-CA 122.633 -1.819 . . . . 75.51 112.386 -0.109 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 76' ' ' TYR . . . . . 0.496 ' CB ' ' O ' ' A' ' 73' ' ' MET . 16.3 t80 -34.41 -52.3 0.48 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.172 -0.467 . . . . 70.42 110.916 -179.911 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 62.1 p -101.41 -171.56 2.01 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.094 -0.503 . . . . 71.44 111.158 -179.956 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -108.65 131.31 21.85 Favored Pre-proline 0 C--N 1.328 -0.335 0 CA-C-O 121.57 0.7 . . . . 70.44 111.142 179.842 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 79' ' ' PRO . . . . . 0.685 ' HG3' HD11 ' A' ' 113' ' ' ILE . 53.5 Cg_endo -69.82 -170.14 0.38 Allowed 'Trans proline' 0 C--N 1.342 0.192 0 C-N-CA 122.688 2.259 . . . . 71.13 112.344 -179.964 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 80' ' ' GLU . . . . . 0.428 ' O ' HD13 ' A' ' 81' ' ' ILE . 0.3 OUTLIER -127.37 127.36 44.08 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.242 -0.436 . . . . 60.2 110.854 -179.963 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 81' ' ' ILE . . . . . 0.722 ' CG2' HD22 ' A' ' 66' ' ' LEU . 10.2 mm -120.4 139.13 48.65 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.156 -0.475 . . . . 73.22 111.102 179.956 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 82' ' ' GLU . . . . . 0.487 ' HG3' ' CD ' ' A' ' 84' ' ' LYS . 7.2 pt-20 -148.34 144.04 27.28 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.144 -0.48 . . . . 63.43 110.866 179.948 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 83' ' ' PHE . . . . . 0.57 ' CG ' HD12 ' A' ' 94' ' ' LEU . 22.5 m-85 -93.76 141.14 28.84 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.132 -0.486 . . . . 74.35 110.895 -179.963 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 84' ' ' LYS . . . . . 0.487 ' CD ' ' HG3' ' A' ' 82' ' ' GLU . 9.6 mmmt -124.89 171.05 10.49 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.124 -0.489 . . . . 65.25 110.903 179.968 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 85' ' ' ASN . . . . . 0.413 ' O ' ' CG2' ' A' ' 86' ' ' VAL . 5.0 m120 62.81 -74.22 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.216 -0.447 . . . . 72.0 110.918 179.977 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 86' ' ' VAL . . . . . 0.465 ' N ' ' O ' ' A' ' 84' ' ' LYS . 3.2 m 41.5 92.08 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.144 -0.48 . . . . 73.24 111.144 179.901 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -102.54 -69.59 0.78 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.21 -0.45 . . . . 73.0 110.868 -179.945 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 88' ' ' ASN . . . . . 0.459 ' CG ' ' HB ' ' A' ' 60' ' ' VAL . 14.6 m-80 -83.31 53.11 2.38 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.191 -0.459 . . . . 73.33 110.851 -179.909 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 89' ' ' VAL . . . . . 0.687 HG21 HD22 ' A' ' 94' ' ' LEU . 2.1 p -165.27 133.85 0.63 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.173 -0.467 . . . . 75.13 111.1 179.904 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 90' ' ' MET . . . . . . . . . . . . . 1.4 mtm -78.36 -70.43 0.49 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.123 -0.49 . . . . 62.21 110.885 179.888 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 91' ' ' ASP . . . . . 0.5 ' HA ' HD23 ' A' ' 94' ' ' LEU . 5.1 p-10 -176.34 -30.95 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.195 -0.457 . . . . 55.41 110.857 179.981 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -53.65 -37.65 63.32 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.185 -0.461 . . . . 70.32 110.906 -179.792 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 93' ' ' GLN . . . . . 0.534 ' HG2' ' CZ ' ' A' ' 128' ' ' PHE . 1.4 mp0 -71.03 -38.37 72.58 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.108 -0.496 . . . . 73.2 110.917 -179.945 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 94' ' ' LEU . . . . . 0.775 HD11 HD13 ' A' ' 64' ' ' ILE . 1.1 mm? -64.78 -47.21 78.95 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.166 -0.47 . . . . 72.23 110.907 -179.964 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 44.6 mt-30 -65.17 -34.0 77.35 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.16 -0.473 . . . . 72.34 110.905 179.952 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 96' ' ' MET . . . . . . . . . . . . . 32.0 ttp -59.85 -37.88 80.52 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.184 -0.462 . . . . 73.21 110.913 179.951 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 97' ' ' LEU . . . . . 0.477 ' O ' ' CD1' ' A' ' 101' ' ' PHE . 17.1 mt -71.97 -38.9 69.66 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.188 -0.46 . . . . 70.24 110.902 179.961 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 98' ' ' LYS . . . . . 0.449 ' HZ1' ' HA ' ' A' ' 82' ' ' GLU . 7.0 mmtt -54.64 -37.11 65.28 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.206 -0.452 . . . . 62.54 110.903 179.847 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -64.45 -38.69 91.9 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.217 -0.447 . . . . 73.33 110.864 -179.861 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 100' ' ' GLU . . . . . 0.498 ' O ' HD12 ' A' ' 104' ' ' ILE . 1.4 mp0 -72.94 -24.1 60.77 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.145 -0.48 . . . . 70.55 110.905 179.995 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 101' ' ' PHE . . . . . 0.477 ' CD1' ' O ' ' A' ' 97' ' ' LEU . 8.9 m-30 -59.75 -35.19 74.1 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.117 -0.492 . . . . 74.1 110.935 -179.951 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.51 -38.29 84.07 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.143 -0.48 . . . . 53.53 110.881 179.959 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 21.8 mtmt -70.04 -43.19 71.76 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.264 -0.426 . . . . 73.11 110.927 179.846 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 104' ' ' ILE . . . . . 0.498 HD12 ' O ' ' A' ' 100' ' ' GLU . 3.0 mt -62.16 -47.45 93.06 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.185 -0.461 . . . . 71.32 111.102 179.901 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 105' ' ' HIS . . . . . 0.465 ' O ' ' N ' ' A' ' 109' ' ' ARG . 1.8 t60 -62.87 -41.09 99.26 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.163 -0.471 . . . . 75.14 110.832 179.932 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 1.3 m-80 -58.14 -39.25 78.3 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.246 -0.434 . . . . 63.52 110.834 -179.901 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 9.4 t -90.12 -13.18 36.28 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.195 -0.457 . . . . 75.1 111.091 -179.921 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 108' ' ' SER . . . . . 0.578 ' HB3' HG22 ' A' ' 113' ' ' ILE . 58.8 m -116.78 17.5 15.12 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.241 -0.436 . . . . 72.02 110.863 -179.845 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 109' ' ' ARG . . . . . 0.465 ' N ' ' O ' ' A' ' 105' ' ' HIS . 21.4 ttp180 -67.17 76.16 0.14 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.098 -0.501 . . . . 71.01 110.884 -179.98 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 149.05 -21.63 1.25 Allowed Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.77 -0.728 . . . . 72.31 112.505 -179.954 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 111' ' ' GLN . . . . . . . . . . . . . 10.6 pt20 -116.84 -165.48 1.07 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.765 0.317 . . . . 72.11 110.894 -179.891 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 23.4 mt-10 -67.05 134.29 51.6 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.189 -0.46 . . . . 63.02 110.871 -179.943 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 113' ' ' ILE . . . . . 0.685 HD11 ' HG3' ' A' ' 79' ' ' PRO . 22.4 pt -124.5 -14.66 5.07 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 116.131 -0.486 . . . . 75.11 111.117 179.984 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 114' ' ' ILE . . . . . 0.716 ' O ' HG23 ' A' ' 118' ' ' THR . 14.5 mm -63.03 -43.83 99.26 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.157 -0.474 . . . . 74.33 111.15 179.81 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 115' ' ' PHE . . . . . 0.854 ' CE1' HD13 ' A' ' 25' ' ' ILE . 16.2 t80 -72.52 -35.97 68.21 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.145 -0.48 . . . . 72.35 110.91 179.944 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 5.2 mm-40 -66.02 -46.77 76.69 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.189 -0.459 . . . . 62.54 110.922 -179.954 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 117' ' ' ILE . . . . . 0.49 ' CG2' ' N ' ' A' ' 118' ' ' THR . 0.7 OUTLIER -64.37 -43.06 97.03 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.159 -0.473 . . . . 74.51 111.137 179.93 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 118' ' ' THR . . . . . 0.716 HG23 ' O ' ' A' ' 114' ' ' ILE . 72.7 p -67.83 -43.03 80.49 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.192 -0.458 . . . . 52.22 111.127 179.972 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 4.0 m -63.86 -44.48 92.99 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.245 -0.434 . . . . 61.22 110.843 -179.835 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 120' ' ' PHE . . . . . 0.405 ' O ' ' HG2' ' A' ' 123' ' ' GLU . 0.2 OUTLIER -65.41 -48.74 71.77 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.176 -0.465 . . . . 74.43 110.906 -179.984 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 121' ' ' THR . . . . . 0.802 HG21 HD11 ' A' ' 66' ' ' LEU . 25.3 p -63.7 -38.62 91.8 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.154 -0.475 . . . . 72.52 111.137 -179.912 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 27.7 tt0 -63.23 -41.44 99.11 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.202 -0.453 . . . . 64.44 110.903 -179.963 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 123' ' ' GLU . . . . . 0.497 ' O ' ' CG ' ' A' ' 127' ' ' GLU . 4.2 pt-20 -75.95 -35.61 59.64 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.245 -0.434 . . . . 74.35 110.861 -179.946 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 124' ' ' LYS . . . . . 0.491 ' HA ' ' CG ' ' A' ' 127' ' ' GLU . 0.0 OUTLIER -68.61 -35.22 77.03 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.14 -0.482 . . . . 74.42 110.901 179.966 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 125' ' ' LEU . . . . . 0.811 ' O ' HD23 ' A' ' 125' ' ' LEU . 4.0 tt -72.93 -43.67 62.1 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.274 -0.421 . . . . 73.43 110.925 179.912 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 4.5 t70 -65.7 -46.93 77.14 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.219 -0.446 . . . . 75.11 110.836 179.843 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 127' ' ' GLU . . . . . 0.497 ' CG ' ' O ' ' A' ' 123' ' ' GLU . 0.0 OUTLIER -59.52 -50.35 74.23 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.248 -0.433 . . . . 72.04 110.868 -179.908 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 128' ' ' PHE . . . . . 0.667 ' CD1' ' C ' ' A' ' 128' ' ' PHE . 0.0 OUTLIER -66.8 -46.05 76.46 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.161 -0.472 . . . . 74.45 110.865 -179.906 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 129' ' ' GLN . . . . . 0.581 ' HG2' HG22 ' A' ' 60' ' ' VAL . 0.9 OUTLIER -54.6 -38.8 67.18 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.19 -0.459 . . . . 73.41 110.9 -179.941 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 130' ' ' ASN . . . . . 0.591 ' O ' HG23 ' A' ' 131' ' ' VAL . 36.6 t-20 -49.16 -72.73 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.164 -0.471 . . . . 72.41 110.898 -179.971 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 131' ' ' VAL . . . . . 0.706 HG12 HG23 ' A' ' 132' ' ' VAL . 73.6 t -162.15 -50.64 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.189 -0.46 . . . . 54.11 111.138 179.938 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 132' ' ' VAL . . . . . 0.706 HG23 HG12 ' A' ' 131' ' ' VAL . 79.6 t -158.97 86.45 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 116.162 -0.472 . . . . 50.45 111.104 179.95 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 133' ' ' ASN . . . . . 0.46 ' C ' ' O ' ' A' ' 132' ' ' VAL . 0.4 OUTLIER 33.57 88.39 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.157 -0.474 . . . . 70.14 110.872 -179.998 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 134' ' ' THR . . . . . . . . . . . . . 99.3 m -128.83 128.49 44.0 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.205 -0.452 . . . . 74.23 111.157 -179.987 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 2.5 mm100 -93.57 159.53 15.18 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.242 -0.436 . . . . 75.54 110.939 179.979 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 21.2 t -169.36 134.42 1.49 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.233 -0.439 . . . . 75.14 110.846 -179.756 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 137' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER 59.42 -177.75 0.09 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.128 -0.487 . . . . 74.23 110.926 179.993 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 7.3 tm-20 . . . . . 0 C--N 1.33 -0.28 0 CA-C-N 116.171 -0.468 . . . . 62.34 110.846 179.969 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 87.3 mmm . . . . . 0 C--O 1.23 0.072 0 CA-C-O 120.803 0.335 . . . . 62.45 110.809 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 72.6 p -121.51 154.07 37.12 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.214 -0.448 . . . . 72.52 110.835 -179.775 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -117.19 86.7 2.56 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.113 -0.494 . . . . 62.22 110.937 -179.987 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -174.68 140.46 0.59 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.189 -0.459 . . . . 61.43 110.851 -179.929 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 89.8 m-70 56.6 102.27 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.112 -0.495 . . . . 61.0 110.835 179.981 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 5.0 mp 46.8 94.74 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.224 -0.444 . . . . 75.14 110.953 -179.983 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 14.9 t -88.81 168.95 12.03 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.205 -0.452 . . . . 73.3 111.148 179.951 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.614 HD13 ' O ' ' A' ' 72' ' ' PRO . 17.4 mt -66.98 -29.35 69.17 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.202 -0.454 . . . . 72.21 110.948 179.97 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 9' ' ' ASP . . . . . 0.411 ' OD1' ' N ' ' A' ' 9' ' ' ASP . 1.2 m-20 -53.38 -32.58 50.03 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.179 -0.464 . . . . 64.32 110.852 179.863 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 9.8 mm100 -66.99 -38.93 86.93 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.205 -0.452 . . . . 73.33 110.922 -179.969 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 11' ' ' TYR . . . . . 0.53 ' CD1' ' HD2' ' A' ' 75' ' ' PRO . 18.9 m-85 -61.65 -25.08 67.15 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.187 -0.46 . . . . 64.14 110.92 -179.89 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -59.05 -41.69 88.47 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.164 -0.471 . . . . 74.32 110.962 -179.917 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 1.5 mm-40 -62.43 -45.23 94.04 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.085 -0.507 . . . . 74.43 110.897 179.952 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 14' ' ' ILE . . . . . 0.402 HD12 ' H ' ' A' ' 14' ' ' ILE . 4.4 mp -67.21 -39.89 83.95 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.146 -0.479 . . . . 50.51 111.148 -179.999 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 15' ' ' GLN . . . . . 0.521 ' O ' HD13 ' A' ' 19' ' ' LEU . 55.9 mt-30 -62.62 -49.43 75.24 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.171 -0.468 . . . . 64.21 110.889 179.913 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -63.45 -40.67 97.75 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.206 -0.452 . . . . 74.12 110.878 -179.924 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 17' ' ' ASN . . . . . 0.419 ' O ' ' HG3' ' A' ' 20' ' ' GLU . 0.8 OUTLIER -57.71 -33.28 68.23 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.197 -0.456 . . . . 34.41 110.916 -179.91 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 18' ' ' GLU . . . . . 0.527 ' OE1' ' HE1' ' A' ' 70' ' ' MET . 1.4 tt0 -68.42 -37.82 80.65 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.143 -0.481 . . . . 72.41 110.895 -179.992 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.521 HD13 ' O ' ' A' ' 15' ' ' GLN . 10.9 mp -56.65 -52.26 65.56 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.189 -0.459 . . . . 63.13 110.926 -179.98 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 20' ' ' GLU . . . . . 0.419 ' HG3' ' O ' ' A' ' 17' ' ' ASN . 3.6 pt-20 -68.92 -31.97 71.25 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.204 -0.453 . . . . 73.21 110.901 179.952 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -63.59 -48.66 76.45 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.15 -0.477 . . . . 71.41 111.086 179.898 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 22' ' ' ILE . . . . . 0.721 HD11 ' HB2' ' A' ' 115' ' ' PHE . 0.5 OUTLIER -77.22 -34.29 21.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.161 -0.472 . . . . 61.41 111.122 -179.995 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 42.5 mtt180 -52.52 -35.44 53.22 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.208 -0.451 . . . . 72.03 110.874 179.971 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 24.8 p -62.66 -31.19 72.02 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.199 -0.455 . . . . 73.43 110.9 -179.8 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 25' ' ' ILE . . . . . 0.75 HD13 ' CE1' ' A' ' 115' ' ' PHE . 3.9 mt -84.76 -45.44 17.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.08 -0.509 . . . . 75.34 111.154 179.952 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 24.2 m-85 -105.82 44.63 1.03 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.142 -0.481 . . . . 74.41 110.948 179.991 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 2.2 mtm -43.53 -52.38 6.21 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.104 -0.498 . . . . 62.4 110.853 179.918 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 -93.68 -27.32 16.62 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.224 -0.443 . . . . 74.31 110.889 179.93 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 10.5 m-20 -87.62 27.66 1.09 Allowed 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.177 -0.465 . . . . 64.44 110.884 -179.982 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 30' ' ' PHE . . . . . 0.539 ' HA ' HD13 ' A' ' 50' ' ' ILE . 5.4 t80 -106.21 138.7 41.93 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.161 -0.472 . . . . 75.15 110.888 -179.904 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 55.3 m -122.91 133.07 54.42 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.128 -0.487 . . . . 53.04 111.132 -179.909 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 2.8 t70 -105.04 114.9 29.37 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.21 -0.45 . . . . 75.32 110.875 179.911 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.754 HD21 ' CE1' ' A' ' 67' ' ' HIS . 0.2 OUTLIER -115.51 -7.15 12.25 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.147 -0.479 . . . . 63.3 110.935 -179.953 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 34' ' ' THR . . . . . 0.686 ' N ' HD12 ' A' ' 33' ' ' LEU . 0.2 OUTLIER -44.09 143.6 1.12 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.231 -0.44 . . . . 64.44 111.164 179.933 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 2.4 mmtm -57.99 79.25 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.245 -0.434 . . . . 72.23 110.855 179.932 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 36' ' ' ARG . . . . . 0.498 ' N ' ' O ' ' A' ' 34' ' ' THR . 2.0 mmm180 -87.93 -173.7 4.39 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.206 -0.452 . . . . 64.4 110.907 179.945 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -73.1 65.1 0.77 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.209 -0.45 . . . . 74.43 110.889 179.978 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -169.38 -38.18 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.273 -0.421 . . . . 73.45 110.876 -179.839 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 69.1 m -55.7 -172.0 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.158 -0.473 . . . . 73.51 110.878 -179.81 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 40' ' ' TRP . . . . . . . . . . . . . 28.2 p90 -111.12 -8.59 14.41 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.158 -0.474 . . . . 74.54 110.896 -179.966 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 41' ' ' ASP . . . . . 0.434 ' C ' ' HG2' ' A' ' 42' ' ' LYS . 19.3 t0 -124.88 169.19 12.3 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.212 -0.449 . . . . 73.04 110.871 179.901 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 42' ' ' LYS . . . . . 0.434 ' HG2' ' C ' ' A' ' 41' ' ' ASP . 0.1 OUTLIER -139.07 55.63 1.7 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.174 -0.466 . . . . 70.24 110.866 -179.951 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 43' ' ' GLN . . . . . 0.459 ' N ' ' CD ' ' A' ' 44' ' ' PRO . 0.8 OUTLIER -139.37 53.14 4.59 Favored Pre-proline 0 C--N 1.329 -0.305 0 CA-C-O 121.584 0.707 . . . . 72.3 110.914 179.972 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 44' ' ' PRO . . . . . 0.459 ' CD ' ' N ' ' A' ' 43' ' ' GLN . 54.0 Cg_endo -69.73 -166.4 0.18 Allowed 'Trans proline' 0 N--CA 1.465 -0.162 0 C-N-CA 122.703 2.269 . . . . 63.22 112.38 179.97 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 45' ' ' GLN . . . . . 0.964 ' HG2' HG23 ' A' ' 47' ' ' ILE . 0.0 OUTLIER -174.47 28.88 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.25 -0.432 . . . . 65.04 110.881 -179.988 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 46' ' ' ILE . . . . . 0.68 HG22 ' O ' ' A' ' 45' ' ' GLN . 0.1 OUTLIER 86.87 -21.09 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.217 -0.447 . . . . 75.13 111.121 179.988 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 47' ' ' ILE . . . . . 0.964 HG23 ' HG2' ' A' ' 45' ' ' GLN . 0.1 OUTLIER -34.99 152.5 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 116.22 -0.445 . . . . 41.34 111.137 179.841 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 48' ' ' PHE . . . . . 0.713 ' HZ ' HG21 ' A' ' 114' ' ' ILE . 1.7 p90 -161.68 168.21 23.76 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.174 -0.466 . . . . 73.51 110.876 179.965 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 49' ' ' GLU . . . . . 0.457 ' CG ' ' HB2' ' A' ' 67' ' ' HIS . 7.6 mt-10 -121.19 160.98 22.68 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.114 -0.494 . . . . 61.11 110.809 -179.892 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 50' ' ' ILE . . . . . 0.539 HD13 ' HA ' ' A' ' 30' ' ' PHE . 11.5 mm -139.2 134.83 41.3 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.144 -0.48 . . . . 65.24 111.14 179.951 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 93.6 m -88.53 118.33 28.11 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.146 -0.479 . . . . 34.3 111.14 179.997 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 52' ' ' LEU . . . . . 0.927 HD12 HD12 ' A' ' 66' ' ' LEU . 21.2 mt -119.63 165.3 14.64 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.202 -0.453 . . . . 70.24 110.916 179.958 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -175.96 166.53 3.02 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.182 -0.463 . . . . 75.05 110.828 179.985 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -59.3 177.25 0.19 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.177 -0.465 . . . . 64.42 110.859 -179.801 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 16.2 m -90.89 -26.37 5.18 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.147 -0.479 . . . . 71.24 111.096 179.959 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -115.31 -169.79 1.64 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.205 -0.452 . . . . 71.44 110.894 179.924 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -116.27 -23.58 8.33 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.2 -0.455 . . . . 72.31 110.903 -179.996 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 58' ' ' GLU . . . . . 0.551 ' HA ' ' C ' ' A' ' 59' ' ' PRO . 7.9 pt-20 -114.51 146.32 35.67 Favored Pre-proline 0 C--N 1.329 -0.289 0 CA-C-O 121.574 0.702 . . . . 71.4 110.939 179.933 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 59' ' ' PRO . . . . . 0.551 ' C ' ' HA ' ' A' ' 58' ' ' GLU . 54.0 Cg_endo -69.75 -12.54 12.21 Favored 'Cis proline' 0 C--O 1.232 0.194 0 C-N-CA 122.69 -1.796 . . . . 64.32 112.334 -0.025 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 60' ' ' VAL . . . . . 0.938 HG22 ' OE1' ' A' ' 129' ' ' GLN . 12.2 m -147.44 167.61 5.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.25 -0.432 . . . . 63.4 111.138 179.902 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 5.9 tt0 -94.26 -22.64 18.26 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.138 -0.483 . . . . 73.04 110.873 -179.967 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 62' ' ' SER . . . . . 0.626 ' CB ' HD21 ' A' ' 125' ' ' LEU . 1.7 m 42.68 94.66 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.166 -0.47 . . . . 70.33 110.834 -179.819 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 25.5 t -118.97 123.1 43.75 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.141 -0.481 . . . . 75.53 110.878 -179.85 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 64' ' ' ILE . . . . . 0.728 HD11 HG21 ' A' ' 89' ' ' VAL . 52.9 mt -138.08 147.14 26.05 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.092 -0.503 . . . . 44.33 111.126 179.956 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 29.0 m -111.62 113.79 26.42 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.189 -0.46 . . . . 74.43 111.124 179.987 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 66' ' ' LEU . . . . . 1.017 HD21 ' CE1' ' A' ' 83' ' ' PHE . 15.9 mt -91.97 109.95 21.3 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.247 -0.433 . . . . 33.33 110.927 179.928 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 67' ' ' HIS . . . . . 0.754 ' CE1' HD21 ' A' ' 33' ' ' LEU . 1.2 t60 -95.64 109.89 22.08 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.19 -0.459 . . . . 75.22 110.839 179.884 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 68' ' ' PHE . . . . . 0.498 ' HA ' HD13 ' A' ' 81' ' ' ILE . 0.0 OUTLIER -104.02 139.93 38.45 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.219 -0.446 . . . . 53.3 110.874 -179.917 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 69' ' ' ALA . . . . . 0.563 ' HA ' HG22 ' A' ' 47' ' ' ILE . . . -124.44 120.07 30.99 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.165 -0.47 . . . . 34.13 111.087 179.93 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 70' ' ' MET . . . . . 0.527 ' HE1' ' OE1' ' A' ' 18' ' ' GLU . 9.2 mmt -79.63 95.51 5.93 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.199 -0.455 . . . . 75.32 110.864 179.98 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -49.78 160.16 0.65 Allowed Pre-proline 0 C--N 1.33 -0.263 0 CA-C-O 121.639 0.733 . . . . 74.35 111.135 -179.923 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 72' ' ' PRO . . . . . 0.614 ' O ' HD13 ' A' ' 8' ' ' LEU . 53.9 Cg_endo -69.78 3.1 2.98 Favored 'Trans proline' 0 C--N 1.342 0.189 0 C-N-CA 122.691 2.261 . . . . 61.33 112.349 179.963 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 73' ' ' MET . . . . . 0.694 ' HB3' HG23 ' A' ' 77' ' ' THR . 0.0 OUTLIER -120.36 -25.55 5.61 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.194 -0.457 . . . . 74.23 110.881 179.908 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 74' ' ' TYR . . . . . 0.653 ' CD1' ' C ' ' A' ' 74' ' ' TYR . 0.0 OUTLIER -50.52 150.75 4.51 Favored Pre-proline 0 C--N 1.328 -0.337 0 CA-C-O 121.648 0.737 . . . . 74.55 110.916 -179.854 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 75' ' ' PRO . . . . . 0.542 ' C ' ' HA ' ' A' ' 74' ' ' TYR . 53.7 Cg_endo -69.76 -14.12 12.45 Favored 'Cis proline' 0 C--N 1.341 0.183 0 C-N-CA 122.65 -1.813 . . . . 75.43 112.325 -0.089 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 76' ' ' TYR . . . . . 0.502 ' CB ' ' O ' ' A' ' 73' ' ' MET . 6.2 t80 -33.93 -52.64 0.44 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.236 -0.438 . . . . 74.01 110.883 -179.912 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 77' ' ' THR . . . . . 0.694 HG23 ' HB3' ' A' ' 73' ' ' MET . 39.0 p -105.86 -178.88 3.78 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.141 -0.481 . . . . 63.15 111.179 -179.989 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -98.62 129.36 30.32 Favored Pre-proline 0 C--N 1.329 -0.287 0 CA-C-O 121.595 0.712 . . . . 55.25 111.135 179.859 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 79' ' ' PRO . . . . . 0.778 ' HG3' HD11 ' A' ' 113' ' ' ILE . 53.9 Cg_endo -69.74 -170.89 0.42 Allowed 'Trans proline' 0 C--O 1.231 0.152 0 C-N-CA 122.717 2.278 . . . . 51.04 112.366 -179.992 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 80' ' ' GLU . . . . . 0.402 ' O ' HD13 ' A' ' 81' ' ' ILE . 2.1 tt0 -119.77 125.17 47.94 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.224 -0.443 . . . . 73.34 110.878 -179.982 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 81' ' ' ILE . . . . . 0.498 HD13 ' HA ' ' A' ' 68' ' ' PHE . 13.0 mm -121.37 142.38 37.83 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.107 -0.497 . . . . 71.33 111.109 -179.985 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 82' ' ' GLU . . . . . 0.485 ' HG3' ' CD ' ' A' ' 84' ' ' LYS . 11.8 pt-20 -148.61 147.2 28.7 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.162 -0.472 . . . . 64.14 110.886 179.903 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 83' ' ' PHE . . . . . 1.017 ' CE1' HD21 ' A' ' 66' ' ' LEU . 91.2 m-85 -95.79 139.97 31.25 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.12 -0.491 . . . . 73.11 110.893 -179.934 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 84' ' ' LYS . . . . . 0.485 ' CD ' ' HG3' ' A' ' 82' ' ' GLU . 6.0 mmmt -126.25 170.8 11.49 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.159 -0.473 . . . . 74.32 110.918 -179.998 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 85' ' ' ASN . . . . . 0.412 ' O ' ' C ' ' A' ' 86' ' ' VAL . 2.5 m120 63.53 -73.35 0.05 OUTLIER 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.258 -0.428 . . . . 72.2 110.892 179.946 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 86' ' ' VAL . . . . . 0.503 HG11 HD11 ' A' ' 94' ' ' LEU . 4.2 m 36.12 91.0 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 116.162 -0.472 . . . . 63.52 111.182 179.952 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -94.93 -72.49 0.62 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.18 -0.464 . . . . 74.01 110.881 -179.94 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 88' ' ' ASN . . . . . 0.427 ' CG ' ' HB ' ' A' ' 60' ' ' VAL . 24.5 m120 -81.28 47.1 0.99 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.184 -0.462 . . . . 72.52 110.897 -179.954 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 89' ' ' VAL . . . . . 0.728 HG21 HD11 ' A' ' 64' ' ' ILE . 48.1 t -141.71 145.27 24.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.138 -0.483 . . . . 72.34 111.118 179.897 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 90' ' ' MET . . . . . . . . . . . . . 21.3 mtm -92.04 -71.11 0.66 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.15 -0.477 . . . . 73.55 110.871 179.941 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER 178.28 -37.21 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.249 -0.432 . . . . 73.52 110.901 179.951 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -55.97 -45.78 78.82 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.196 -0.456 . . . . 54.11 110.891 -179.805 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 93' ' ' GLN . . . . . 0.581 ' HG2' ' CD2' ' A' ' 128' ' ' PHE . 2.4 mp0 -61.19 -44.38 97.38 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.152 -0.476 . . . . 73.43 110.874 -179.969 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 94' ' ' LEU . . . . . 0.503 HD11 HG11 ' A' ' 86' ' ' VAL . 78.6 mt -59.08 -48.85 80.1 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.188 -0.46 . . . . 64.14 110.92 -179.974 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 2.2 mm-40 -65.1 -33.7 76.64 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.166 -0.47 . . . . 54.42 110.877 179.959 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 96' ' ' MET . . . . . . . . . . . . . 30.5 ttp -59.9 -38.64 82.86 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.212 -0.449 . . . . 75.11 110.852 179.997 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 97' ' ' LEU . . . . . 0.581 ' HB3' ' CZ ' ' A' ' 101' ' ' PHE . 24.9 mt -65.64 -41.09 93.02 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.199 -0.455 . . . . 75.41 110.922 -179.997 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 98' ' ' LYS . . . . . 0.515 ' HA ' ' CD2' ' A' ' 101' ' ' PHE . 13.2 mmtm -55.47 -43.62 75.67 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.17 -0.468 . . . . 73.51 110.867 179.871 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 4.2 t -57.28 -38.2 73.56 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.246 -0.433 . . . . 75.55 110.87 -179.936 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 6.8 mt-10 -74.69 -29.97 61.4 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.12 -0.491 . . . . 73.54 110.887 -179.965 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 101' ' ' PHE . . . . . 0.647 ' CZ ' HD11 ' A' ' 117' ' ' ILE . 14.0 m-30 -61.74 -27.77 68.95 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.164 -0.471 . . . . 74.52 110.896 -179.93 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -65.37 -44.92 86.1 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.106 -0.497 . . . . 75.43 110.927 179.953 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.53 -37.51 74.11 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.199 -0.455 . . . . 62.01 110.912 179.846 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 104' ' ' ILE . . . . . 0.569 HD11 ' CD2' ' A' ' 120' ' ' PHE . 5.0 mt -61.93 -47.54 92.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.257 -0.429 . . . . 71.32 111.104 179.886 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 105' ' ' HIS . . . . . . . . . . . . . 1.6 t60 -62.86 -42.15 99.64 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.19 -0.459 . . . . 74.3 110.844 179.886 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -56.94 -43.37 81.44 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.242 -0.435 . . . . 64.45 110.924 -179.945 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 6.9 t -77.84 -30.71 51.14 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.127 -0.488 . . . . 65.42 111.136 -179.986 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 21.0 m -102.96 24.23 11.04 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.229 -0.441 . . . . 60.02 110.835 -179.866 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 17.9 ttt180 -67.16 77.69 0.14 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.142 -0.481 . . . . 71.21 110.901 -179.993 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 110' ' ' GLY . . . . . 0.472 ' HA2' ' CG ' ' A' ' 75' ' ' PRO . . . 145.64 -18.46 1.83 Allowed Glycine 0 N--CA 1.452 -0.266 0 C-N-CA 120.71 -0.757 . . . . 44.32 112.477 -179.949 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 111' ' ' GLN . . . . . . . . . . . . . 10.0 pt20 -117.49 -165.1 1.05 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.735 0.302 . . . . 72.31 110.928 -179.88 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 53.3 mt-10 -69.08 135.6 51.02 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.215 -0.448 . . . . 74.55 110.88 -179.944 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 113' ' ' ILE . . . . . 0.778 HD11 ' HG3' ' A' ' 79' ' ' PRO . 28.0 pt -123.8 -16.32 4.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.122 -0.49 . . . . 65.23 111.125 179.993 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 114' ' ' ILE . . . . . 0.883 ' O ' HG23 ' A' ' 118' ' ' THR . 29.7 mm -61.19 -38.7 80.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.155 -0.475 . . . . 33.34 111.115 179.878 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 115' ' ' PHE . . . . . 0.75 ' CE1' HD13 ' A' ' 25' ' ' ILE . 43.0 t80 -72.82 -36.16 67.46 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.183 -0.462 . . . . 75.43 110.883 179.969 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 8.3 mm-40 -68.3 -46.66 69.72 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.14 -0.482 . . . . 73.41 110.897 -179.958 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 117' ' ' ILE . . . . . 0.647 HD11 ' CZ ' ' A' ' 101' ' ' PHE . 0.0 OUTLIER -65.79 -41.94 91.29 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 116.161 -0.472 . . . . 74.31 111.111 179.984 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 118' ' ' THR . . . . . 0.883 HG23 ' O ' ' A' ' 114' ' ' ILE . 57.4 p -68.8 -42.95 76.63 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.179 -0.464 . . . . 54.11 111.15 179.943 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 36.6 t -65.13 -44.34 89.0 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.198 -0.455 . . . . 74.42 110.87 -179.867 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 120' ' ' PHE . . . . . 0.569 ' CD2' HD11 ' A' ' 104' ' ' ILE . 0.7 OUTLIER -60.87 -48.08 83.45 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.161 -0.472 . . . . 73.13 110.878 -179.963 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 121' ' ' THR . . . . . 0.957 HG21 HD11 ' A' ' 66' ' ' LEU . 18.9 p -58.77 -38.98 79.68 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.13 -0.486 . . . . 72.12 111.182 -179.94 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 9.1 tt0 -61.46 -40.89 96.14 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.197 -0.456 . . . . 75.45 110.929 179.972 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 123' ' ' GLU . . . . . 0.453 ' HG2' ' N ' ' A' ' 124' ' ' LYS . 1.0 OUTLIER -75.46 -45.0 41.21 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.231 -0.441 . . . . 74.43 110.901 -179.965 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 124' ' ' LYS . . . . . 0.453 ' N ' ' HG2' ' A' ' 123' ' ' GLU . 8.4 mmmt -64.43 -37.83 88.91 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.167 -0.469 . . . . 71.53 110.907 179.957 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 125' ' ' LEU . . . . . 0.789 ' O ' HD23 ' A' ' 125' ' ' LEU . 3.6 tt -69.65 -44.59 70.23 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.18 -0.464 . . . . 73.41 110.919 179.909 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 126' ' ' ASP . . . . . 0.424 ' OD1' ' C ' ' A' ' 126' ' ' ASP . 0.0 OUTLIER -68.61 -39.89 80.65 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.183 -0.462 . . . . 73.52 110.833 179.858 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 127' ' ' GLU . . . . . 0.491 ' HG3' ' N ' ' A' ' 128' ' ' PHE . 3.2 pt-20 -65.62 -42.77 91.17 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.225 -0.443 . . . . 63.4 110.882 -179.889 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 128' ' ' PHE . . . . . 0.659 ' CD1' ' C ' ' A' ' 128' ' ' PHE . 0.0 OUTLIER -75.16 -58.95 2.97 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.165 -0.47 . . . . 74.3 110.911 -179.926 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 129' ' ' GLN . . . . . 0.938 ' OE1' HG22 ' A' ' 60' ' ' VAL . 1.3 tm0? -46.75 -20.31 0.13 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.167 -0.469 . . . . 72.13 110.926 -179.934 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 130' ' ' ASN . . . . . . . . . . . . . 12.1 t-20 -62.52 -64.58 0.88 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.203 -0.453 . . . . 54.4 110.872 -179.951 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 18.7 m -147.75 -36.32 0.1 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.178 -0.464 . . . . 73.1 111.098 179.925 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 132' ' ' VAL . . . . . 0.638 HG22 ' O ' ' A' ' 132' ' ' VAL . 2.5 p 39.53 72.52 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.217 -0.447 . . . . 62.0 111.105 179.958 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 133' ' ' ASN . . . . . . . . . . . . . 4.6 t-20 71.65 -66.95 0.28 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.162 -0.472 . . . . 72.3 110.883 179.975 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 134' ' ' THR . . . . . . . . . . . . . 80.3 m -135.95 117.24 14.57 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.209 -0.45 . . . . 74.32 111.164 179.978 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 6.9 pt20 -72.47 126.4 29.76 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.223 -0.444 . . . . 73.22 110.933 -179.988 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -145.5 168.45 20.55 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.218 -0.446 . . . . 60.31 110.904 -179.789 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 137' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -126.55 150.36 48.87 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.162 -0.472 . . . . 72.31 110.914 -179.984 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 2.3 tt0 . . . . . 0 C--N 1.329 -0.29 0 CA-C-N 116.179 -0.464 . . . . 64.25 110.904 179.934 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 4.8 mmm . . . . . 0 C--O 1.231 0.085 0 CA-C-O 120.74 0.305 . . . . 62.33 110.916 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -60.18 89.72 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.24 -0.436 . . . . 75.42 110.807 -179.77 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -63.36 95.11 0.09 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.098 -0.501 . . . . 73.41 110.9 179.994 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -109.24 156.55 19.78 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.178 -0.464 . . . . 53.15 110.867 -179.954 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 5' ' ' HIS . . . . . 0.442 ' O ' ' C ' ' A' ' 6' ' ' LEU . 17.6 p-80 -76.52 149.98 36.64 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.118 -0.492 . . . . 75.11 110.839 179.978 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 6' ' ' LEU . . . . . 0.442 ' C ' ' O ' ' A' ' 5' ' ' HIS . 0.1 OUTLIER 35.2 81.09 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.202 -0.454 . . . . 74.35 110.938 -179.982 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 14.9 t -170.45 162.29 8.21 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.15 -0.477 . . . . 70.02 111.152 179.967 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.71 HD13 ' O ' ' A' ' 72' ' ' PRO . 20.1 mt -54.61 -27.94 43.01 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.247 -0.433 . . . . 71.22 110.926 179.939 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -51.52 -31.67 24.87 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.211 -0.45 . . . . 74.13 110.85 179.856 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 8.7 mm100 -67.85 -35.49 78.66 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.178 -0.464 . . . . 73.45 110.88 -179.87 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 11' ' ' TYR . . . . . 0.402 ' CD1' ' HD2' ' A' ' 75' ' ' PRO . 13.6 m-85 -67.61 -24.98 65.53 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.208 -0.451 . . . . 74.11 110.933 -179.893 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -59.26 -38.08 79.18 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.146 -0.479 . . . . 64.1 110.925 -179.917 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 2.7 mm-40 -58.86 -46.0 88.8 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.126 -0.488 . . . . 44.34 110.903 179.979 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 14' ' ' ILE . . . . . 0.541 HG22 ' OE1' ' A' ' 18' ' ' GLU . 4.2 mp -68.05 -46.64 81.27 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.179 -0.464 . . . . 74.23 111.115 179.961 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 84.5 mt-30 -57.21 -48.22 79.33 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.202 -0.453 . . . . 74.32 110.89 179.966 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -62.22 -42.27 99.15 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.263 -0.426 . . . . 74.05 110.886 -179.945 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 2.5 m-20 -58.1 -33.64 69.33 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.168 -0.469 . . . . 74.41 110.876 -179.879 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 18' ' ' GLU . . . . . 0.541 ' OE1' HG22 ' A' ' 14' ' ' ILE . 2.4 mp0 -65.44 -38.85 91.1 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.163 -0.471 . . . . 74.23 110.93 179.986 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 8.5 mp -63.7 -51.7 63.84 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.103 -0.499 . . . . 74.12 110.909 -179.972 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 1.9 pt-20 -68.9 -32.72 72.55 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.163 -0.472 . . . . 73.32 110.888 179.925 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -62.06 -50.56 71.51 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.175 -0.466 . . . . 75.54 111.07 179.95 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 22' ' ' ILE . . . . . 0.716 ' HA ' HD12 ' A' ' 25' ' ' ILE . 0.6 OUTLIER -77.23 -34.36 21.2 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 116.249 -0.432 . . . . 72.54 111.112 179.985 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 44.4 mtp180 -52.54 -35.02 52.6 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.187 -0.46 . . . . 53.42 110.89 179.973 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -66.98 -31.43 72.0 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.191 -0.459 . . . . 51.42 110.828 -179.812 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 25' ' ' ILE . . . . . 0.722 HG21 ' HE1' ' A' ' 115' ' ' PHE . 3.9 mt -82.89 -44.41 18.96 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.159 -0.473 . . . . 74.5 111.137 179.967 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 26.6 m-85 -106.6 41.16 1.49 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.193 -0.458 . . . . 73.34 110.964 -179.994 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER -40.4 -49.38 2.82 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.099 -0.501 . . . . 71.42 110.895 179.91 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -98.39 -9.02 25.88 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.196 -0.456 . . . . 43.42 110.872 179.981 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -104.67 32.65 3.98 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.218 -0.446 . . . . 72.24 110.819 -179.999 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 30' ' ' PHE . . . . . 0.627 ' HA ' HD13 ' A' ' 50' ' ' ILE . 1.7 t80 -116.55 138.39 51.45 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.234 -0.439 . . . . 73.11 110.89 -179.95 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 52.3 m -111.71 129.79 55.99 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.147 -0.479 . . . . 71.34 111.089 -179.857 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 32' ' ' ASP . . . . . 0.452 ' O ' ' CG ' ' A' ' 32' ' ' ASP . 0.0 OUTLIER -99.36 115.62 29.64 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.215 -0.448 . . . . 53.1 110.864 179.861 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.854 HD21 HG12 ' A' ' 47' ' ' ILE . 0.4 OUTLIER -123.48 -17.04 6.62 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.138 -0.483 . . . . 63.34 110.943 -179.976 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 34' ' ' THR . . . . . 0.81 ' N ' HD23 ' A' ' 33' ' ' LEU . 1.2 m -45.69 135.41 6.77 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.187 -0.46 . . . . 75.33 111.098 180.0 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -75.38 90.9 2.68 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.209 -0.45 . . . . 74.11 110.924 179.904 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -123.27 -155.75 0.67 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.242 -0.436 . . . . 71.24 110.871 -179.976 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 37' ' ' LYS . . . . . 0.418 ' O ' ' O ' ' A' ' 38' ' ' SER . 3.2 mmpt? 52.32 -172.42 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.188 -0.46 . . . . 72.42 110.905 179.987 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 38' ' ' SER . . . . . 0.418 ' O ' ' O ' ' A' ' 37' ' ' LYS . 2.2 t -38.02 -93.07 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.175 -0.466 . . . . 71.14 110.915 -179.932 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 39' ' ' SER . . . . . 0.401 ' N ' ' OG ' ' A' ' 38' ' ' SER . 73.3 m 55.65 -174.17 0.05 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.12 -0.491 . . . . 72.51 110.87 -179.86 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 40' ' ' TRP . . . . . . . . . . . . . 26.9 p90 -109.06 -25.63 10.58 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.156 -0.474 . . . . 74.44 110.881 -179.958 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 2.1 p30 -121.91 146.48 47.08 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.232 -0.44 . . . . 63.44 110.831 179.935 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -133.91 72.07 1.47 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.168 -0.469 . . . . 71.33 110.906 179.962 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 5.1 tt0 -124.46 63.67 36.17 Favored Pre-proline 0 C--N 1.329 -0.287 0 CA-C-O 121.579 0.704 . . . . 62.01 110.918 179.942 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.78 129.92 18.41 Favored 'Trans proline' 0 C--N 1.341 0.164 0 C-N-CA 122.671 2.247 . . . . 73.23 112.358 179.996 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 45' ' ' GLN . . . . . 0.559 ' O ' HG22 ' A' ' 46' ' ' ILE . 16.2 tt0 -106.42 8.47 31.58 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.235 -0.439 . . . . 73.44 110.931 -179.971 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 46' ' ' ILE . . . . . 0.559 HG22 ' O ' ' A' ' 45' ' ' GLN . 0.0 OUTLIER 82.02 -3.99 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.179 -0.464 . . . . 74.23 111.146 179.979 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 47' ' ' ILE . . . . . 0.854 HG12 HD21 ' A' ' 33' ' ' LEU . 0.2 OUTLIER -59.83 143.37 14.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.162 -0.472 . . . . 71.44 111.117 179.844 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 48' ' ' PHE . . . . . 0.767 ' HA ' HD22 ' A' ' 33' ' ' LEU . 4.2 p90 -155.54 154.73 32.19 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.218 -0.447 . . . . 73.51 110.884 179.955 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 49' ' ' GLU . . . . . 0.69 ' CG ' HD13 ' A' ' 33' ' ' LEU . 6.0 mt-10 -108.93 159.17 17.02 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.178 -0.465 . . . . 64.1 110.928 -179.971 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 50' ' ' ILE . . . . . 0.627 HD13 ' HA ' ' A' ' 30' ' ' PHE . 7.3 mm -133.95 140.6 46.0 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 116.174 -0.466 . . . . 71.43 111.179 179.962 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 88.9 m -85.21 118.58 24.84 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.208 -0.451 . . . . 73.11 111.153 179.99 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 52' ' ' LEU . . . . . 0.474 HD12 HD22 ' A' ' 66' ' ' LEU . 17.0 mt -123.3 163.23 21.13 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.286 -0.415 . . . . 74.12 110.925 179.962 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -178.43 175.54 1.14 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.211 -0.45 . . . . 73.22 110.905 179.979 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -70.12 -156.08 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.16 -0.473 . . . . 64.2 110.873 -179.811 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 18.0 m -117.72 -20.08 5.62 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.138 -0.483 . . . . 63.22 111.156 179.926 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -112.44 174.73 5.75 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.171 -0.468 . . . . 54.03 110.89 179.916 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -111.8 -22.38 11.16 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.173 -0.467 . . . . 73.12 110.895 179.989 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 58' ' ' GLU . . . . . 0.543 ' HA ' ' C ' ' A' ' 59' ' ' PRO . 3.4 pt-20 -126.32 148.91 65.6 Favored Pre-proline 0 C--N 1.33 -0.26 0 CA-C-O 121.692 0.758 . . . . 55.33 110.84 179.956 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 59' ' ' PRO . . . . . 0.543 ' C ' ' HA ' ' A' ' 58' ' ' GLU . 54.0 Cg_endo -69.72 -8.58 10.5 Favored 'Cis proline' 0 C--N 1.342 0.186 0 C-N-CA 122.737 -1.776 . . . . 74.34 112.33 0.012 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 60' ' ' VAL . . . . . 0.538 ' CG2' ' CG ' ' A' ' 129' ' ' GLN . 29.2 m -139.5 172.27 13.08 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.193 -0.458 . . . . 64.42 111.131 179.923 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 5.1 tt0 -108.35 -17.15 14.07 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.143 -0.48 . . . . 74.32 110.882 179.99 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 62' ' ' SER . . . . . 0.805 ' CB ' HD11 ' A' ' 125' ' ' LEU . 0.3 OUTLIER 41.4 93.43 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.193 -0.458 . . . . 41.55 110.86 -179.773 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 16.1 t -124.5 124.02 41.38 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.112 -0.495 . . . . 73.14 110.835 -179.831 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 64' ' ' ILE . . . . . . . . . . . . . 14.5 mt -138.34 146.06 27.37 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 116.124 -0.489 . . . . 73.0 111.155 179.889 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 62.1 m -110.32 113.69 26.55 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.162 -0.472 . . . . 73.44 111.159 179.996 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 66' ' ' LEU . . . . . 0.636 HD21 HG21 ' A' ' 121' ' ' THR . 0.4 OUTLIER -91.75 112.24 24.08 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.267 -0.424 . . . . 63.03 110.92 179.955 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 1.9 t-80 -105.27 109.87 22.02 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.203 -0.453 . . . . 74.53 110.872 179.841 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 68' ' ' PHE . . . . . 0.501 ' HA ' HD13 ' A' ' 81' ' ' ILE . 0.0 OUTLIER -103.75 140.12 38.05 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.208 -0.451 . . . . 71.43 110.871 -179.916 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -119.3 129.36 54.84 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.159 -0.473 . . . . 43.32 111.093 179.921 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 70' ' ' MET . . . . . 0.794 ' HE3' HD11 ' A' ' 114' ' ' ILE . 17.8 mmt -91.35 95.7 10.14 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.22 -0.445 . . . . 61.43 110.845 -179.993 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -51.61 159.96 1.14 Allowed Pre-proline 0 C--N 1.329 -0.295 0 CA-C-O 121.578 0.704 . . . . 63.03 111.129 -179.91 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 72' ' ' PRO . . . . . 0.71 ' O ' HD13 ' A' ' 8' ' ' LEU . 53.8 Cg_endo -69.8 3.29 2.88 Favored 'Trans proline' 0 C--N 1.341 0.163 0 C-N-CA 122.705 2.27 . . . . 75.32 112.362 179.944 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 73' ' ' MET . . . . . 0.514 ' HB3' HG23 ' A' ' 77' ' ' THR . 0.1 OUTLIER -119.73 -25.78 5.83 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.182 -0.463 . . . . 72.44 110.921 179.911 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 74' ' ' TYR . . . . . 0.651 ' CD1' ' C ' ' A' ' 74' ' ' TYR . 0.0 OUTLIER -48.37 149.59 2.69 Favored Pre-proline 0 C--N 1.329 -0.305 0 CA-C-O 121.692 0.758 . . . . 65.44 110.987 -179.909 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 75' ' ' PRO . . . . . 0.536 ' C ' ' HA ' ' A' ' 74' ' ' TYR . 53.6 Cg_endo -69.84 -13.0 12.51 Favored 'Cis proline' 0 C--O 1.232 0.184 0 C-N-CA 122.688 -1.797 . . . . 43.54 112.341 0.059 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 76' ' ' TYR . . . . . 0.489 ' CB ' ' O ' ' A' ' 73' ' ' MET . 1.5 t80 -34.89 -48.48 0.4 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.232 -0.44 . . . . 73.41 110.91 -179.917 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 77' ' ' THR . . . . . 0.514 HG23 ' HB3' ' A' ' 73' ' ' MET . 69.6 p -108.2 169.92 8.33 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.119 -0.491 . . . . 75.12 111.168 -179.985 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -89.59 129.81 45.64 Favored Pre-proline 0 C--N 1.33 -0.282 0 CA-C-O 121.57 0.7 . . . . 44.54 111.121 179.858 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 79' ' ' PRO . . . . . 0.778 ' HG3' HD11 ' A' ' 113' ' ' ILE . 53.6 Cg_endo -69.77 179.38 3.74 Favored 'Trans proline' 0 C--N 1.341 0.163 0 C-N-CA 122.643 2.229 . . . . 63.11 112.355 -179.989 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -117.1 137.13 52.49 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.219 -0.446 . . . . 73.04 110.846 -179.921 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 81' ' ' ILE . . . . . 0.501 HD13 ' HA ' ' A' ' 68' ' ' PHE . 5.2 mm -125.45 144.21 36.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.164 -0.471 . . . . 74.31 111.139 179.964 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 82' ' ' GLU . . . . . 0.473 ' HG3' ' CD ' ' A' ' 84' ' ' LYS . 3.0 pt-20 -145.48 141.25 28.16 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.175 -0.466 . . . . 75.04 110.901 179.985 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 83' ' ' PHE . . . . . 0.636 ' CG ' HD22 ' A' ' 94' ' ' LEU . 7.5 m-85 -96.97 141.02 30.64 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.196 -0.456 . . . . 65.1 110.886 -179.916 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 84' ' ' LYS . . . . . 0.473 ' CD ' ' HG3' ' A' ' 82' ' ' GLU . 5.1 mmmt -125.45 172.22 9.84 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.124 -0.489 . . . . 72.11 110.9 179.952 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 85' ' ' ASN . . . . . 0.4 ' C ' ' CG2' ' A' ' 86' ' ' VAL . 5.7 m120 61.48 -75.24 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.222 -0.445 . . . . 65.32 110.865 179.939 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 86' ' ' VAL . . . . . 1.012 HG11 HD11 ' A' ' 94' ' ' LEU . 2.4 m 39.96 92.63 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.233 -0.44 . . . . 74.41 111.125 179.916 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -97.06 -87.43 0.31 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.147 -0.478 . . . . 63.04 110.938 -179.992 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -47.93 -51.25 24.15 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.199 -0.455 . . . . 74.43 110.897 -179.985 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 89' ' ' VAL . . . . . 0.694 HG21 ' HG ' ' A' ' 94' ' ' LEU . 1.2 p -59.53 135.2 24.34 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.187 -0.461 . . . . 75.11 111.123 179.903 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 90' ' ' MET . . . . . . . . . . . . . 4.7 mtm -86.87 -60.82 1.88 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.168 -0.469 . . . . 73.22 110.882 179.925 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 3.5 p-10 179.41 -32.1 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.198 -0.455 . . . . 74.14 110.858 179.961 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 99.8 p -54.6 -45.35 73.63 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.2 -0.455 . . . . 75.33 110.832 -179.773 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 93' ' ' GLN . . . . . 0.645 ' CD ' ' CD1' ' A' ' 128' ' ' PHE . 1.2 mt-30 -70.2 -38.09 75.25 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.14 -0.482 . . . . 70.34 110.894 -179.947 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 94' ' ' LEU . . . . . 1.012 HD11 HG11 ' A' ' 86' ' ' VAL . 29.2 mt -58.84 -47.77 83.68 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.217 -0.447 . . . . 72.51 110.91 -179.986 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 28.4 mt-30 -62.78 -34.1 76.56 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.168 -0.469 . . . . 74.31 110.952 179.919 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 96' ' ' MET . . . . . . . . . . . . . 43.5 ttp -60.47 -37.27 80.48 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.199 -0.455 . . . . 63.43 110.86 179.941 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 97' ' ' LEU . . . . . 0.984 HD22 HG22 ' A' ' 121' ' ' THR . 80.4 mt -61.41 -46.57 89.57 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.223 -0.444 . . . . 73.23 110.891 -179.97 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 98' ' ' LYS . . . . . 0.528 ' HD3' ' CZ ' ' A' ' 83' ' ' PHE . 3.9 mmtp -58.12 -34.16 69.92 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.204 -0.453 . . . . 70.24 110.87 179.896 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 1.4 t -69.68 -46.29 66.4 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.207 -0.452 . . . . 71.0 110.822 -179.887 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 100' ' ' GLU . . . . . 0.67 ' O ' HD12 ' A' ' 104' ' ' ILE . 7.7 pt-20 -72.38 -23.88 61.18 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.145 -0.48 . . . . 71.32 110.926 -179.973 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 101' ' ' PHE . . . . . 0.611 ' CD1' ' O ' ' A' ' 97' ' ' LEU . 10.1 m-30 -59.42 -22.9 62.14 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.121 -0.49 . . . . 63.3 110.886 -179.93 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.46 -45.38 59.78 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.155 -0.475 . . . . 74.03 110.858 -179.999 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 24.6 mtmm -63.24 -38.8 92.57 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.189 -0.46 . . . . 55.13 110.869 179.922 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 104' ' ' ILE . . . . . 0.716 HD11 ' CD2' ' A' ' 120' ' ' PHE . 1.6 mp -63.08 -47.63 91.66 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.218 -0.446 . . . . 73.54 111.108 179.876 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 105' ' ' HIS . . . . . . . . . . . . . 9.3 t-80 -63.12 -41.88 99.43 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.201 -0.454 . . . . 73.44 110.866 179.867 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -56.73 -43.39 80.6 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.21 -0.45 . . . . 72.21 110.9 -179.929 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 107' ' ' THR . . . . . 0.411 HG22 ' O ' ' A' ' 104' ' ' ILE . 7.6 t -77.73 -22.39 50.44 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.185 -0.461 . . . . 71.01 111.162 -179.983 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 108' ' ' SER . . . . . 0.584 ' HB3' HG22 ' A' ' 113' ' ' ILE . 1.7 m -118.3 35.46 4.75 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.197 -0.456 . . . . 73.43 110.862 -179.851 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 14.4 ttt180 -75.87 88.41 2.88 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.163 -0.471 . . . . 70.1 110.85 -179.919 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 123.33 32.85 0.87 Allowed Glycine 0 N--CA 1.45 -0.369 0 C-N-CA 120.754 -0.736 . . . . 51.41 112.49 179.987 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 111' ' ' GLN . . . . . . . . . . . . . 3.4 pt20 -169.28 -162.98 0.38 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.794 0.331 . . . . 71.42 110.878 -179.888 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 35.3 mt-10 -65.9 127.1 30.7 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.162 -0.472 . . . . 74.13 110.833 -179.896 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 113' ' ' ILE . . . . . 0.778 HD11 ' HG3' ' A' ' 79' ' ' PRO . 7.4 pt -126.35 -8.35 5.1 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 116.122 -0.49 . . . . 61.24 111.13 179.947 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 114' ' ' ILE . . . . . 0.883 ' H ' HD12 ' A' ' 114' ' ' ILE . 3.6 mp -67.73 -46.77 81.92 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.174 -0.466 . . . . 73.23 111.114 179.873 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 115' ' ' PHE . . . . . 0.722 ' HE1' HG21 ' A' ' 25' ' ' ILE . 28.1 t80 -68.28 -36.42 79.37 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.157 -0.474 . . . . 72.42 110.852 -179.979 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 53.4 mm-40 -67.54 -45.79 74.68 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.139 -0.482 . . . . 71.54 110.911 -179.945 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 117' ' ' ILE . . . . . 0.532 HD11 ' CG ' ' A' ' 101' ' ' PHE . 0.4 OUTLIER -67.15 -40.41 85.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.111 -0.495 . . . . 74.2 111.141 179.983 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 118' ' ' THR . . . . . 0.802 HG23 ' O ' ' A' ' 114' ' ' ILE . 62.1 p -68.35 -43.43 77.49 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.156 -0.475 . . . . 44.14 111.114 179.956 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -64.9 -43.89 91.39 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.26 -0.427 . . . . 51.01 110.829 -179.824 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 120' ' ' PHE . . . . . 0.716 ' CD2' HD11 ' A' ' 104' ' ' ILE . 0.1 OUTLIER -60.86 -48.58 81.15 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.13 -0.486 . . . . 74.24 110.904 -179.961 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 121' ' ' THR . . . . . 0.984 HG22 HD22 ' A' ' 97' ' ' LEU . 29.5 p -64.52 -40.31 95.39 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.128 -0.487 . . . . 63.23 111.145 -179.949 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 16.1 tt0 -60.17 -38.14 82.28 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.211 -0.449 . . . . 71.23 110.955 179.985 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 123' ' ' GLU . . . . . 0.515 ' C ' ' CD ' ' A' ' 123' ' ' GLU . 0.1 OUTLIER -77.87 -46.38 21.55 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.156 -0.475 . . . . 74.32 110.947 179.986 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.4 -34.1 77.39 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.127 -0.488 . . . . 74.32 110.889 179.96 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 125' ' ' LEU . . . . . 0.805 HD11 ' CB ' ' A' ' 62' ' ' SER . 1.8 tp -68.96 -43.37 75.14 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.236 -0.438 . . . . 63.43 110.925 179.926 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -68.12 -36.95 80.55 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.139 -0.482 . . . . 74.53 110.885 179.863 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 127' ' ' GLU . . . . . 0.42 ' HG3' ' N ' ' A' ' 128' ' ' PHE . 0.0 OUTLIER -62.39 -28.76 70.0 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.155 -0.475 . . . . 70.14 110.906 -179.947 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 128' ' ' PHE . . . . . 0.645 ' CD1' ' CD ' ' A' ' 93' ' ' GLN . 0.2 OUTLIER -77.07 -31.26 55.92 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.143 -0.48 . . . . 65.54 110.907 -179.918 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 129' ' ' GLN . . . . . 0.538 ' CG ' ' CG2' ' A' ' 60' ' ' VAL . 0.3 OUTLIER -100.65 32.84 2.96 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.138 -0.483 . . . . 75.41 110.909 180.0 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 130' ' ' ASN . . . . . . . . . . . . . 1.7 t-20 -101.07 -39.61 7.62 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.208 -0.451 . . . . 73.43 110.902 -179.984 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 131' ' ' VAL . . . . . 0.625 HG23 ' O ' ' A' ' 131' ' ' VAL . 26.3 m -134.39 93.78 1.43 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.156 -0.475 . . . . 72.2 111.146 179.887 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 132' ' ' VAL . . . . . . . . . . . . . 94.8 t -92.74 127.2 45.02 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.14 -0.482 . . . . 73.34 111.137 179.911 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 133' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -139.91 30.2 2.05 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.212 -0.449 . . . . 72.24 110.864 179.961 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 134' ' ' THR . . . . . . . . . . . . . 34.7 p -126.45 156.0 41.33 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.207 -0.451 . . . . 44.0 111.143 -179.999 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -89.17 111.89 22.77 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.18 -0.463 . . . . 74.33 110.894 -179.967 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 3.4 m -137.23 124.45 21.76 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.214 -0.448 . . . . 64.03 110.808 -179.792 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 137' ' ' LEU . . . . . . . . . . . . . 15.4 tp -168.21 -49.15 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.125 -0.489 . . . . 75.41 110.927 -179.983 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.329 -0.283 0 CA-C-N 116.113 -0.494 . . . . 60.23 110.858 179.956 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.23 0.062 0 CA-C-O 120.798 0.332 . . . . 72.03 110.871 . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -120.25 133.78 55.4 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.215 -0.448 . . . . 72.24 110.892 -179.815 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER 177.19 125.14 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.162 -0.472 . . . . 53.41 110.903 -179.97 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 12.4 p -108.7 51.18 0.75 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.166 -0.47 . . . . 74.31 110.806 -179.9 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 1.1 t-160 -140.06 82.55 1.87 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.157 -0.474 . . . . 73.44 110.867 179.986 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER 38.9 89.08 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.258 -0.428 . . . . 62.53 110.945 -179.967 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -134.79 169.39 17.43 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.22 -0.446 . . . . 74.43 111.115 179.945 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.416 HD13 ' O ' ' A' ' 72' ' ' PRO . 16.6 mt -58.34 -26.78 63.5 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.175 -0.466 . . . . 74.53 110.926 179.987 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -51.4 -32.02 24.8 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.181 -0.463 . . . . 73.54 110.885 179.802 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 11.4 mm-40 -68.4 -40.32 81.35 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.185 -0.462 . . . . 72.45 110.896 -179.906 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 10.4 m-85 -49.37 -23.32 1.42 Allowed 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.229 -0.441 . . . . 74.25 110.896 -179.85 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 9.1 m-85 -57.72 -36.34 71.88 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.158 -0.474 . . . . 73.12 110.958 -179.919 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 13' ' ' GLU . . . . . 0.601 ' CG ' HD12 ' A' ' 14' ' ' ILE . 11.9 pt-20 -60.97 -43.55 98.6 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.068 -0.514 . . . . 74.23 110.868 -179.965 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 14' ' ' ILE . . . . . 0.601 HD12 ' CG ' ' A' ' 13' ' ' GLU . 2.8 mp -68.15 -43.32 85.11 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.179 -0.464 . . . . 74.05 111.19 179.932 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 15' ' ' GLN . . . . . 0.473 ' HG2' ' CB ' ' A' ' 70' ' ' MET . 20.4 mt-30 -63.16 -45.74 90.44 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.118 -0.492 . . . . 54.34 110.931 179.928 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 16.1 t -58.86 -41.59 87.38 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.224 -0.444 . . . . 64.22 110.869 -179.934 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 4.8 m-20 -63.15 -34.02 76.71 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.191 -0.459 . . . . 73.04 110.87 -179.917 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 18' ' ' GLU . . . . . 0.415 ' N ' ' OE1' ' A' ' 18' ' ' GLU . 0.0 OUTLIER -66.22 -38.99 89.25 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.193 -0.458 . . . . 61.1 110.89 -179.994 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.726 HD11 HG13 ' A' ' 46' ' ' ILE . 6.0 mt -60.79 -51.64 68.48 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.18 -0.463 . . . . 61.13 110.883 -179.968 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 4.8 pt-20 -68.74 -38.15 79.93 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.227 -0.442 . . . . 52.42 110.863 179.943 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -58.63 -50.54 73.47 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.154 -0.475 . . . . 62.13 111.084 179.977 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 22' ' ' ILE . . . . . 0.577 ' HA ' HD12 ' A' ' 25' ' ' ILE . 0.7 OUTLIER -75.49 -35.83 33.45 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.218 -0.446 . . . . 74.21 111.115 179.984 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 7.2 mtp180 -52.55 -34.25 49.28 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.178 -0.464 . . . . 72.45 110.873 179.981 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -66.39 -34.55 78.21 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.183 -0.462 . . . . 74.05 110.831 -179.816 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 25' ' ' ILE . . . . . 0.9 HD13 ' CE1' ' A' ' 115' ' ' PHE . 3.7 mt -79.92 -45.34 22.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.178 -0.465 . . . . 61.11 111.117 179.977 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 34.9 m-85 -109.78 45.38 1.1 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.177 -0.465 . . . . 63.41 110.974 -179.989 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 27' ' ' MET . . . . . 0.417 ' H ' ' HE2' ' A' ' 27' ' ' MET . 0.4 OUTLIER -39.68 -55.6 1.86 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.103 -0.499 . . . . 72.32 110.882 179.921 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -95.28 -14.69 23.76 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.252 -0.431 . . . . 72.32 110.88 179.945 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 4.4 m-20 -92.75 31.01 1.44 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.185 -0.461 . . . . 72.41 110.897 179.997 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 30' ' ' PHE . . . . . 0.519 ' CD1' ' C ' ' A' ' 30' ' ' PHE . 2.0 t80 -120.39 142.26 49.35 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.163 -0.471 . . . . 74.51 110.846 -179.881 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 31' ' ' THR . . . . . 0.45 ' N ' ' CD1' ' A' ' 30' ' ' PHE . 18.2 m -119.01 129.38 55.1 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.16 -0.473 . . . . 74.44 111.148 -179.925 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 10.2 t0 -89.27 113.6 24.87 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.206 -0.452 . . . . 70.12 110.883 179.902 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.991 HD21 HG12 ' A' ' 47' ' ' ILE . 0.4 OUTLIER -120.19 -28.92 4.98 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.159 -0.473 . . . . 63.34 110.891 -179.962 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 34' ' ' THR . . . . . 0.934 ' N ' HD23 ' A' ' 33' ' ' LEU . 5.2 m -40.38 139.42 0.76 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.231 -0.441 . . . . 72.53 111.166 179.957 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -81.96 49.8 1.44 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.237 -0.438 . . . . 74.44 110.862 179.981 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 36' ' ' ARG . . . . . 0.533 ' HG2' HG22 ' A' ' 34' ' ' THR . 4.8 mmm180 -79.93 131.64 35.88 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.228 -0.442 . . . . 75.34 110.891 179.986 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER 38.41 66.2 0.53 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.176 -0.465 . . . . 65.14 110.901 179.975 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 1.2 m -135.85 156.35 48.92 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.219 -0.446 . . . . 75.31 110.827 -179.901 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 39' ' ' SER . . . . . 0.441 ' O ' ' HB3' ' A' ' 40' ' ' TRP . 21.1 m -82.79 174.77 10.66 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.106 -0.497 . . . . 55.14 110.883 -179.838 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 40' ' ' TRP . . . . . 0.594 ' CE3' ' O ' ' A' ' 40' ' ' TRP . 0.0 OUTLIER 78.41 -32.48 0.16 Allowed 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.175 -0.466 . . . . 65.12 110.939 -179.978 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 41' ' ' ASP . . . . . 0.558 ' HB2' ' CD2' ' A' ' 40' ' ' TRP . 0.7 OUTLIER 173.54 154.54 0.1 Allowed 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.248 -0.433 . . . . 53.13 110.887 179.933 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 8.1 mttt -135.58 67.34 1.48 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.183 -0.462 . . . . 74.1 110.914 179.99 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -119.24 62.25 6.2 Favored Pre-proline 0 C--N 1.329 -0.283 0 CA-C-O 121.608 0.718 . . . . 62.23 110.888 -179.995 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.72 162.56 41.57 Favored 'Trans proline' 0 C--N 1.341 0.178 0 C-N-CA 122.698 2.266 . . . . 75.33 112.346 179.995 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 45' ' ' GLN . . . . . 0.519 ' CG ' ' O ' ' A' ' 45' ' ' GLN . 7.3 tt0 -140.26 11.56 2.36 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.219 -0.446 . . . . 62.15 110.921 -179.999 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 46' ' ' ILE . . . . . 0.726 HG13 HD11 ' A' ' 19' ' ' LEU . 0.0 OUTLIER 82.81 -28.1 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.215 -0.448 . . . . 72.05 111.118 179.952 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 47' ' ' ILE . . . . . 0.991 HG12 HD21 ' A' ' 33' ' ' LEU . 0.2 OUTLIER -37.97 150.42 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.147 -0.479 . . . . 54.21 111.129 179.877 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 48' ' ' PHE . . . . . 0.733 ' HA ' HD22 ' A' ' 33' ' ' LEU . 1.6 p90 -152.35 157.93 41.99 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.187 -0.46 . . . . 64.42 110.902 179.967 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 49' ' ' GLU . . . . . 0.678 ' HG3' HD13 ' A' ' 33' ' ' LEU . 7.1 mt-10 -108.76 147.43 32.03 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.164 -0.471 . . . . 55.44 110.886 -179.939 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 50' ' ' ILE . . . . . 0.417 HD13 ' HA ' ' A' ' 30' ' ' PHE . 10.8 mm -129.32 135.23 62.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.172 -0.467 . . . . 71.52 111.132 179.955 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 98.4 m -84.27 132.16 34.66 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.174 -0.466 . . . . 62.21 111.134 179.945 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 52' ' ' LEU . . . . . 0.717 HD12 HD12 ' A' ' 66' ' ' LEU . 19.8 mt -132.83 157.04 46.01 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.18 -0.464 . . . . 63.41 110.88 179.983 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 53' ' ' ARG . . . . . 0.741 ' C ' HD21 ' A' ' 125' ' ' LEU . 0.0 OUTLIER -178.64 166.02 1.71 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.219 -0.446 . . . . 74.51 110.921 179.952 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 54' ' ' SER . . . . . 0.853 ' CA ' HD11 ' A' ' 125' ' ' LEU . 0.4 OUTLIER -62.63 -176.53 0.11 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.223 -0.444 . . . . 53.44 110.859 -179.765 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 18.5 m -99.08 -24.08 4.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.147 -0.479 . . . . 61.45 111.096 -179.991 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -112.92 -171.03 1.79 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.196 -0.456 . . . . 54.51 110.925 179.902 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 6.0 mmmm -119.33 -18.92 8.46 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.234 -0.439 . . . . 73.12 110.874 179.989 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 58' ' ' GLU . . . . . 0.56 ' HA ' ' C ' ' A' ' 59' ' ' PRO . 11.2 pt-20 -115.97 143.27 30.53 Favored Pre-proline 0 C--N 1.329 -0.315 0 CA-C-O 121.599 0.714 . . . . 73.41 110.898 179.939 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 59' ' ' PRO . . . . . 0.56 ' C ' ' HA ' ' A' ' 58' ' ' GLU . 54.0 Cg_endo -69.67 -9.23 10.74 Favored 'Cis proline' 0 C--O 1.232 0.205 0 C-N-CA 122.746 -1.772 . . . . 73.12 112.355 -0.051 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 60' ' ' VAL . . . . . 0.502 HG22 ' CG ' ' A' ' 129' ' ' GLN . 11.9 m -152.13 -176.29 0.25 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.215 -0.448 . . . . 51.03 111.129 179.945 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 61' ' ' GLU . . . . . 0.457 ' O ' ' C ' ' A' ' 62' ' ' SER . 11.7 tt0 -113.24 -11.95 13.16 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.166 -0.47 . . . . 74.44 110.898 -179.977 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 62' ' ' SER . . . . . 0.836 ' HB3' HD13 ' A' ' 125' ' ' LEU . 0.1 OUTLIER 33.16 90.56 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.122 -0.49 . . . . 70.4 110.846 -179.794 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 32.3 t -109.53 124.73 51.58 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.11 -0.495 . . . . 63.25 110.876 -179.849 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 64' ' ' ILE . . . . . 0.513 HD11 HG21 ' A' ' 89' ' ' VAL . 14.5 mt -139.71 150.72 22.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.144 -0.48 . . . . 73.51 111.115 179.998 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 90.7 m -120.9 114.47 21.62 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.182 -0.463 . . . . 53.24 111.123 179.957 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 66' ' ' LEU . . . . . 0.992 HD11 HG21 ' A' ' 121' ' ' THR . 17.5 mt -93.81 116.49 28.96 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.224 -0.444 . . . . 72.35 110.923 179.914 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 7.2 t60 -103.98 115.44 30.45 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.223 -0.444 . . . . 73.54 110.817 179.883 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 68' ' ' PHE . . . . . 0.614 ' HA ' HD13 ' A' ' 81' ' ' ILE . 0.0 OUTLIER -103.86 139.75 38.62 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.183 -0.462 . . . . 74.44 110.889 -179.923 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 69' ' ' ALA . . . . . 0.597 ' HA ' HG22 ' A' ' 47' ' ' ILE . . . -120.44 114.93 22.53 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.125 -0.489 . . . . 62.44 111.108 179.906 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 70' ' ' MET . . . . . 0.473 ' CB ' ' HG2' ' A' ' 15' ' ' GLN . 1.0 OUTLIER -81.59 95.38 7.14 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.203 -0.453 . . . . 72.34 110.929 179.929 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -51.36 161.49 0.78 Allowed Pre-proline 0 C--N 1.329 -0.295 0 CA-C-O 121.602 0.715 . . . . 61.51 111.134 -179.89 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 72' ' ' PRO . . . . . 0.416 ' O ' HD13 ' A' ' 8' ' ' LEU . 53.0 Cg_endo -69.75 -15.09 36.97 Favored 'Trans proline' 0 C--N 1.341 0.158 0 C-N-CA 122.694 2.263 . . . . 63.35 112.316 179.991 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 73' ' ' MET . . . . . 0.57 ' HB3' HG23 ' A' ' 77' ' ' THR . 0.0 OUTLIER -101.38 -20.68 15.07 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.211 -0.45 . . . . 71.22 110.889 179.876 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 74' ' ' TYR . . . . . 0.668 ' CD1' ' C ' ' A' ' 74' ' ' TYR . 0.0 OUTLIER -50.72 152.42 3.5 Favored Pre-proline 0 C--N 1.328 -0.356 0 CA-C-O 121.654 0.74 . . . . 62.51 110.913 -179.899 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 75' ' ' PRO . . . . . 0.548 ' C ' ' HA ' ' A' ' 74' ' ' TYR . 54.1 Cg_endo -69.75 -11.37 11.87 Favored 'Cis proline' 0 C--O 1.231 0.169 0 C-N-CA 122.684 -1.798 . . . . 62.23 112.334 -0.033 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 76' ' ' TYR . . . . . 0.501 ' CB ' ' O ' ' A' ' 73' ' ' MET . 2.3 t80 -34.06 -56.77 0.48 Allowed 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.175 -0.466 . . . . 61.5 110.927 -179.895 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 77' ' ' THR . . . . . 0.57 HG23 ' HB3' ' A' ' 73' ' ' MET . 37.6 p -99.46 167.48 10.59 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.117 -0.492 . . . . 75.5 111.14 -179.969 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -89.03 129.93 46.36 Favored Pre-proline 0 C--N 1.329 -0.288 0 CA-C-O 121.576 0.703 . . . . 71.02 111.096 179.864 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 79' ' ' PRO . . . . . 0.765 ' HG3' HD11 ' A' ' 113' ' ' ILE . 53.4 Cg_endo -69.75 -176.59 1.53 Allowed 'Trans proline' 0 C--N 1.341 0.172 0 C-N-CA 122.695 2.263 . . . . 73.22 112.365 179.984 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 80' ' ' GLU . . . . . 0.585 ' O ' HD13 ' A' ' 81' ' ' ILE . 2.8 tt0 -114.55 141.16 48.1 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.223 -0.444 . . . . 51.41 110.912 -179.974 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 81' ' ' ILE . . . . . 0.614 HD13 ' HA ' ' A' ' 68' ' ' PHE . 17.4 mm -133.44 140.88 45.86 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.17 -0.468 . . . . 73.5 111.111 -179.979 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 82' ' ' GLU . . . . . 0.478 ' HG3' ' CD ' ' A' ' 84' ' ' LYS . 5.9 pt-20 -149.08 145.76 27.39 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.185 -0.461 . . . . 72.42 110.883 179.95 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 83' ' ' PHE . . . . . 0.917 ' CE1' HD21 ' A' ' 66' ' ' LEU . 26.5 m-85 -97.65 142.14 29.82 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.196 -0.457 . . . . 60.53 110.896 -179.946 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 84' ' ' LYS . . . . . 0.478 ' CD ' ' HG3' ' A' ' 82' ' ' GLU . 5.1 mmmt -126.92 173.65 9.44 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.167 -0.469 . . . . 75.51 110.872 179.975 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 85' ' ' ASN . . . . . 0.464 ' O ' ' C ' ' A' ' 86' ' ' VAL . 4.1 m120 63.29 -72.67 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.175 -0.466 . . . . 72.2 110.857 179.942 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 86' ' ' VAL . . . . . 0.568 ' O ' HG23 ' A' ' 86' ' ' VAL . 16.6 m 32.13 90.99 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.192 -0.458 . . . . 71.11 111.125 179.924 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -95.51 -74.14 0.56 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.167 -0.469 . . . . 50.22 110.91 -179.988 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 88' ' ' ASN . . . . . 0.479 ' ND2' ' HB ' ' A' ' 60' ' ' VAL . 62.4 m-80 -78.61 45.48 0.59 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.204 -0.453 . . . . 53.15 110.881 -179.974 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 89' ' ' VAL . . . . . 0.716 HG11 ' HG ' ' A' ' 94' ' ' LEU . 42.2 t -135.28 140.12 45.55 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.17 -0.468 . . . . 74.14 111.134 179.914 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 90' ' ' MET . . . . . 0.457 ' O ' ' CB ' ' A' ' 91' ' ' ASP . 22.0 mtm -92.1 -62.0 1.5 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.167 -0.469 . . . . 41.12 110.839 179.968 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 91' ' ' ASP . . . . . 0.457 ' CB ' ' O ' ' A' ' 90' ' ' MET . 0.4 OUTLIER 163.0 -22.15 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.226 -0.443 . . . . 75.14 110.857 179.968 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -62.9 -47.18 84.42 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.199 -0.455 . . . . 74.23 110.887 -179.789 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 93' ' ' GLN . . . . . 0.516 ' CG ' HG13 ' A' ' 89' ' ' VAL . 3.8 pm0 -71.26 -36.41 71.75 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.132 -0.485 . . . . 65.13 110.896 -179.945 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 94' ' ' LEU . . . . . 0.716 ' HG ' HG11 ' A' ' 89' ' ' VAL . 31.7 mt -58.0 -48.96 78.47 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.191 -0.458 . . . . 74.22 110.887 -179.97 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 2.4 mm-40 -65.79 -33.57 76.16 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.204 -0.453 . . . . 74.05 110.871 179.972 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 96' ' ' MET . . . . . . . . . . . . . 6.1 ttp -59.61 -36.65 76.74 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.222 -0.444 . . . . 73.25 110.898 179.954 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 97' ' ' LEU . . . . . 0.997 HD13 HG22 ' A' ' 121' ' ' THR . 61.2 mt -66.5 -43.63 84.82 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.201 -0.454 . . . . 73.11 110.899 -179.99 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 98' ' ' LYS . . . . . 0.431 ' HA ' ' CD2' ' A' ' 101' ' ' PHE . 8.5 mmtp -55.44 -37.1 67.26 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.239 -0.437 . . . . 72.41 110.897 179.823 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 8.9 m -62.4 -43.61 98.41 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.198 -0.455 . . . . 75.11 110.872 -179.873 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 100' ' ' GLU . . . . . 0.559 ' O ' HD12 ' A' ' 104' ' ' ILE . 5.7 mm-40 -71.01 -24.95 62.47 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.11 -0.496 . . . . 63.12 110.863 -179.96 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 101' ' ' PHE . . . . . 0.593 ' CD1' ' O ' ' A' ' 97' ' ' LEU . 9.0 m-30 -59.62 -40.84 88.92 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.167 -0.469 . . . . 74.44 110.912 -179.909 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -63.11 -40.26 97.1 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.122 -0.49 . . . . 63.33 110.882 179.992 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 14.7 ttpt -67.94 -36.5 80.22 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.25 -0.432 . . . . 55.11 110.901 179.847 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 104' ' ' ILE . . . . . 0.559 HD12 ' O ' ' A' ' 100' ' ' GLU . 3.8 mt -67.35 -47.6 80.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.208 -0.451 . . . . 74.34 111.115 179.895 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 105' ' ' HIS . . . . . . . . . . . . . 14.8 t60 -62.92 -42.19 99.71 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.161 -0.472 . . . . 73.35 110.881 179.868 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -57.96 -38.28 75.71 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.206 -0.452 . . . . 72.13 110.94 -179.966 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 8.9 t -88.15 -23.25 23.69 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.161 -0.472 . . . . 70.42 111.166 -179.992 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 108' ' ' SER . . . . . 0.638 ' HB3' HG22 ' A' ' 113' ' ' ILE . 13.4 m -114.59 41.01 2.43 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.174 -0.466 . . . . 55.24 110.898 -179.897 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 13.7 ttt180 -88.8 90.73 8.54 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.124 -0.489 . . . . 72.32 110.856 -179.914 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 140.09 -6.16 2.8 Favored Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.754 -0.736 . . . . 74.23 112.495 -179.966 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 111' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -136.11 -152.59 0.46 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.757 0.313 . . . . 74.13 110.919 -179.944 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 112' ' ' GLU . . . . . 0.405 ' HG2' ' CD ' ' A' ' 18' ' ' GLU . 11.9 mt-10 -79.8 132.3 36.1 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.197 -0.456 . . . . 65.13 110.921 -179.956 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 113' ' ' ILE . . . . . 0.765 HD11 ' HG3' ' A' ' 79' ' ' PRO . 9.8 pt -126.27 -12.33 4.54 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 116.157 -0.474 . . . . 53.11 111.127 179.99 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 114' ' ' ILE . . . . . 0.778 ' O ' HG23 ' A' ' 118' ' ' THR . 1.3 mp -63.05 -39.66 86.06 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.195 -0.457 . . . . 74.14 111.14 179.85 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 115' ' ' PHE . . . . . 0.9 ' CE1' HD13 ' A' ' 25' ' ' ILE . 40.9 t80 -70.96 -38.72 72.81 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.179 -0.464 . . . . 75.31 110.848 179.976 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 54.9 mm-40 -65.41 -44.04 88.65 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.128 -0.487 . . . . 63.14 110.849 -179.867 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 117' ' ' ILE . . . . . 0.467 HD11 ' CG ' ' A' ' 101' ' ' PHE . 0.4 OUTLIER -65.14 -40.15 87.89 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.172 -0.467 . . . . 65.14 111.142 179.965 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 118' ' ' THR . . . . . 0.778 HG23 ' O ' ' A' ' 114' ' ' ILE . 58.7 p -67.62 -42.9 81.62 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.176 -0.465 . . . . 74.54 111.157 179.974 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 119' ' ' SER . . . . . 0.417 ' HA ' ' CG ' ' A' ' 122' ' ' GLN . 0.7 OUTLIER -67.44 -31.41 71.57 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.238 -0.437 . . . . 72.33 110.864 -179.891 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 120' ' ' PHE . . . . . 0.447 ' O ' ' HG2' ' A' ' 123' ' ' GLU . 0.3 OUTLIER -77.65 -38.74 47.12 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.128 -0.487 . . . . 64.51 110.888 -179.941 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 121' ' ' THR . . . . . 0.997 HG22 HD13 ' A' ' 97' ' ' LEU . 9.7 p -71.64 -42.21 67.86 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.154 -0.476 . . . . 72.15 111.173 -179.948 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 122' ' ' GLN . . . . . 0.417 ' CG ' ' HA ' ' A' ' 119' ' ' SER . 1.1 pp0? -66.21 -41.08 90.62 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.229 -0.441 . . . . 72.54 110.93 179.953 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 123' ' ' GLU . . . . . 0.447 ' HG2' ' O ' ' A' ' 120' ' ' PHE . 11.9 pt-20 -68.37 -35.33 77.55 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.214 -0.448 . . . . 74.12 110.895 -179.915 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 124' ' ' LYS . . . . . 0.44 ' HA ' ' CE ' ' A' ' 124' ' ' LYS . 0.0 OUTLIER -72.16 -44.35 63.2 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.141 -0.481 . . . . 61.44 110.908 179.958 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 125' ' ' LEU . . . . . 0.853 HD11 ' CA ' ' A' ' 54' ' ' SER . 0.2 OUTLIER -65.18 -40.41 94.24 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.248 -0.433 . . . . 62.34 110.886 179.918 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -63.63 -45.43 90.28 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.223 -0.444 . . . . 65.25 110.893 179.835 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 127' ' ' GLU . . . . . 0.442 ' HG3' ' N ' ' A' ' 128' ' ' PHE . 0.0 OUTLIER -66.17 -29.3 69.56 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.158 -0.474 . . . . 72.22 110.896 -179.905 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 128' ' ' PHE . . . . . 0.49 ' CE1' ' HB3' ' A' ' 93' ' ' GLN . 1.8 t80 -61.41 -58.14 9.4 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.131 -0.486 . . . . 75.25 110.889 -179.901 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 129' ' ' GLN . . . . . 0.502 ' CG ' HG22 ' A' ' 60' ' ' VAL . 1.7 mt-30 -49.02 -21.66 0.73 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.139 -0.482 . . . . 65.13 110.915 -179.982 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 130' ' ' ASN . . . . . . . . . . . . . 1.3 t-20 -82.52 -41.66 19.38 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.183 -0.462 . . . . 74.3 110.869 -179.926 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 131' ' ' VAL . . . . . 0.497 HG23 ' O ' ' A' ' 131' ' ' VAL . 2.9 m -108.01 24.65 2.88 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.154 -0.476 . . . . 75.53 111.1 179.944 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 132' ' ' VAL . . . . . 0.513 HG22 ' H ' ' A' ' 134' ' ' THR . 7.3 p -57.5 120.15 3.46 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.186 -0.461 . . . . 71.22 111.104 179.896 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 133' ' ' ASN . . . . . . . . . . . . . 30.2 m-80 -108.89 36.95 2.68 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.212 -0.449 . . . . 71.43 110.883 179.95 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 134' ' ' THR . . . . . 0.513 ' H ' HG22 ' A' ' 132' ' ' VAL . 70.1 p -145.87 121.61 10.54 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.191 -0.459 . . . . 73.02 111.13 -179.973 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 135' ' ' GLN . . . . . 0.412 ' C ' ' O ' ' A' ' 134' ' ' THR . 0.0 OUTLIER -37.08 -38.03 0.18 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.225 -0.443 . . . . 71.01 110.898 -179.991 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 53.5 p 42.67 48.54 4.79 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.225 -0.443 . . . . 73.01 110.835 -179.804 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 137' ' ' LEU . . . . . 0.409 ' O ' ' C ' ' A' ' 138' ' ' GLU . 0.0 OUTLIER -105.01 110.31 22.66 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.134 -0.485 . . . . 51.2 110.915 179.975 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 138' ' ' GLU . . . . . 0.409 ' C ' ' O ' ' A' ' 137' ' ' LEU . 25.4 tt0 . . . . . 0 C--N 1.33 -0.278 0 CA-C-N 116.199 -0.455 . . . . 72.23 110.903 179.961 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.7 mmm . . . . . 0 C--O 1.231 0.115 0 CA-C-O 120.8 0.333 . . . . 61.23 110.879 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 6.0 m -135.02 141.22 46.12 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.229 -0.441 . . . . 71.34 110.869 -179.78 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -110.99 -176.25 2.91 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.128 -0.487 . . . . 74.41 110.899 -179.985 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 61.1 m -46.59 -64.82 0.67 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.189 -0.46 . . . . 74.11 110.872 -179.972 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 32.6 m80 -134.79 -63.2 0.71 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.141 -0.481 . . . . 74.13 110.854 179.966 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 1.1 mp -77.38 121.25 23.52 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.216 -0.447 . . . . 62.24 110.934 -179.956 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 11.7 t -146.36 158.93 43.94 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.202 -0.454 . . . . 53.21 111.122 179.98 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.411 HD13 ' O ' ' A' ' 72' ' ' PRO . 20.2 mt -60.22 -30.49 69.43 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.157 -0.474 . . . . 71.21 110.888 179.974 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -51.25 -25.58 5.88 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.215 -0.448 . . . . 74.3 110.881 179.847 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 10' ' ' GLN . . . . . 0.417 ' O ' ' HG2' ' A' ' 13' ' ' GLU . 10.3 mm-40 -67.77 -38.99 84.16 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.221 -0.445 . . . . 75.41 110.913 -179.941 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 23.9 m-85 -64.51 -22.2 66.9 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.205 -0.452 . . . . 74.04 110.889 -179.834 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -57.43 -36.25 71.13 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.143 -0.48 . . . . 72.53 110.871 -179.842 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 13' ' ' GLU . . . . . 0.481 ' HG3' ' N ' ' A' ' 14' ' ' ILE . 5.6 pt-20 -59.82 -39.91 86.67 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.112 -0.494 . . . . 63.42 110.888 -179.981 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 14' ' ' ILE . . . . . 0.481 ' N ' ' HG3' ' A' ' 13' ' ' GLU . 3.7 mp -67.62 -47.47 80.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.178 -0.465 . . . . 73.45 111.109 179.967 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 46.4 mt-30 -64.56 -44.53 90.44 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.211 -0.45 . . . . 73.53 110.888 179.988 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 6.3 t -63.61 -41.47 98.3 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.218 -0.446 . . . . 73.31 110.865 -179.93 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 1.2 m-20 -57.98 -34.7 70.24 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.214 -0.448 . . . . 62.15 110.918 -179.936 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -67.23 -38.6 85.51 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.188 -0.46 . . . . 60.5 110.898 179.973 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.903 HD11 ' CG1' ' A' ' 46' ' ' ILE . 6.1 mt -60.91 -51.52 68.93 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.148 -0.478 . . . . 54.43 110.936 -179.994 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 4.7 pt-20 -68.62 -37.9 80.11 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.198 -0.455 . . . . 73.21 110.905 179.917 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -63.83 -50.64 68.09 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.126 -0.488 . . . . 54.04 111.089 179.924 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 22' ' ' ILE . . . . . 0.423 ' HA ' HD12 ' A' ' 25' ' ' ILE . 0.8 OUTLIER -71.4 -36.58 61.61 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 116.226 -0.443 . . . . 74.11 111.137 179.983 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -52.48 -34.45 49.32 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.177 -0.465 . . . . 71.12 110.889 179.963 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -67.23 -36.25 81.27 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.174 -0.466 . . . . 71.15 110.85 -179.77 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 25' ' ' ILE . . . . . 0.644 HD13 ' CE1' ' A' ' 115' ' ' PHE . 3.3 mt -79.33 -45.23 23.88 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.153 -0.476 . . . . 64.22 111.138 179.915 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 29.0 m-85 -109.04 46.35 0.98 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.155 -0.475 . . . . 74.22 110.936 -179.977 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 1.2 mtm -42.67 -57.4 2.74 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.081 -0.509 . . . . 72.13 110.9 179.903 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 6.2 p-10 -106.08 32.98 4.04 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.229 -0.441 . . . . 62.54 110.874 179.937 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -135.01 13.15 3.61 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.187 -0.46 . . . . 70.14 110.891 179.976 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 30' ' ' PHE . . . . . 0.611 ' CD1' ' C ' ' A' ' 30' ' ' PHE . 0.2 OUTLIER -111.89 139.92 46.98 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.195 -0.457 . . . . 71.23 110.854 -179.899 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 20.2 m -110.85 128.11 55.66 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.097 -0.501 . . . . 72.41 111.143 -179.928 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -87.61 113.71 23.55 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.218 -0.446 . . . . 63.12 110.891 179.918 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 1.065 HD23 ' N ' ' A' ' 34' ' ' THR . 0.1 OUTLIER -121.73 -16.68 7.63 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.193 -0.458 . . . . 71.04 110.899 -179.946 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 34' ' ' THR . . . . . 1.065 ' N ' HD23 ' A' ' 33' ' ' LEU . 15.8 m -43.6 146.29 0.54 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.204 -0.453 . . . . 73.23 111.146 179.933 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 35' ' ' LYS . . . . . 0.476 ' CD ' ' HA ' ' A' ' 44' ' ' PRO . 0.3 OUTLIER -43.48 90.94 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.222 -0.445 . . . . 73.03 110.902 179.923 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 36' ' ' ARG . . . . . 0.492 ' N ' ' O ' ' A' ' 34' ' ' THR . 8.1 mmm180 -92.95 40.06 1.05 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.227 -0.442 . . . . 71.24 110.911 179.963 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 37' ' ' LYS . . . . . 0.591 ' HB3' ' CZ3' ' A' ' 40' ' ' TRP . 2.3 mmmt -41.81 151.99 0.08 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.147 -0.479 . . . . 72.25 110.871 179.989 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 5.9 t -57.98 -92.65 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.198 -0.455 . . . . 64.04 110.835 -179.894 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 1.6 m -154.75 87.12 1.14 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.153 -0.476 . . . . 31.1 110.854 -179.817 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 40' ' ' TRP . . . . . 0.591 ' CZ3' ' HB3' ' A' ' 37' ' ' LYS . 0.1 OUTLIER 177.58 -29.47 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.131 -0.486 . . . . 62.24 110.916 179.979 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 1.3 t70 -138.9 135.11 34.1 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.19 -0.459 . . . . 71.51 110.867 179.939 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 1.4 mttt -140.66 81.55 1.81 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.203 -0.453 . . . . 64.2 110.873 180.0 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 43' ' ' GLN . . . . . 0.496 ' N ' ' CD ' ' A' ' 44' ' ' PRO . 3.6 tt0 -121.43 50.89 2.37 Favored Pre-proline 0 C--N 1.329 -0.283 0 CA-C-O 121.556 0.693 . . . . 74.5 110.892 179.956 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 44' ' ' PRO . . . . . 0.496 ' CD ' ' N ' ' A' ' 43' ' ' GLN . 54.1 Cg_endo -69.69 -179.61 3.0 Favored 'Trans proline' 0 C--N 1.341 0.145 0 C-N-CA 122.721 2.28 . . . . 72.11 112.349 179.97 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 45' ' ' GLN . . . . . 0.469 ' CG ' ' O ' ' A' ' 45' ' ' GLN . 15.2 tt0 -139.87 8.52 2.33 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.247 -0.433 . . . . 62.31 110.912 179.995 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 46' ' ' ILE . . . . . 0.903 ' CG1' HD11 ' A' ' 19' ' ' LEU . 0.0 OUTLIER 81.86 -34.74 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.229 -0.441 . . . . 73.44 111.112 -179.995 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 47' ' ' ILE . . . . . 0.92 HG12 HD21 ' A' ' 33' ' ' LEU . 0.1 OUTLIER -32.97 141.02 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.209 -0.45 . . . . 72.51 111.12 179.878 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 48' ' ' PHE . . . . . 0.872 ' HA ' HD22 ' A' ' 33' ' ' LEU . 1.4 p90 -153.06 164.59 37.73 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.172 -0.467 . . . . 74.25 110.927 179.961 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 49' ' ' GLU . . . . . 0.801 ' CG ' HD13 ' A' ' 33' ' ' LEU . 12.5 mt-10 -108.86 152.31 25.08 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.183 -0.462 . . . . 71.52 110.893 -179.953 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 50' ' ' ILE . . . . . 0.479 HD13 ' HA ' ' A' ' 30' ' ' PHE . 3.8 mm -133.89 141.54 43.73 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.142 -0.481 . . . . 73.01 111.144 179.951 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 85.8 m -86.28 126.7 34.49 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.168 -0.469 . . . . 41.01 111.144 179.957 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 52' ' ' LEU . . . . . 0.729 HD12 HD12 ' A' ' 66' ' ' LEU . 16.2 mt -132.59 159.55 39.19 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.194 -0.457 . . . . 72.41 110.908 179.953 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -178.31 174.56 1.28 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.178 -0.465 . . . . 75.03 110.918 179.979 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 54' ' ' SER . . . . . 0.462 ' HA ' ' CD1' ' A' ' 125' ' ' LEU . 7.3 p -63.16 -177.61 0.19 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.241 -0.436 . . . . 61.14 110.844 -179.792 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 30.2 m -91.18 -22.36 6.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.095 -0.502 . . . . 74.12 111.12 179.943 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -122.74 -170.13 2.04 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.208 -0.451 . . . . 52.55 110.862 179.95 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 1.7 mmmp? -118.11 -16.56 9.76 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.185 -0.462 . . . . 64.31 110.888 -179.97 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 58' ' ' GLU . . . . . 0.562 ' HA ' ' C ' ' A' ' 59' ' ' PRO . 56.8 mt-10 -120.22 146.69 43.14 Favored Pre-proline 0 C--N 1.329 -0.298 0 CA-C-O 121.675 0.75 . . . . 74.31 110.894 179.97 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 59' ' ' PRO . . . . . 0.562 ' C ' ' HA ' ' A' ' 58' ' ' GLU . 54.0 Cg_endo -69.75 -9.56 11.05 Favored 'Cis proline' 0 C--N 1.342 0.188 0 C-N-CA 122.695 -1.794 . . . . 52.3 112.334 0.034 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 60' ' ' VAL . . . . . 0.449 HG22 ' CG ' ' A' ' 129' ' ' GLN . 22.1 m -141.98 176.16 4.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.247 -0.433 . . . . 75.11 111.122 179.96 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 61' ' ' GLU . . . . . 0.447 ' O ' ' C ' ' A' ' 62' ' ' SER . 13.4 tt0 -106.97 -16.73 14.37 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.199 -0.455 . . . . 74.43 110.879 -180.0 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 62' ' ' SER . . . . . 0.887 ' HB3' HD21 ' A' ' 125' ' ' LEU . 26.7 m 34.12 87.19 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.161 -0.472 . . . . 50.51 110.87 -179.776 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 7.9 t -112.29 127.56 56.02 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.136 -0.483 . . . . 73.42 110.842 -179.777 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 64' ' ' ILE . . . . . . . . . . . . . 22.5 mt -140.61 140.34 33.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.144 -0.48 . . . . 53.11 111.127 179.948 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 29.8 m -103.28 117.3 34.19 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.15 -0.477 . . . . 54.44 111.159 179.968 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 66' ' ' LEU . . . . . 0.828 HD11 HG21 ' A' ' 121' ' ' THR . 8.9 mt -98.05 115.17 27.68 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.216 -0.447 . . . . 60.04 110.95 179.942 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 67' ' ' HIS . . . . . 0.571 ' CE1' HD11 ' A' ' 33' ' ' LEU . 10.5 t60 -111.67 110.08 20.29 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.193 -0.458 . . . . 75.11 110.885 179.893 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 68' ' ' PHE . . . . . 0.549 ' HB3' HD11 ' A' ' 81' ' ' ILE . 0.0 OUTLIER -102.81 140.21 37.38 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.239 -0.437 . . . . 73.03 110.897 -179.893 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 69' ' ' ALA . . . . . 0.537 ' HA ' HG22 ' A' ' 47' ' ' ILE . . . -120.73 116.41 25.21 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.144 -0.48 . . . . 32.3 111.073 179.961 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 70' ' ' MET . . . . . 0.575 ' CE ' HD11 ' A' ' 114' ' ' ILE . 1.1 mtt -87.06 108.96 19.1 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.241 -0.436 . . . . 55.53 110.908 179.934 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -61.68 160.38 27.26 Favored Pre-proline 0 C--N 1.33 -0.277 0 CA-C-O 121.516 0.674 . . . . 74.13 111.174 -179.924 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 72' ' ' PRO . . . . . 0.411 ' O ' HD13 ' A' ' 8' ' ' LEU . 53.7 Cg_endo -69.83 -4.17 13.53 Favored 'Trans proline' 0 C--N 1.341 0.173 0 C-N-CA 122.636 2.224 . . . . 63.53 112.373 179.937 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 73' ' ' MET . . . . . 0.505 ' O ' ' CB ' ' A' ' 76' ' ' TYR . 0.0 OUTLIER -111.92 -24.58 9.88 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.183 -0.462 . . . . 74.42 110.868 179.909 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 74' ' ' TYR . . . . . 0.655 ' CD1' ' C ' ' A' ' 74' ' ' TYR . 0.0 OUTLIER -48.94 152.7 1.73 Allowed Pre-proline 0 C--N 1.329 -0.309 0 CA-C-O 121.666 0.746 . . . . 72.24 110.941 -179.861 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 75' ' ' PRO . . . . . 0.549 ' HA ' ' CD2' ' A' ' 74' ' ' TYR . 53.4 Cg_endo -69.75 -8.55 10.53 Favored 'Cis proline' 0 C--O 1.232 0.196 0 C-N-CA 122.714 -1.786 . . . . 65.54 112.319 -0.056 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 76' ' ' TYR . . . . . 0.505 ' CB ' ' O ' ' A' ' 73' ' ' MET . 31.1 t80 -33.0 -46.79 0.16 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.255 -0.43 . . . . 74.33 110.912 -179.902 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 13.8 p -106.83 -171.44 1.89 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.135 -0.484 . . . . 65.41 111.125 -179.961 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -104.8 130.41 23.22 Favored Pre-proline 0 C--N 1.329 -0.3 0 CA-C-O 121.577 0.703 . . . . 72.21 111.123 179.843 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 79' ' ' PRO . . . . . 0.531 ' HG3' HD11 ' A' ' 113' ' ' ILE . 53.3 Cg_endo -69.8 167.54 24.19 Favored 'Trans proline' 0 C--O 1.231 0.153 0 C-N-CA 122.648 2.232 . . . . 75.32 112.336 -179.975 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 1.7 tt0 -118.85 134.82 54.9 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.213 -0.449 . . . . 74.13 110.876 -179.962 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 81' ' ' ILE . . . . . 0.569 HG21 HD22 ' A' ' 66' ' ' LEU . 12.1 mt -142.8 150.83 17.8 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.152 -0.476 . . . . 63.4 111.129 179.973 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 82' ' ' GLU . . . . . 0.504 ' HG3' ' CD ' ' A' ' 84' ' ' LYS . 9.2 pt-20 -149.43 147.64 28.5 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.167 -0.47 . . . . 63.1 110.906 179.923 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 83' ' ' PHE . . . . . 0.512 ' CZ ' ' HD3' ' A' ' 98' ' ' LYS . 6.3 m-85 -89.03 140.58 29.29 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.161 -0.472 . . . . 72.33 110.861 -179.891 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 84' ' ' LYS . . . . . 0.51 ' O ' ' N ' ' A' ' 86' ' ' VAL . 8.7 mmmt -124.26 174.69 7.54 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.133 -0.485 . . . . 54.13 110.913 179.971 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 85' ' ' ASN . . . . . 0.413 ' C ' HG22 ' A' ' 86' ' ' VAL . 5.0 m120 59.66 -76.06 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.265 -0.425 . . . . 63.31 110.852 179.937 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 86' ' ' VAL . . . . . 0.9 HG11 HD21 ' A' ' 94' ' ' LEU . 3.6 m 41.28 87.52 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.162 -0.472 . . . . 54.45 111.146 179.914 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -94.61 -78.39 0.44 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.187 -0.46 . . . . 61.31 110.934 -179.989 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 88' ' ' ASN . . . . . 0.433 ' CG ' ' HB ' ' A' ' 60' ' ' VAL . 33.6 m120 -83.96 55.02 3.11 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.173 -0.467 . . . . 71.22 110.871 -179.954 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 89' ' ' VAL . . . . . 0.579 HG21 HD13 ' A' ' 94' ' ' LEU . 1.3 p -152.75 145.79 15.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.192 -0.458 . . . . 73.44 111.145 179.921 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 90' ' ' MET . . . . . 0.633 ' O ' HD22 ' A' ' 94' ' ' LEU . 0.5 OUTLIER -95.18 -155.65 0.48 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.176 -0.465 . . . . 65.33 110.88 179.904 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 91' ' ' ASP . . . . . 0.477 ' O ' ' CG ' ' A' ' 95' ' ' GLN . 0.1 OUTLIER -98.61 -17.76 18.46 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.227 -0.442 . . . . 75.21 110.883 179.955 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 78.8 p -66.64 -47.11 73.61 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.192 -0.458 . . . . 60.42 110.911 -179.783 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 93' ' ' GLN . . . . . 0.549 ' CG ' ' CD2' ' A' ' 128' ' ' PHE . 5.9 mt-30 -68.69 -42.97 77.07 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.114 -0.494 . . . . 74.12 110.918 -179.987 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 94' ' ' LEU . . . . . 0.9 HD21 HG11 ' A' ' 86' ' ' VAL . 0.1 OUTLIER -59.04 -49.11 79.14 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.156 -0.475 . . . . 64.53 110.91 -179.998 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 95' ' ' GLN . . . . . 0.477 ' CG ' ' O ' ' A' ' 91' ' ' ASP . 7.3 mm-40 -66.06 -35.25 80.03 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.149 -0.478 . . . . 74.14 110.941 179.911 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 96' ' ' MET . . . . . 0.512 ' SD ' ' CE1' ' A' ' 128' ' ' PHE . 29.5 ttp -60.3 -44.85 95.04 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.187 -0.461 . . . . 63.14 110.873 179.961 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 97' ' ' LEU . . . . . 0.635 HD22 HG22 ' A' ' 121' ' ' THR . 33.7 mt -58.13 -39.8 79.67 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.227 -0.442 . . . . 64.41 110.906 -179.968 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 98' ' ' LYS . . . . . 0.512 ' HD3' ' CZ ' ' A' ' 83' ' ' PHE . 5.6 mmtp -57.39 -43.78 83.94 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.186 -0.461 . . . . 73.3 110.881 179.82 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -61.3 -39.0 88.83 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.229 -0.442 . . . . 51.34 110.853 -179.879 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 100' ' ' GLU . . . . . 0.507 ' HG2' ' CE1' ' A' ' 120' ' ' PHE . 0.3 OUTLIER -69.86 -28.6 65.79 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.168 -0.469 . . . . 65.13 110.916 -179.97 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 101' ' ' PHE . . . . . 0.657 ' CG ' HD11 ' A' ' 117' ' ' ILE . 9.2 m-30 -59.42 -39.17 82.62 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.143 -0.481 . . . . 72.45 110.843 -179.906 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.81 -39.5 94.38 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.143 -0.48 . . . . 64.04 110.904 -179.999 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 37.7 mtmt -68.77 -40.98 79.45 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.209 -0.451 . . . . 61.34 110.891 179.865 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 4.3 mt -65.09 -47.57 87.26 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 116.278 -0.419 . . . . 72.41 111.166 179.842 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 105' ' ' HIS . . . . . 0.495 ' O ' ' N ' ' A' ' 109' ' ' ARG . 4.6 t60 -62.76 -41.35 99.18 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.191 -0.459 . . . . 63.54 110.853 179.873 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -59.17 -42.35 90.56 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.224 -0.444 . . . . 74.25 110.89 -179.944 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 10.7 t -82.67 -28.12 30.85 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.191 -0.459 . . . . 74.02 111.126 -179.955 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 108' ' ' SER . . . . . 0.762 ' HB3' HG22 ' A' ' 113' ' ' ILE . 23.5 m -101.74 13.38 35.05 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.195 -0.457 . . . . 63.21 110.904 -179.874 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 109' ' ' ARG . . . . . 0.495 ' N ' ' O ' ' A' ' 105' ' ' HIS . 2.6 ttt-85 -61.57 77.88 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.114 -0.494 . . . . 72.23 110.882 -179.949 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 110' ' ' GLY . . . . . 0.448 ' N ' ' O ' ' A' ' 108' ' ' SER . . . 137.12 31.76 0.25 Allowed Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.739 -0.744 . . . . 61.43 112.52 -179.98 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 111' ' ' GLN . . . . . . . . . . . . . 7.2 pt20 -173.2 -165.69 0.3 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.743 0.306 . . . . 52.34 110.958 -179.841 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 38.8 mt-10 -65.74 127.64 32.77 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.216 -0.447 . . . . 73.5 110.88 179.994 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 113' ' ' ILE . . . . . 0.762 HG22 ' HB3' ' A' ' 108' ' ' SER . 19.3 pt -126.5 -10.9 4.66 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.133 -0.485 . . . . 74.24 111.112 179.974 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 114' ' ' ILE . . . . . 0.744 ' O ' HG23 ' A' ' 118' ' ' THR . 13.6 mm -67.06 -44.9 87.92 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.221 -0.445 . . . . 75.2 111.079 179.887 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 115' ' ' PHE . . . . . 0.644 ' CE1' HD13 ' A' ' 25' ' ' ILE . 19.7 t80 -68.98 -34.5 75.41 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.19 -0.459 . . . . 60.53 110.894 179.962 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 4.9 mm-40 -67.47 -47.53 69.79 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.154 -0.475 . . . . 63.01 110.89 -179.909 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 117' ' ' ILE . . . . . 0.657 HD11 ' CG ' ' A' ' 101' ' ' PHE . 0.5 OUTLIER -64.31 -40.53 89.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.108 -0.496 . . . . 61.32 111.165 179.949 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 118' ' ' THR . . . . . 0.744 HG23 ' O ' ' A' ' 114' ' ' ILE . 58.3 p -67.03 -43.38 82.94 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.166 -0.47 . . . . 75.21 111.13 179.93 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -68.07 -39.24 83.01 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.24 -0.437 . . . . 72.44 110.876 -179.861 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 120' ' ' PHE . . . . . 0.507 ' CE1' ' HG2' ' A' ' 100' ' ' GLU . 0.4 OUTLIER -69.69 -45.21 68.81 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.12 -0.491 . . . . 73.0 110.92 -179.995 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 121' ' ' THR . . . . . 0.828 HG21 HD11 ' A' ' 66' ' ' LEU . 19.0 p -66.63 -42.17 87.18 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.142 -0.481 . . . . 55.32 111.144 -179.935 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -65.06 -51.28 62.36 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.266 -0.425 . . . . 74.24 110.943 179.98 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 123' ' ' GLU . . . . . 0.474 ' CG ' ' N ' ' A' ' 124' ' ' LYS . 7.3 pt-20 -62.13 -46.2 90.08 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.188 -0.46 . . . . 74.54 110.869 -179.953 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 124' ' ' LYS . . . . . 0.474 ' N ' ' CG ' ' A' ' 123' ' ' GLU . 1.1 mmpt? -63.91 -40.07 95.64 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.189 -0.46 . . . . 70.35 110.874 179.986 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 125' ' ' LEU . . . . . 0.887 HD21 ' HB3' ' A' ' 62' ' ' SER . 0.1 OUTLIER -70.09 -38.97 75.83 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.231 -0.44 . . . . 73.51 110.9 179.92 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 126' ' ' ASP . . . . . 0.722 ' N ' HD13 ' A' ' 125' ' ' LEU . 1.6 t0 -66.72 -46.49 75.35 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.158 -0.474 . . . . 74.12 110.856 179.872 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -67.88 -28.63 67.69 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.215 -0.448 . . . . 73.11 110.914 -179.93 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 128' ' ' PHE . . . . . 0.549 ' CD2' ' CG ' ' A' ' 93' ' ' GLN . 0.5 OUTLIER -72.17 -55.65 6.9 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.17 -0.468 . . . . 61.12 110.906 -179.934 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 129' ' ' GLN . . . . . 0.453 ' C ' ' OE1' ' A' ' 129' ' ' GLN . 1.1 tm0? -42.65 -50.02 5.49 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.132 -0.485 . . . . 74.45 110.894 -179.952 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 130' ' ' ASN . . . . . 0.421 ' C ' HG12 ' A' ' 131' ' ' VAL . 1.5 t-20 -59.4 -74.57 0.07 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.221 -0.445 . . . . 63.32 110.832 -179.925 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 131' ' ' VAL . . . . . 0.879 HG22 HG23 ' A' ' 132' ' ' VAL . 1.4 p 169.23 -51.94 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.159 -0.473 . . . . 74.01 111.13 179.941 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 132' ' ' VAL . . . . . 0.879 HG23 HG22 ' A' ' 131' ' ' VAL . 61.6 t -143.5 136.58 24.72 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 116.143 -0.481 . . . . 72.31 111.125 179.948 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 133' ' ' ASN . . . . . . . . . . . . . 73.5 m-20 47.76 -174.06 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.164 -0.471 . . . . 51.32 110.896 179.977 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 134' ' ' THR . . . . . . . . . . . . . 8.6 t -119.3 153.97 34.24 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.214 -0.448 . . . . 64.55 111.119 -179.976 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -120.29 131.99 55.13 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.165 -0.47 . . . . 71.41 110.928 179.982 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 13.5 t 53.54 75.65 0.25 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.203 -0.453 . . . . 71.33 110.845 -179.799 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 137' ' ' LEU . . . . . . . . . . . . . 15.5 tp -42.91 -48.9 5.93 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.156 -0.475 . . . . 72.02 110.897 179.981 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--N 1.33 -0.273 0 CA-C-N 116.206 -0.452 . . . . 72.04 110.888 179.952 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.23 0.077 0 CA-C-O 120.786 0.327 . . . . 63.12 110.89 . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 35.3 t -169.18 130.93 1.18 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.169 -0.469 . . . . 64.44 110.816 -179.76 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER 169.65 125.79 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.172 -0.467 . . . . 75.31 110.886 179.977 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 15.6 m 59.35 166.33 0.06 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.229 -0.441 . . . . 63.21 110.878 -179.929 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 1.2 m80 -108.57 -60.49 1.73 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.124 -0.489 . . . . 72.01 110.835 179.989 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -83.98 93.66 8.11 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.199 -0.455 . . . . 64.41 110.94 -179.977 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -162.58 169.16 20.67 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.239 -0.437 . . . . 55.22 111.12 179.971 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 44.1 mt -54.81 -24.48 23.0 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.166 -0.47 . . . . 75.04 110.904 179.987 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 17.2 t0 -54.19 -31.67 53.55 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.198 -0.455 . . . . 72.21 110.866 179.828 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 10' ' ' GLN . . . . . 0.41 ' O ' ' HG2' ' A' ' 13' ' ' GLU . 97.0 mm-40 -66.72 -40.53 88.44 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.218 -0.447 . . . . 60.13 110.918 -179.901 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 20.1 m-85 -56.09 -22.94 30.9 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.194 -0.457 . . . . 73.3 110.925 -179.859 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 12' ' ' TYR . . . . . 0.585 ' CZ ' HD11 ' A' ' 46' ' ' ILE . 0.3 OUTLIER -57.69 -36.34 71.82 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.145 -0.48 . . . . 75.01 110.869 -179.885 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 13' ' ' GLU . . . . . 0.483 ' HG3' ' N ' ' A' ' 14' ' ' ILE . 5.0 pt-20 -61.63 -41.11 97.04 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.173 -0.467 . . . . 64.03 110.874 -179.997 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 14' ' ' ILE . . . . . 0.483 ' N ' ' HG3' ' A' ' 13' ' ' GLU . 3.8 mp -68.28 -44.33 83.94 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-N 116.153 -0.476 . . . . 60.13 111.125 -179.99 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 15' ' ' GLN . . . . . 0.819 ' HB3' HG21 ' A' ' 46' ' ' ILE . 10.2 mt-30 -65.99 -47.22 75.27 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.15 -0.477 . . . . 73.23 110.91 179.944 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 2.5 t -61.4 -40.69 95.29 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.177 -0.465 . . . . 72.2 110.871 -179.946 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -58.21 -33.72 69.6 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.208 -0.451 . . . . 75.54 110.887 -179.866 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 18' ' ' GLU . . . . . 0.401 ' OE1' ' SD ' ' A' ' 70' ' ' MET . 32.6 mt-10 -65.81 -39.08 90.54 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.197 -0.456 . . . . 74.5 110.876 -179.997 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.433 HD12 ' CE1' ' A' ' 48' ' ' PHE . 6.8 mp -63.18 -51.8 64.93 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.144 -0.48 . . . . 73.12 110.903 -179.943 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 1.7 pt-20 -68.8 -37.22 79.12 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.203 -0.453 . . . . 73.12 110.895 179.941 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -64.27 -50.51 67.63 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.148 -0.478 . . . . 65.51 111.066 179.97 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 22' ' ' ILE . . . . . 0.833 ' HA ' HD12 ' A' ' 25' ' ' ILE . 0.9 OUTLIER -71.85 -35.31 54.35 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.272 -0.422 . . . . 73.34 111.117 179.971 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 23' ' ' ARG . . . . . 0.458 ' HG3' ' CD2' ' A' ' 30' ' ' PHE . 7.6 mtp180 -54.36 -37.99 65.59 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.174 -0.466 . . . . 64.44 110.887 179.936 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -65.38 -31.41 72.5 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.18 -0.464 . . . . 42.53 110.859 -179.786 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 25' ' ' ILE . . . . . 0.833 HD12 ' HA ' ' A' ' 22' ' ' ILE . 5.1 mt -80.35 -45.43 22.1 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.135 -0.484 . . . . 73.12 111.099 179.972 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 26' ' ' TYR . . . . . 0.422 ' O ' ' N ' ' A' ' 30' ' ' PHE . 25.1 m-85 -107.97 41.28 1.57 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.175 -0.466 . . . . 70.11 110.909 -179.94 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 27' ' ' MET . . . . . 0.406 ' C ' ' O ' ' A' ' 26' ' ' TYR . 1.9 mtm -38.08 -52.94 1.42 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.137 -0.483 . . . . 74.42 110.869 179.907 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -88.83 -33.2 17.47 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.206 -0.452 . . . . 71.11 110.848 179.979 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -84.5 21.67 1.43 Allowed 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.237 -0.438 . . . . 62.5 110.875 179.997 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 30' ' ' PHE . . . . . 0.532 ' HA ' HD13 ' A' ' 50' ' ' ILE . 0.4 OUTLIER -111.0 128.67 55.92 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.189 -0.46 . . . . 53.12 110.89 -179.889 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 83.2 m -114.2 133.88 55.3 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.157 -0.474 . . . . 65.01 111.143 -179.923 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 41.8 t0 -98.11 120.5 38.62 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.213 -0.449 . . . . 71.51 110.891 179.918 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.941 HD21 HG12 ' A' ' 47' ' ' ILE . 0.2 OUTLIER -121.58 0.73 9.97 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.204 -0.453 . . . . 63.31 110.89 -179.904 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 34' ' ' THR . . . . . 0.787 ' N ' HD23 ' A' ' 33' ' ' LEU . 0.2 OUTLIER -53.39 -167.53 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.186 -0.461 . . . . 75.02 111.184 179.999 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 35' ' ' LYS . . . . . 0.756 ' H ' HG22 ' A' ' 34' ' ' THR . 0.2 OUTLIER -87.35 18.89 3.5 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.252 -0.431 . . . . 74.31 110.839 179.95 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.99 -94.44 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.242 -0.436 . . . . 74.31 110.867 179.992 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 5.5 mmpt? -87.27 57.53 4.51 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.206 -0.452 . . . . 73.31 110.916 179.95 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 52.9 p -142.41 78.83 1.64 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.252 -0.431 . . . . 71.41 110.887 -179.915 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 5.9 m -63.7 99.3 0.22 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.175 -0.466 . . . . 64.43 110.851 -179.789 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 40' ' ' TRP . . . . . . . . . . . . . 33.2 t-105 -171.59 -47.18 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.169 -0.469 . . . . 73.3 110.913 -179.963 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 34.1 t70 -143.74 152.19 40.96 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.265 -0.425 . . . . 55.43 110.904 179.949 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -123.65 65.22 1.02 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.228 -0.442 . . . . 75.43 110.911 179.987 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 23.6 mt-30 -159.12 75.01 3.34 Favored Pre-proline 0 C--N 1.329 -0.325 0 CA-C-O 121.574 0.702 . . . . 74.05 110.928 179.971 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 44' ' ' PRO . . . . . 0.459 ' CG ' ' HG2' ' A' ' 35' ' ' LYS . 53.4 Cg_endo -69.72 -177.84 2.05 Favored 'Trans proline' 0 C--N 1.341 0.161 0 C-N-CA 122.694 2.263 . . . . 62.4 112.35 179.992 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 45' ' ' GLN . . . . . 0.99 ' HG2' HD12 ' A' ' 47' ' ' ILE . 7.4 pt20 -157.13 18.19 0.29 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.225 -0.443 . . . . 75.01 110.913 -179.996 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 46' ' ' ILE . . . . . 0.819 HG21 ' HB3' ' A' ' 15' ' ' GLN . 15.4 mm 69.9 75.48 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.177 -0.465 . . . . 63.32 111.153 179.961 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 47' ' ' ILE . . . . . 0.99 HD12 ' HG2' ' A' ' 45' ' ' GLN . 0.2 OUTLIER -142.52 148.33 20.13 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.171 -0.468 . . . . 73.05 111.135 179.875 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 48' ' ' PHE . . . . . 0.841 ' HA ' HD22 ' A' ' 33' ' ' LEU . 22.3 p90 -162.14 155.4 20.58 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.146 -0.479 . . . . 63.35 110.903 179.919 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 49' ' ' GLU . . . . . 0.601 ' HG3' HD13 ' A' ' 33' ' ' LEU . 13.4 mt-10 -108.44 151.88 25.44 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.199 -0.455 . . . . 74.32 110.87 -179.901 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 50' ' ' ILE . . . . . 0.532 HD13 ' HA ' ' A' ' 30' ' ' PHE . 29.9 mm -130.38 135.71 60.06 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.132 -0.486 . . . . 73.01 111.155 179.958 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 84.8 m -87.19 116.97 25.63 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.208 -0.451 . . . . 60.21 111.163 179.954 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 18.3 mt -117.0 164.91 13.99 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.241 -0.436 . . . . 71.42 110.94 179.959 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -175.76 175.84 1.96 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.203 -0.453 . . . . 75.01 110.865 179.943 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 76.6 p -66.69 -154.3 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.156 -0.474 . . . . 73.34 110.843 -179.789 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 17.3 m -119.21 -19.64 5.42 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.135 -0.484 . . . . 63.21 111.123 179.976 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -114.23 178.66 4.2 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.186 -0.461 . . . . 73.43 110.866 179.911 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 57' ' ' LYS . . . . . 0.462 ' N ' ' HD3' ' A' ' 57' ' ' LYS . 0.0 OUTLIER -118.24 -5.63 10.88 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.168 -0.469 . . . . 73.31 110.917 179.974 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 58' ' ' GLU . . . . . 0.553 ' HA ' ' C ' ' A' ' 59' ' ' PRO . 2.9 pt-20 -135.57 145.65 54.24 Favored Pre-proline 0 C--N 1.329 -0.287 0 CA-C-O 121.654 0.74 . . . . 75.44 110.91 179.939 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 59' ' ' PRO . . . . . 0.553 ' C ' ' HA ' ' A' ' 58' ' ' GLU . 53.6 Cg_endo -69.78 -6.92 9.73 Favored 'Cis proline' 0 C--N 1.342 0.185 0 C-N-CA 122.654 -1.811 . . . . 33.43 112.332 0.011 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 60' ' ' VAL . . . . . 0.457 ' O ' ' C ' ' A' ' 57' ' ' LYS . 32.3 m -140.89 -174.25 0.75 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.205 -0.452 . . . . 61.22 111.115 179.954 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 61' ' ' GLU . . . . . 0.46 ' O ' ' C ' ' A' ' 62' ' ' SER . 7.2 tt0 -119.28 -12.2 9.45 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.182 -0.463 . . . . 73.22 110.879 -179.965 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 62' ' ' SER . . . . . 0.827 ' CB ' HD11 ' A' ' 125' ' ' LEU . 0.2 OUTLIER 33.8 89.21 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.158 -0.474 . . . . 41.21 110.888 -179.79 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 5.0 p -119.06 123.63 44.94 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.158 -0.474 . . . . 74.0 110.839 -179.802 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 64' ' ' ILE . . . . . 0.794 HD11 HG21 ' A' ' 89' ' ' VAL . 33.6 mt -135.69 134.96 51.46 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.126 -0.488 . . . . 75.22 111.131 179.921 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 36.6 m -98.81 113.98 26.34 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.157 -0.474 . . . . 53.44 111.133 179.969 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 66' ' ' LEU . . . . . 0.681 HD21 HG21 ' A' ' 121' ' ' THR . 0.4 OUTLIER -94.74 111.37 23.15 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.236 -0.438 . . . . 61.33 110.899 179.984 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 5.1 t60 -103.38 112.02 24.72 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.217 -0.447 . . . . 72.13 110.873 179.843 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 68' ' ' PHE . . . . . 0.543 ' CE1' HG23 ' A' ' 114' ' ' ILE . 0.0 OUTLIER -103.76 139.91 38.35 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.227 -0.442 . . . . 74.21 110.861 -179.897 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 69' ' ' ALA . . . . . 0.777 ' HA ' HG22 ' A' ' 47' ' ' ILE . . . -123.66 116.22 22.73 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.171 -0.468 . . . . 75.54 111.058 179.94 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 70' ' ' MET . . . . . 0.449 ' HE1' ' CG1' ' A' ' 114' ' ' ILE . 0.0 OUTLIER -79.39 160.58 26.62 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.222 -0.445 . . . . 71.1 110.852 179.974 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -116.92 161.13 34.01 Favored Pre-proline 0 C--N 1.329 -0.295 0 CA-C-O 121.551 0.691 . . . . 60.32 111.145 -179.904 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.77 3.07 2.99 Favored 'Trans proline' 0 C--N 1.341 0.152 0 C-N-CA 122.702 2.268 . . . . 64.31 112.335 179.942 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 73' ' ' MET . . . . . 0.495 ' O ' ' CB ' ' A' ' 76' ' ' TYR . 0.5 OUTLIER -122.19 -24.98 4.97 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.201 -0.454 . . . . 73.1 110.901 179.889 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 74' ' ' TYR . . . . . 0.647 ' CD1' ' C ' ' A' ' 74' ' ' TYR . 0.0 OUTLIER -46.74 149.92 1.38 Allowed Pre-proline 0 C--N 1.329 -0.323 0 CA-C-O 121.698 0.761 . . . . 73.14 110.929 -179.875 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 75' ' ' PRO . . . . . 0.551 ' C ' ' HA ' ' A' ' 74' ' ' TYR . 53.5 Cg_endo -69.8 -10.31 11.51 Favored 'Cis proline' 0 C--O 1.232 0.198 0 C-N-CA 122.713 -1.786 . . . . 41.53 112.307 0.007 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 76' ' ' TYR . . . . . 0.495 ' CB ' ' O ' ' A' ' 73' ' ' MET . 24.3 t80 -34.08 -45.84 0.22 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.264 -0.426 . . . . 71.42 110.914 -179.91 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 77' ' ' THR . . . . . 0.464 HG23 ' HB2' ' A' ' 73' ' ' MET . 28.3 p -108.65 175.39 5.48 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.129 -0.487 . . . . 73.32 111.162 -179.969 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -100.55 127.69 32.07 Favored Pre-proline 0 C--N 1.329 -0.312 0 CA-C-O 121.541 0.686 . . . . 63.45 111.131 179.875 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 79' ' ' PRO . . . . . 0.762 ' HG3' HD11 ' A' ' 113' ' ' ILE . 53.8 Cg_endo -69.85 -168.82 0.3 Allowed 'Trans proline' 0 C--N 1.341 0.158 0 C-N-CA 122.656 2.237 . . . . 62.33 112.304 -179.947 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 80' ' ' GLU . . . . . 0.475 ' HG3' ' N ' ' A' ' 81' ' ' ILE . 0.3 OUTLIER -129.24 140.92 51.28 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.19 -0.459 . . . . 75.43 110.91 -179.976 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 81' ' ' ILE . . . . . 0.475 ' N ' ' HG3' ' A' ' 80' ' ' GLU . 3.1 mm -129.03 148.34 33.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.131 -0.486 . . . . 71.14 111.117 179.985 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 82' ' ' GLU . . . . . 0.507 ' HG3' ' CD ' ' A' ' 84' ' ' LYS . 4.1 pt-20 -147.83 142.85 27.0 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.195 -0.457 . . . . 62.04 110.908 179.966 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 83' ' ' PHE . . . . . 0.576 ' CD1' HD11 ' A' ' 66' ' ' LEU . 8.9 m-85 -99.39 138.64 36.19 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.171 -0.468 . . . . 64.44 110.899 -179.937 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 84' ' ' LYS . . . . . 0.507 ' CD ' ' HG3' ' A' ' 82' ' ' GLU . 7.7 mmmt -125.95 170.48 11.64 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.198 -0.455 . . . . 72.3 110.893 179.925 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 85' ' ' ASN . . . . . 0.432 ' O ' ' C ' ' A' ' 86' ' ' VAL . 2.5 m120 63.86 -72.97 0.05 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.232 -0.44 . . . . 63.02 110.889 179.97 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 86' ' ' VAL . . . . . 0.614 ' CG1' HD21 ' A' ' 94' ' ' LEU . 4.7 m 35.62 89.96 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.18 -0.464 . . . . 75.52 111.098 179.906 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -95.09 -68.14 0.82 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.173 -0.467 . . . . 61.15 110.862 -179.991 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 88' ' ' ASN . . . . . 0.438 ' ND2' HG11 ' A' ' 60' ' ' VAL . 19.9 t-20 -82.16 40.92 0.65 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.23 -0.441 . . . . 72.42 110.868 -179.943 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 89' ' ' VAL . . . . . 0.794 HG21 HD11 ' A' ' 64' ' ' ILE . 6.6 t -132.95 149.19 31.54 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.223 -0.444 . . . . 73.03 111.142 179.902 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 90' ' ' MET . . . . . 0.724 ' SD ' HG21 ' A' ' 134' ' ' THR . 0.2 OUTLIER -101.86 -69.52 0.78 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.175 -0.466 . . . . 74.23 110.843 179.936 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 2.7 p30 -177.31 -43.44 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.208 -0.451 . . . . 72.34 110.848 -179.975 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -54.22 -38.93 66.23 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.173 -0.467 . . . . 73.0 110.886 -179.794 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 93' ' ' GLN . . . . . 0.54 ' OE1' ' CG ' ' A' ' 128' ' ' PHE . 4.0 tt0 -65.94 -45.18 82.75 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.083 -0.508 . . . . 73.32 110.932 -179.954 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 94' ' ' LEU . . . . . 0.614 HD21 ' CG1' ' A' ' 86' ' ' VAL . 80.9 mt -60.51 -48.58 81.14 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.194 -0.457 . . . . 72.24 110.922 -179.994 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 2.7 mm-40 -63.66 -33.83 76.5 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.215 -0.448 . . . . 63.42 110.933 179.904 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 96' ' ' MET . . . . . 0.42 ' HE3' ' HG2' ' A' ' 124' ' ' LYS . 11.9 ttp -59.71 -39.49 84.8 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.191 -0.459 . . . . 54.42 110.901 179.946 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 97' ' ' LEU . . . . . 0.871 HD22 HG22 ' A' ' 121' ' ' THR . 29.1 mt -66.35 -39.13 88.98 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.193 -0.458 . . . . 63.32 110.934 -179.987 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 98' ' ' LYS . . . . . 0.434 ' HD3' ' CZ ' ' A' ' 83' ' ' PHE . 3.0 mmtp -61.62 -34.38 75.57 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.188 -0.46 . . . . 74.3 110.893 179.796 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 3.1 m -70.34 -45.88 65.28 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.233 -0.439 . . . . 62.24 110.872 -179.894 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 100' ' ' GLU . . . . . 0.719 ' O ' HD12 ' A' ' 104' ' ' ILE . 11.2 pt-20 -72.56 -23.79 61.03 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.159 -0.473 . . . . 62.52 110.906 -179.957 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 101' ' ' PHE . . . . . 0.616 ' CD1' ' O ' ' A' ' 97' ' ' LEU . 8.3 m-30 -59.87 -38.02 80.98 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.124 -0.489 . . . . 72.03 110.856 -179.918 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -62.33 -40.11 95.29 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.16 -0.473 . . . . 73.31 110.868 179.998 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 103' ' ' LYS . . . . . 0.415 ' O ' HG22 ' A' ' 107' ' ' THR . 4.1 tmmt? -67.57 -39.81 84.89 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.31 -0.405 . . . . 54.14 110.873 179.877 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 104' ' ' ILE . . . . . 0.719 HD12 ' O ' ' A' ' 100' ' ' GLU . 1.8 mt -62.9 -47.15 94.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.217 -0.447 . . . . 44.42 111.16 179.861 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 105' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -62.84 -43.07 99.78 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.126 -0.488 . . . . 74.1 110.868 179.862 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -59.98 -31.04 69.53 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.198 -0.455 . . . . 64.41 110.907 -179.944 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 107' ' ' THR . . . . . 0.415 HG22 ' O ' ' A' ' 103' ' ' LYS . 10.7 t -97.77 -9.66 26.18 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.15 -0.477 . . . . 73.42 111.152 -179.957 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 37.5 m -124.58 36.96 4.51 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.193 -0.458 . . . . 54.35 110.843 -179.827 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -97.18 93.83 6.77 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.155 -0.475 . . . . 75.14 110.878 -179.941 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 151.67 -13.88 0.79 Allowed Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.713 -0.756 . . . . 74.34 112.503 -179.954 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 111' ' ' GLN . . . . . . . . . . . . . 1.3 pt20 -132.09 -95.5 0.34 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.769 0.319 . . . . 75.23 110.884 -179.855 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 26.6 mt-10 -137.47 141.58 41.55 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.181 -0.463 . . . . 52.43 110.918 -179.942 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 113' ' ' ILE . . . . . 0.762 HD11 ' HG3' ' A' ' 79' ' ' PRO . 19.1 pt -124.17 -7.77 7.01 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.134 -0.484 . . . . 73.22 111.086 -179.977 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 114' ' ' ILE . . . . . 0.659 ' O ' HG23 ' A' ' 118' ' ' THR . 38.6 mm -67.07 -42.17 88.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.178 -0.464 . . . . 74.43 111.151 179.881 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 115' ' ' PHE . . . . . 0.811 ' HE1' HG21 ' A' ' 25' ' ' ILE . 29.2 t80 -72.53 -40.96 66.35 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.149 -0.478 . . . . 54.11 110.871 179.938 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 19.5 mm-40 -63.91 -42.57 97.37 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.16 -0.473 . . . . 64.42 110.923 -179.938 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 117' ' ' ILE . . . . . 0.596 HD11 ' CD2' ' A' ' 101' ' ' PHE . 0.4 OUTLIER -67.22 -41.97 87.37 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.116 -0.493 . . . . 73.33 111.179 179.952 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 118' ' ' THR . . . . . 0.659 HG23 ' O ' ' A' ' 114' ' ' ILE . 69.0 p -68.33 -43.12 78.26 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.158 -0.474 . . . . 61.54 111.141 179.903 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -64.51 -43.96 92.43 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.24 -0.436 . . . . 62.42 110.855 -179.809 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 120' ' ' PHE . . . . . 0.572 ' CD2' HD11 ' A' ' 104' ' ' ILE . 0.1 OUTLIER -63.1 -45.44 92.04 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.097 -0.501 . . . . 65.12 110.925 -179.986 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 121' ' ' THR . . . . . 0.871 HG22 HD22 ' A' ' 97' ' ' LEU . 25.0 p -69.17 -38.83 78.91 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.15 -0.477 . . . . 74.4 111.158 -179.982 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -64.21 -38.81 92.37 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.229 -0.441 . . . . 73.12 110.901 -179.999 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 123' ' ' GLU . . . . . 0.48 ' HG3' ' N ' ' A' ' 124' ' ' LYS . 6.4 pt-20 -77.65 -39.0 46.56 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.232 -0.44 . . . . 62.01 110.881 -179.925 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 124' ' ' LYS . . . . . 0.48 ' N ' ' HG3' ' A' ' 123' ' ' GLU . 0.1 OUTLIER -70.33 -39.64 74.63 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.214 -0.448 . . . . 73.34 110.865 179.982 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 125' ' ' LEU . . . . . 0.827 HD11 ' CB ' ' A' ' 62' ' ' SER . 1.3 tp -61.74 -50.43 72.45 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.253 -0.43 . . . . 65.41 110.928 179.929 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 3.1 t0 -57.84 -39.19 77.11 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.175 -0.466 . . . . 75.31 110.893 179.8 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 127' ' ' GLU . . . . . 0.463 ' HG3' ' N ' ' A' ' 128' ' ' PHE . 0.0 OUTLIER -63.96 -28.8 70.06 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.156 -0.474 . . . . 64.51 110.884 -179.879 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 128' ' ' PHE . . . . . 0.54 ' CG ' ' OE1' ' A' ' 93' ' ' GLN . 0.3 OUTLIER -71.45 -68.95 0.41 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.155 -0.475 . . . . 72.33 110.905 -179.949 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 129' ' ' GLN . . . . . 0.682 ' O ' HG12 ' A' ' 132' ' ' VAL . 1.7 tm0? -35.58 -38.71 0.12 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.124 -0.489 . . . . 74.14 110.901 -179.967 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 130' ' ' ASN . . . . . . . . . . . . . 1.5 m-20 -64.38 -45.66 86.73 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.207 -0.451 . . . . 73.55 110.862 -179.956 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 131' ' ' VAL . . . . . 0.569 HG23 ' O ' ' A' ' 131' ' ' VAL . 2.9 m -110.05 28.48 1.88 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.212 -0.449 . . . . 73.11 111.119 179.942 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 132' ' ' VAL . . . . . 0.682 HG12 ' O ' ' A' ' 129' ' ' GLN . 14.4 p -73.87 132.59 33.16 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.177 -0.465 . . . . 74.13 111.135 179.89 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 133' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -125.68 43.23 3.11 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.217 -0.447 . . . . 52.24 110.851 179.996 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 134' ' ' THR . . . . . 0.724 HG21 ' SD ' ' A' ' 90' ' ' MET . 30.7 p -145.73 158.42 43.86 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.227 -0.442 . . . . 73.2 111.155 -179.991 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -143.59 133.89 24.56 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.241 -0.436 . . . . 62.3 110.895 -179.972 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 2.5 m -132.73 -49.87 0.9 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.217 -0.447 . . . . 73.14 110.845 -179.794 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 137' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -51.48 111.54 0.6 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.126 -0.488 . . . . 71.33 110.926 -179.992 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.329 -0.29 0 CA-C-N 116.185 -0.462 . . . . 71.55 110.897 179.929 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.458 -0.052 0 CA-C-O 120.819 0.342 . . . . 75.14 110.891 . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 3.1 m -133.54 -45.16 0.82 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.16 -0.473 . . . . 71.45 110.865 -179.843 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER 66.42 98.98 0.05 OUTLIER 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.13 -0.486 . . . . 61.12 110.927 -179.993 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -173.58 174.76 3.12 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.164 -0.471 . . . . 74.51 110.809 -179.936 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 6.6 m-70 -72.85 81.48 1.17 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.068 -0.514 . . . . 74.03 110.857 179.982 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 2.6 tp -126.82 114.68 18.24 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.175 -0.466 . . . . 63.53 110.903 -179.986 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 7.7 t -161.66 178.28 9.17 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.222 -0.444 . . . . 73.12 111.113 179.954 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.675 HD21 ' HE3' ' A' ' 73' ' ' MET . 63.3 mt -70.01 -28.82 65.81 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.21 -0.45 . . . . 73.11 110.88 179.979 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 1.2 t70 -50.5 -33.93 23.26 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.208 -0.451 . . . . 62.33 110.874 179.84 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 59.0 mm-40 -67.65 -36.8 81.42 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.195 -0.457 . . . . 71.43 110.904 -179.934 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 16.8 m-85 -62.82 -27.67 69.48 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.206 -0.452 . . . . 65.31 110.916 -179.841 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 1.5 t80 -60.07 -37.77 80.88 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.111 -0.495 . . . . 74.32 110.955 -179.924 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 2.1 mm-40 -61.47 -45.65 93.35 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.107 -0.497 . . . . 65.33 110.872 180.0 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 3.7 mp -65.76 -40.73 88.58 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.196 -0.456 . . . . 73.23 111.145 179.974 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 15' ' ' GLN . . . . . 0.553 ' HB3' HG21 ' A' ' 46' ' ' ILE . 80.5 mt-30 -59.2 -47.03 86.83 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.197 -0.456 . . . . 61.54 110.902 179.954 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 4.6 t -63.86 -42.34 97.58 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.21 -0.45 . . . . 62.52 110.844 -179.924 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -57.8 -33.51 68.66 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.199 -0.455 . . . . 71.45 110.842 -179.844 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 18' ' ' GLU . . . . . 0.487 ' OE1' ' CD1' ' A' ' 114' ' ' ILE . 1.4 mm-40 -67.25 -38.72 85.61 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.193 -0.458 . . . . 65.02 110.908 -179.996 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.456 ' CD2' HG13 ' A' ' 46' ' ' ILE . 8.6 mp -62.63 -51.53 66.9 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.142 -0.481 . . . . 73.25 110.916 179.993 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 1.8 pt-20 -68.72 -31.77 71.08 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.165 -0.47 . . . . 51.34 110.889 179.964 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -63.93 -48.39 76.75 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.177 -0.465 . . . . 75.32 111.082 179.928 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 22' ' ' ILE . . . . . 0.403 HG23 ' CD2' ' A' ' 26' ' ' TYR . 0.7 OUTLIER -76.93 -37.1 26.53 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.234 -0.439 . . . . 72.3 111.122 179.981 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 2.7 mtt180 -52.55 -34.22 49.14 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.198 -0.456 . . . . 72.24 110.844 -179.985 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -66.18 -37.81 86.5 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.194 -0.457 . . . . 71.31 110.874 -179.809 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 25' ' ' ILE . . . . . 0.742 HG21 ' HE1' ' A' ' 115' ' ' PHE . 3.2 mt -78.81 -45.16 25.11 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.127 -0.488 . . . . 72.22 111.171 179.922 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 26' ' ' TYR . . . . . 0.403 ' CD2' HG23 ' A' ' 22' ' ' ILE . 17.5 m-85 -106.94 45.11 1.0 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.168 -0.469 . . . . 62.33 110.916 179.998 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 1.5 mtm -45.15 -61.25 1.72 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.11 -0.496 . . . . 55.12 110.902 179.871 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 15.6 m-20 -75.5 -28.55 59.22 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.2 -0.454 . . . . 73.03 110.892 179.95 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -94.2 37.84 1.1 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.153 -0.476 . . . . 53.25 110.871 -179.99 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 30' ' ' PHE . . . . . 0.571 ' HA ' HD13 ' A' ' 50' ' ' ILE . 9.3 t80 -117.71 129.06 55.48 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.191 -0.459 . . . . 74.22 110.889 -179.908 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 82.7 m -118.13 131.13 56.44 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.167 -0.47 . . . . 72.43 111.174 -179.962 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 9.4 t0 -105.12 114.46 28.67 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.244 -0.434 . . . . 71.22 110.833 179.959 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 1.139 HD21 ' CE1' ' A' ' 67' ' ' HIS . 0.2 OUTLIER -111.05 -6.3 14.66 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.208 -0.451 . . . . 65.02 110.913 -179.965 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 34' ' ' THR . . . . . 0.683 ' N ' HD12 ' A' ' 33' ' ' LEU . 0.2 OUTLIER -45.95 123.49 4.57 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.198 -0.456 . . . . 72.45 111.148 179.968 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -51.48 86.35 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.207 -0.451 . . . . 73.33 110.863 179.915 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 36' ' ' ARG . . . . . 0.493 ' N ' ' O ' ' A' ' 34' ' ' THR . 0.7 OUTLIER -105.12 -63.92 1.18 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.242 -0.435 . . . . 74.2 110.924 179.906 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 37' ' ' LYS . . . . . 0.42 ' HE2' ' C ' ' A' ' 37' ' ' LYS . 0.0 OUTLIER -138.75 138.83 38.02 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.149 -0.478 . . . . 54.02 110.887 179.959 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 58.0 m 61.39 99.9 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.205 -0.452 . . . . 64.22 110.838 -179.873 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 68.9 m -167.97 -172.64 1.86 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.141 -0.481 . . . . 55.13 110.902 -179.83 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 40' ' ' TRP . . . . . . . . . . . . . 30.0 p90 -108.69 -20.84 12.94 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.138 -0.483 . . . . 72.01 110.943 179.965 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 41' ' ' ASP . . . . . 0.413 ' C ' ' HG2' ' A' ' 42' ' ' LYS . 0.8 OUTLIER -131.23 167.16 19.66 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.244 -0.434 . . . . 43.25 110.892 179.911 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 42' ' ' LYS . . . . . 0.413 ' HG2' ' C ' ' A' ' 41' ' ' ASP . 2.9 mttt -142.58 63.87 1.38 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.196 -0.456 . . . . 75.43 110.918 -179.978 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 1.4 pp0? -150.43 61.81 5.01 Favored Pre-proline 0 C--N 1.33 -0.257 0 CA-C-O 121.629 0.728 . . . . 74.32 110.949 179.941 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.76 -163.52 0.11 Allowed 'Trans proline' 0 C--N 1.341 0.176 0 C-N-CA 122.683 2.255 . . . . 62.34 112.338 -179.974 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 45' ' ' GLN . . . . . 0.958 ' HG2' HG23 ' A' ' 47' ' ' ILE . 0.1 OUTLIER -179.68 32.64 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.188 -0.46 . . . . 62.01 110.895 -179.976 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 46' ' ' ILE . . . . . 0.674 HG22 ' O ' ' A' ' 45' ' ' GLN . 0.1 OUTLIER 86.82 -16.67 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.222 -0.444 . . . . 50.35 111.126 179.974 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 47' ' ' ILE . . . . . 0.958 HG23 ' HG2' ' A' ' 45' ' ' GLN . 0.1 OUTLIER -45.62 149.63 0.31 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-N 116.16 -0.473 . . . . 74.43 111.105 179.872 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 48' ' ' PHE . . . . . 0.465 ' HA ' ' CD1' ' A' ' 33' ' ' LEU . 27.8 p90 -158.46 171.09 20.79 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.122 -0.49 . . . . 75.23 110.885 179.936 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 49' ' ' GLU . . . . . 0.764 ' OE2' HD23 ' A' ' 33' ' ' LEU . 5.8 mt-10 -119.35 161.16 20.94 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.168 -0.469 . . . . 74.23 110.884 -179.924 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 50' ' ' ILE . . . . . 0.571 HD13 ' HA ' ' A' ' 30' ' ' PHE . 8.2 mm -142.96 137.43 26.86 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.147 -0.478 . . . . 62.42 111.087 179.994 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 85.5 m -83.9 131.58 34.85 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.17 -0.468 . . . . 60.13 111.105 179.971 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 52' ' ' LEU . . . . . 0.881 HD12 HD12 ' A' ' 66' ' ' LEU . 17.4 mt -134.79 159.5 41.15 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.187 -0.461 . . . . 72.03 110.873 179.989 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 53' ' ' ARG . . . . . 0.428 ' HD2' ' C ' ' A' ' 52' ' ' LEU . 0.0 OUTLIER 178.82 166.21 0.89 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.156 -0.474 . . . . 75.24 110.885 179.977 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -57.38 167.3 1.0 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.153 -0.476 . . . . 75.43 110.841 -179.789 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 19.2 m -78.91 -21.52 12.81 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.111 -0.495 . . . . 73.05 111.096 179.965 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 2.4 t70 -118.54 -172.05 2.2 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.201 -0.454 . . . . 73.44 110.837 179.97 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 3.3 mmmm -119.04 -17.51 8.98 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.218 -0.446 . . . . 73.34 110.919 179.962 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 58' ' ' GLU . . . . . 0.551 ' HA ' ' C ' ' A' ' 59' ' ' PRO . 4.7 pt-20 -120.08 145.77 40.74 Favored Pre-proline 0 C--N 1.33 -0.28 0 CA-C-O 121.664 0.745 . . . . 63.43 110.868 179.944 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 59' ' ' PRO . . . . . 0.551 ' C ' ' HA ' ' A' ' 58' ' ' GLU . 52.9 Cg_endo -69.81 -14.67 12.59 Favored 'Cis proline' 0 C--N 1.342 0.217 0 C-N-CA 122.697 -1.793 . . . . 74.33 112.303 0.073 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 60' ' ' VAL . . . . . 0.458 HG22 ' CG ' ' A' ' 129' ' ' GLN . 13.3 m -142.37 166.86 15.68 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.261 -0.427 . . . . 73.33 111.154 179.925 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 26.0 tt0 -102.88 -22.05 13.91 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.191 -0.459 . . . . 71.52 110.88 -179.952 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 62' ' ' SER . . . . . 0.545 ' HB3' HD11 ' A' ' 125' ' ' LEU . 2.5 m 40.77 92.31 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.205 -0.452 . . . . 73.35 110.821 -179.783 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 1.1 p -108.95 123.07 48.53 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.12 -0.491 . . . . 63.25 110.886 -179.863 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 64' ' ' ILE . . . . . 0.488 HD11 HG21 ' A' ' 89' ' ' VAL . 41.6 mt -136.98 137.4 46.94 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.115 -0.493 . . . . 70.01 111.155 179.958 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 16.3 m -101.24 115.69 31.09 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.206 -0.452 . . . . 74.23 111.17 179.951 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 66' ' ' LEU . . . . . 0.924 HD21 ' CE1' ' A' ' 83' ' ' PHE . 14.8 mt -95.93 109.24 21.64 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.202 -0.454 . . . . 63.15 110.909 179.989 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 67' ' ' HIS . . . . . 1.139 ' CE1' HD21 ' A' ' 33' ' ' LEU . 3.6 t60 -101.76 110.46 22.45 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.208 -0.451 . . . . 64.54 110.813 179.894 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 68' ' ' PHE . . . . . 0.469 ' HA ' ' CG1' ' A' ' 81' ' ' ILE . 0.0 OUTLIER -101.74 138.91 38.09 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.17 -0.468 . . . . 74.32 110.87 -179.938 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 69' ' ' ALA . . . . . 0.627 ' HA ' HG22 ' A' ' 47' ' ' ILE . . . -118.68 123.56 45.22 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.157 -0.474 . . . . 61.11 111.119 179.903 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 70' ' ' MET . . . . . 0.669 ' CE ' HD11 ' A' ' 114' ' ' ILE . 7.8 mmt -90.72 89.88 7.7 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.241 -0.436 . . . . 74.31 110.864 179.99 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -47.06 159.55 0.38 Allowed Pre-proline 0 C--N 1.33 -0.274 0 CA-C-O 121.589 0.709 . . . . 71.23 111.122 -179.957 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 72' ' ' PRO . . . . . 0.421 ' O ' HD22 ' A' ' 8' ' ' LEU . 53.7 Cg_endo -69.76 2.15 3.79 Favored 'Trans proline' 0 C--N 1.342 0.201 0 C-N-CA 122.66 2.24 . . . . 75.31 112.348 179.926 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 73' ' ' MET . . . . . 0.675 ' HE3' HD21 ' A' ' 8' ' ' LEU . 0.0 OUTLIER -116.86 -25.82 7.14 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.245 -0.434 . . . . 74.23 110.873 179.886 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 74' ' ' TYR . . . . . 0.662 ' CD1' ' C ' ' A' ' 74' ' ' TYR . 0.0 OUTLIER -52.24 153.75 4.73 Favored Pre-proline 0 C--N 1.328 -0.364 0 CA-C-O 121.693 0.759 . . . . 72.13 110.898 -179.846 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 75' ' ' PRO . . . . . 0.534 ' C ' ' HA ' ' A' ' 74' ' ' TYR . 53.6 Cg_endo -69.74 -11.11 11.77 Favored 'Cis proline' 0 C--N 1.341 0.182 0 C-N-CA 122.682 -1.799 . . . . 72.42 112.359 -0.114 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 76' ' ' TYR . . . . . 0.5 ' CB ' ' O ' ' A' ' 73' ' ' MET . 10.2 t80 -33.91 -57.01 0.47 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.241 -0.436 . . . . 72.15 110.947 -179.947 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 77' ' ' THR . . . . . 0.669 HG23 ' HB3' ' A' ' 73' ' ' MET . 30.4 p -97.72 -179.66 4.52 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.098 -0.501 . . . . 71.22 111.089 -179.955 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -94.88 129.25 36.45 Favored Pre-proline 0 C--N 1.329 -0.291 0 CA-C-O 121.623 0.725 . . . . 73.33 111.068 179.888 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 79' ' ' PRO . . . . . 0.596 ' HG3' HD11 ' A' ' 113' ' ' ILE . 53.4 Cg_endo -69.78 174.09 10.04 Favored 'Trans proline' 0 C--N 1.342 0.205 0 C-N-CA 122.666 2.244 . . . . 62.04 112.344 -179.988 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 80' ' ' GLU . . . . . 0.408 ' O ' HG13 ' A' ' 81' ' ' ILE . 3.1 tt0 -118.45 138.54 52.41 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.196 -0.456 . . . . 73.14 110.874 -179.975 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 81' ' ' ILE . . . . . 0.469 ' CG1' ' HA ' ' A' ' 68' ' ' PHE . 15.0 mt -144.56 148.93 17.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.131 -0.486 . . . . 71.53 111.118 179.983 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 82' ' ' GLU . . . . . 0.514 ' HG3' ' CD ' ' A' ' 84' ' ' LYS . 11.3 pt-20 -146.34 148.28 32.21 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.188 -0.46 . . . . 71.05 110.88 179.953 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 83' ' ' PHE . . . . . 0.924 ' CE1' HD21 ' A' ' 66' ' ' LEU . 49.6 m-85 -90.42 136.68 32.9 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.172 -0.467 . . . . 71.44 110.915 -179.975 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 84' ' ' LYS . . . . . 0.514 ' CD ' ' HG3' ' A' ' 82' ' ' GLU . 9.4 mmmt -125.82 169.95 12.1 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.12 -0.491 . . . . 74.03 110.893 -179.996 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 85' ' ' ASN . . . . . 0.469 ' O ' ' C ' ' A' ' 86' ' ' VAL . 5.7 m-80 62.63 -73.03 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.251 -0.431 . . . . 72.15 110.903 179.981 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 86' ' ' VAL . . . . . 0.654 ' O ' HG23 ' A' ' 86' ' ' VAL . 30.5 m 31.86 91.34 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.226 -0.443 . . . . 73.24 111.132 179.919 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -96.18 -72.99 0.61 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.172 -0.467 . . . . 64.51 110.932 -179.98 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 88' ' ' ASN . . . . . 0.439 ' CG ' ' HB ' ' A' ' 60' ' ' VAL . 70.2 m-80 -76.95 54.12 0.99 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.158 -0.473 . . . . 64.34 110.927 -179.995 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 89' ' ' VAL . . . . . 0.488 HG21 HD11 ' A' ' 64' ' ' ILE . 16.2 t -139.2 154.99 25.95 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.203 -0.453 . . . . 64.31 111.114 179.954 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 90' ' ' MET . . . . . . . . . . . . . 4.8 mtm -100.95 -69.59 0.77 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.177 -0.465 . . . . 64.12 110.866 179.938 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 4.3 p-10 173.62 -44.63 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.201 -0.454 . . . . 72.35 110.86 179.945 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -54.38 -38.69 66.43 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.222 -0.444 . . . . 53.51 110.857 -179.74 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 93' ' ' GLN . . . . . 0.596 ' OE1' ' CD2' ' A' ' 128' ' ' PHE . 0.0 OUTLIER -66.6 -42.69 86.52 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.169 -0.469 . . . . 43.55 110.91 -179.969 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 84.1 mt -62.26 -48.29 80.58 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.158 -0.474 . . . . 74.3 110.927 -179.983 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -65.45 -34.27 77.88 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.205 -0.452 . . . . 75.42 110.92 179.88 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 96' ' ' MET . . . . . . . . . . . . . 26.8 ttp -59.99 -39.36 85.45 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.194 -0.457 . . . . 44.11 110.878 179.939 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 97' ' ' LEU . . . . . 0.747 HD22 HG22 ' A' ' 121' ' ' THR . 17.3 mt -66.85 -39.65 87.65 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.243 -0.435 . . . . 55.21 110.908 -179.98 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 5.2 mmtm -56.29 -38.0 70.63 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.198 -0.455 . . . . 73.42 110.876 179.853 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 1.7 m -69.58 -39.64 77.2 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.237 -0.438 . . . . 74.33 110.85 -179.885 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 100' ' ' GLU . . . . . 0.68 ' O ' HD12 ' A' ' 104' ' ' ILE . 68.4 mm-40 -69.22 -24.53 64.03 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.137 -0.483 . . . . 75.21 110.876 -179.912 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 101' ' ' PHE . . . . . 0.649 ' CG ' HD11 ' A' ' 117' ' ' ILE . 6.9 m-30 -63.0 -32.39 73.74 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.155 -0.475 . . . . 72.01 110.886 -179.947 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 102' ' ' LYS . . . . . 0.437 ' HE2' ' C ' ' A' ' 102' ' ' LYS . 2.3 ttpt -70.5 -41.79 72.17 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.171 -0.468 . . . . 74.31 110.893 179.965 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 12.2 ttpt -66.87 -41.17 87.74 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.223 -0.444 . . . . 73.31 110.912 179.872 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 104' ' ' ILE . . . . . 0.68 HD12 ' O ' ' A' ' 100' ' ' GLU . 3.2 mt -64.84 -47.59 87.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.22 -0.445 . . . . 63.15 111.112 179.856 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 105' ' ' HIS . . . . . 0.429 ' O ' ' N ' ' A' ' 109' ' ' ARG . 10.1 t60 -62.91 -41.23 99.39 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.224 -0.444 . . . . 74.14 110.889 179.899 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -59.11 -42.59 90.9 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.217 -0.447 . . . . 65.22 110.904 -179.962 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 10.4 t -81.97 -27.14 33.38 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.184 -0.462 . . . . 75.42 111.152 -179.97 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 108' ' ' SER . . . . . 0.515 ' HB2' HG22 ' A' ' 113' ' ' ILE . 40.5 m -107.44 24.31 13.08 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.225 -0.443 . . . . 32.31 110.839 -179.869 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 109' ' ' ARG . . . . . 0.429 ' N ' ' O ' ' A' ' 105' ' ' HIS . 18.0 ttt180 -71.65 81.76 0.84 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.156 -0.475 . . . . 71.13 110.861 -179.924 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 155.51 -33.35 0.64 Allowed Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 120.774 -0.727 . . . . 25.42 112.54 -179.931 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 111' ' ' GLN . . . . . . . . . . . . . 10.5 pt20 -112.09 -158.72 0.66 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.746 0.308 . . . . 65.23 110.92 -179.862 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 4.0 mt-10 -69.85 136.65 50.97 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.242 -0.435 . . . . 61.55 110.871 -179.943 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 113' ' ' ILE . . . . . 0.596 HD11 ' HG3' ' A' ' 79' ' ' PRO . 2.3 pt -123.95 -6.73 7.21 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.108 -0.496 . . . . 74.23 111.095 179.998 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 114' ' ' ILE . . . . . 0.868 ' H ' HD12 ' A' ' 114' ' ' ILE . 3.5 mp -68.22 -46.66 80.74 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-N 116.194 -0.457 . . . . 65.44 111.155 179.834 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 115' ' ' PHE . . . . . 0.742 ' HE1' HG21 ' A' ' 25' ' ' ILE . 11.4 t80 -65.19 -37.46 87.42 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.142 -0.481 . . . . 72.22 110.916 179.91 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 6.6 mm-40 -67.87 -45.24 75.11 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.106 -0.497 . . . . 74.43 110.897 -179.947 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 117' ' ' ILE . . . . . 0.649 HD11 ' CG ' ' A' ' 101' ' ' PHE . 0.4 OUTLIER -67.55 -40.92 85.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.157 -0.474 . . . . 73.34 111.085 -179.981 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 118' ' ' THR . . . . . 0.69 HG23 ' O ' ' A' ' 114' ' ' ILE . 81.3 p -68.79 -43.49 75.59 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.204 -0.453 . . . . 73.34 111.134 179.978 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 3.3 t -68.1 -44.42 76.24 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.262 -0.427 . . . . 64.14 110.836 -179.832 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 4.6 t80 -62.9 -45.2 93.63 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.146 -0.479 . . . . 75.42 110.887 -179.939 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 121' ' ' THR . . . . . 0.747 HG22 HD22 ' A' ' 97' ' ' LEU . 17.1 p -66.23 -45.32 81.06 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.099 -0.5 . . . . 74.1 111.138 -179.892 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 40.8 tt0 -65.26 -43.81 90.08 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.266 -0.425 . . . . 73.51 110.902 -179.99 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 11.1 pt-20 -70.61 -28.8 65.12 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.178 -0.465 . . . . 62.31 110.895 -179.945 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 124' ' ' LYS . . . . . 0.463 ' HA ' ' CE ' ' A' ' 124' ' ' LYS . 0.2 OUTLIER -78.99 -40.86 30.46 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.173 -0.467 . . . . 74.12 110.894 179.921 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 125' ' ' LEU . . . . . 0.641 ' O ' HD23 ' A' ' 125' ' ' LEU . 0.7 OUTLIER -69.98 -38.1 75.93 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.236 -0.438 . . . . 61.35 110.949 179.906 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -66.7 -46.31 75.97 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.185 -0.461 . . . . 73.44 110.837 179.866 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 127' ' ' GLU . . . . . 0.443 ' OE1' ' C ' ' A' ' 127' ' ' GLU . 1.6 pp20? -65.88 -28.19 68.77 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.185 -0.461 . . . . 72.42 110.873 -179.885 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 128' ' ' PHE . . . . . 0.596 ' CD2' ' OE1' ' A' ' 93' ' ' GLN . 0.2 OUTLIER -78.83 -62.57 1.65 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.144 -0.48 . . . . 72.55 110.9 -179.913 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 129' ' ' GLN . . . . . 0.458 ' CG ' HG22 ' A' ' 60' ' ' VAL . 1.0 OUTLIER -34.73 -47.24 0.33 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.15 -0.477 . . . . 51.31 110.912 -179.938 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 130' ' ' ASN . . . . . . . . . . . . . 8.9 t-20 -49.34 -64.89 0.67 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.246 -0.434 . . . . 74.25 110.873 -179.963 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 131' ' ' VAL . . . . . 0.458 HG13 ' N ' ' A' ' 132' ' ' VAL . 5.7 p -176.58 -45.25 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.207 -0.451 . . . . 71.41 111.105 179.889 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 132' ' ' VAL . . . . . 0.603 HG22 ' N ' ' A' ' 133' ' ' ASN . 12.1 p -173.5 164.44 0.25 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.197 -0.456 . . . . 73.21 111.12 179.946 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 133' ' ' ASN . . . . . 0.603 ' N ' HG22 ' A' ' 132' ' ' VAL . 3.3 m120 -43.42 104.95 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.181 -0.463 . . . . 73.35 110.889 -179.982 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 134' ' ' THR . . . . . . . . . . . . . 34.2 m -108.62 -60.36 1.75 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.149 -0.478 . . . . 64.22 111.146 -179.974 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -67.99 165.56 17.61 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.222 -0.445 . . . . 73.0 110.892 -179.984 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -159.19 80.8 0.76 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.193 -0.458 . . . . 61.51 110.867 -179.84 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 137' ' ' LEU . . . . . . . . . . . . . 3.0 tt 54.4 88.23 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.148 -0.478 . . . . 71.23 110.934 179.988 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 2.9 mt-10 . . . . . 0 C--N 1.33 -0.276 0 CA-C-N 116.143 -0.48 . . . . 74.52 110.876 179.962 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 3.3 tpp . . . . . 0 C--O 1.231 0.088 0 CA-C-O 120.807 0.337 . . . . 74.35 110.857 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -144.08 143.89 31.36 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.194 -0.457 . . . . 74.21 110.887 -179.814 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -104.97 38.97 1.8 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.16 -0.473 . . . . 64.5 110.894 -179.966 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 4' ' ' SER . . . . . 0.441 ' O ' ' C ' ' A' ' 5' ' ' HIS . 18.0 p -48.82 -80.43 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.184 -0.462 . . . . 73.24 110.877 -179.947 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 5' ' ' HIS . . . . . 0.441 ' C ' ' O ' ' A' ' 4' ' ' SER . 34.4 t60 35.11 88.64 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.147 -0.479 . . . . 73.03 110.821 179.976 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 5.2 tt 55.37 95.23 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.212 -0.449 . . . . 71.1 110.945 -179.976 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 5.5 t -161.84 172.19 16.52 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.214 -0.448 . . . . 53.55 111.141 179.98 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.585 HD21 ' CE ' ' A' ' 73' ' ' MET . 60.4 mt -69.18 -21.67 63.96 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.198 -0.455 . . . . 74.23 110.903 179.992 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 9' ' ' ASP . . . . . 0.437 ' O ' ' HB2' ' A' ' 12' ' ' TYR . 16.3 t70 -50.51 -33.38 21.28 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.21 -0.45 . . . . 51.53 110.841 179.831 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 2.3 mm-40 -70.11 -40.76 74.69 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.19 -0.459 . . . . 74.41 110.914 -179.865 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 12.7 m-85 -50.99 -24.72 3.92 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.199 -0.455 . . . . 72.41 110.929 -179.872 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 12' ' ' TYR . . . . . 0.437 ' HB2' ' O ' ' A' ' 9' ' ' ASP . 0.1 OUTLIER -59.17 -36.23 74.94 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.127 -0.488 . . . . 74.34 110.919 -179.947 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 13' ' ' GLU . . . . . 0.505 ' HG3' ' N ' ' A' ' 14' ' ' ILE . 6.5 pt-20 -60.28 -42.87 96.36 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.12 -0.491 . . . . 63.14 110.901 -179.938 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 14' ' ' ILE . . . . . 0.505 ' N ' ' HG3' ' A' ' 13' ' ' GLU . 3.9 mp -68.46 -39.95 81.46 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.144 -0.48 . . . . 71.1 111.149 179.927 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 15' ' ' GLN . . . . . 0.481 ' HG2' ' CE1' ' A' ' 74' ' ' TYR . 79.8 mt-30 -63.63 -48.28 77.91 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.175 -0.466 . . . . 50.41 110.888 179.941 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -64.84 -39.18 93.15 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.211 -0.449 . . . . 55.03 110.95 -179.958 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -59.08 -33.82 71.26 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.183 -0.462 . . . . 75.11 110.902 -179.927 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 2.1 mm-40 -66.61 -41.01 89.04 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.152 -0.477 . . . . 71.52 110.892 179.972 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.866 HD11 HG13 ' A' ' 46' ' ' ILE . 6.0 mt -59.96 -51.39 69.88 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.164 -0.471 . . . . 64.31 110.898 -179.941 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 5.0 pt-20 -68.34 -34.95 77.02 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.191 -0.459 . . . . 75.33 110.891 179.916 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -62.76 -50.6 70.41 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.157 -0.474 . . . . 74.34 111.099 179.923 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 22' ' ' ILE . . . . . 0.737 ' HA ' HD12 ' A' ' 25' ' ' ILE . 0.6 OUTLIER -77.65 -34.27 20.03 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.155 -0.475 . . . . 64.11 111.151 179.991 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 1.6 mtt180 -52.25 -35.23 49.23 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.202 -0.454 . . . . 64.34 110.887 179.94 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -67.23 -29.14 68.71 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.167 -0.47 . . . . 63.32 110.857 -179.743 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 25' ' ' ILE . . . . . 0.93 HD13 ' CE1' ' A' ' 115' ' ' PHE . 4.5 mt -84.49 -45.21 17.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.092 -0.504 . . . . 61.13 111.163 179.896 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 16.1 m-85 -110.38 46.69 1.02 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.196 -0.456 . . . . 75.14 110.904 -179.975 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 5.1 mtm -43.95 -61.83 1.32 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.114 -0.494 . . . . 64.5 110.9 179.897 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -82.7 -19.28 38.36 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.235 -0.438 . . . . 64.22 110.894 179.924 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 45.2 m-20 -100.55 37.15 1.75 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.209 -0.45 . . . . 74.2 110.885 179.967 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 30' ' ' PHE . . . . . 0.409 ' HA ' HD13 ' A' ' 50' ' ' ILE . 3.9 t80 -125.5 126.28 44.61 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.186 -0.461 . . . . 74.23 110.869 -179.898 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 52.7 m -118.1 133.27 56.06 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.167 -0.47 . . . . 74.13 111.116 -179.958 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 5.7 t0 -103.74 114.32 28.49 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.236 -0.438 . . . . 74.54 110.892 179.863 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.727 HD12 ' N ' ' A' ' 34' ' ' THR . 0.2 OUTLIER -103.34 -5.44 22.99 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.182 -0.463 . . . . 74.11 110.885 -179.91 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 34' ' ' THR . . . . . 0.727 ' N ' HD12 ' A' ' 33' ' ' LEU . 0.3 OUTLIER -36.37 121.49 0.71 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.198 -0.456 . . . . 72.35 111.143 179.933 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 35' ' ' LYS . . . . . 0.488 ' HB3' ' CH2' ' A' ' 40' ' ' TRP . 6.7 mttm -44.15 92.9 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.266 -0.424 . . . . 73.44 110.89 179.886 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 36' ' ' ARG . . . . . 0.455 ' N ' ' O ' ' A' ' 34' ' ' THR . 29.9 mmt180 -88.32 179.25 6.38 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.236 -0.438 . . . . 71.14 110.838 -179.999 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -49.95 124.33 9.78 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.164 -0.471 . . . . 60.24 110.921 179.952 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 38' ' ' SER . . . . . 0.486 ' HB3' ' CE3' ' A' ' 40' ' ' TRP . 0.2 OUTLIER 177.09 -168.62 0.06 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.227 -0.442 . . . . 73.44 110.905 -179.858 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 1.5 m -127.59 96.28 4.49 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.174 -0.467 . . . . 72.33 110.842 -179.847 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 40' ' ' TRP . . . . . 0.488 ' CH2' ' HB3' ' A' ' 35' ' ' LYS . 0.2 OUTLIER 179.84 -34.85 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.144 -0.48 . . . . 74.52 110.956 179.977 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER 178.28 146.66 0.15 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.217 -0.447 . . . . 73.35 110.852 179.918 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 3.3 mttt -141.72 72.01 1.37 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.176 -0.465 . . . . 63.13 110.935 179.969 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 43' ' ' GLN . . . . . 0.488 ' N ' ' CD ' ' A' ' 44' ' ' PRO . 5.7 mt-30 -149.0 51.25 0.93 Allowed Pre-proline 0 C--N 1.329 -0.298 0 CA-C-O 121.629 0.728 . . . . 73.3 110.891 179.981 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 44' ' ' PRO . . . . . 0.488 ' CD ' ' N ' ' A' ' 43' ' ' GLN . 53.6 Cg_endo -69.8 -164.51 0.13 Allowed 'Trans proline' 0 C--N 1.341 0.171 0 C-N-CA 122.713 2.275 . . . . 64.02 112.278 -179.99 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 45' ' ' GLN . . . . . 0.839 ' HG2' HG23 ' A' ' 47' ' ' ILE . 18.0 pt20 -179.13 38.24 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.199 -0.455 . . . . 51.34 110.906 -179.973 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 46' ' ' ILE . . . . . 0.866 HG13 HD11 ' A' ' 19' ' ' LEU . 0.0 OUTLIER 84.83 -24.46 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.236 -0.438 . . . . 74.31 111.089 179.946 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 47' ' ' ILE . . . . . 0.839 HG23 ' HG2' ' A' ' 45' ' ' GLN . 0.2 OUTLIER -32.7 143.66 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.181 -0.463 . . . . 75.54 111.154 179.864 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 11.8 p90 -156.92 174.43 15.52 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.216 -0.447 . . . . 64.41 110.873 179.958 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 49' ' ' GLU . . . . . 0.466 ' CG ' ' HB2' ' A' ' 67' ' ' HIS . 6.3 mt-10 -123.54 161.03 25.73 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.146 -0.479 . . . . 74.23 110.888 -179.908 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 50' ' ' ILE . . . . . 0.411 HD13 ' HA ' ' A' ' 50' ' ' ILE . 13.6 mm -138.04 129.34 38.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.171 -0.468 . . . . 71.45 111.084 -179.988 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 89.3 m -84.01 121.91 28.04 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.142 -0.481 . . . . 72.13 111.141 179.932 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 52' ' ' LEU . . . . . 0.725 HD12 HD12 ' A' ' 66' ' ' LEU . 27.4 mt -121.56 166.06 14.77 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.23 -0.441 . . . . 54.35 110.941 179.935 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 53' ' ' ARG . . . . . 0.508 ' C ' HD21 ' A' ' 125' ' ' LEU . 18.8 ptt180 -179.31 164.79 1.39 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.206 -0.452 . . . . 63.11 110.85 179.97 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 54' ' ' SER . . . . . 0.735 ' N ' HD21 ' A' ' 125' ' ' LEU . 1.7 m -60.65 167.8 2.52 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.164 -0.471 . . . . 54.54 110.867 -179.809 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 27.5 m -76.9 -24.72 15.42 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.119 -0.491 . . . . 61.32 111.155 179.93 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 3.2 t0 -120.5 -171.97 2.28 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.147 -0.479 . . . . 73.33 110.845 179.936 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 7.4 mmmt -116.11 -20.53 9.83 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.141 -0.481 . . . . 74.12 110.888 179.969 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 58' ' ' GLU . . . . . 0.558 ' HA ' ' C ' ' A' ' 59' ' ' PRO . 6.3 pt-20 -115.15 144.38 32.05 Favored Pre-proline 0 C--N 1.329 -0.298 0 CA-C-O 121.674 0.749 . . . . 73.43 110.831 179.959 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 59' ' ' PRO . . . . . 0.558 ' C ' ' HA ' ' A' ' 58' ' ' GLU . 53.5 Cg_endo -69.79 -13.88 12.5 Favored 'Cis proline' 0 C--N 1.342 0.192 0 C-N-CA 122.683 -1.799 . . . . 74.53 112.308 -0.017 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 60' ' ' VAL . . . . . 0.476 HG22 ' CG ' ' A' ' 129' ' ' GLN . 10.2 m -147.32 171.3 3.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-N 116.266 -0.424 . . . . 65.41 111.148 179.892 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 61' ' ' GLU . . . . . 0.462 ' O ' ' C ' ' A' ' 62' ' ' SER . 1.4 pt-20 -107.1 -18.41 13.9 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.165 -0.47 . . . . 72.42 110.914 179.967 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 62' ' ' SER . . . . . 0.738 ' HB2' HD11 ' A' ' 125' ' ' LEU . 71.1 m 32.72 90.55 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.143 -0.481 . . . . 52.12 110.915 -179.821 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 26.8 t -107.75 123.16 48.13 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.131 -0.486 . . . . 72.31 110.866 -179.802 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 64' ' ' ILE . . . . . 0.949 HD11 HG21 ' A' ' 89' ' ' VAL . 35.8 mt -134.77 135.39 53.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-N 116.125 -0.489 . . . . 74.54 111.161 179.921 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 53.1 m -104.98 114.58 28.88 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.171 -0.468 . . . . 63.55 111.078 -179.947 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 66' ' ' LEU . . . . . 0.725 HD12 HD12 ' A' ' 52' ' ' LEU . 19.9 mt -91.46 109.8 21.09 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.234 -0.439 . . . . 53.12 110.913 179.929 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 67' ' ' HIS . . . . . 0.617 ' CE1' HD21 ' A' ' 33' ' ' LEU . 0.8 OUTLIER -90.25 109.48 20.57 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.18 -0.464 . . . . 74.22 110.855 179.844 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 68' ' ' PHE . . . . . 0.672 ' HD2' HD12 ' A' ' 81' ' ' ILE . 0.0 OUTLIER -104.33 139.54 39.17 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.219 -0.446 . . . . 74.44 110.872 -179.904 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 69' ' ' ALA . . . . . 0.427 ' O ' ' CB ' ' A' ' 79' ' ' PRO . . . -121.84 129.33 52.52 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.149 -0.478 . . . . 62.44 111.085 179.942 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 70' ' ' MET . . . . . 0.521 ' CE ' HD11 ' A' ' 114' ' ' ILE . 1.0 OUTLIER -100.64 102.61 13.78 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.219 -0.446 . . . . 74.1 110.898 179.929 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -58.66 160.12 11.08 Favored Pre-proline 0 C--N 1.329 -0.283 0 CA-C-O 121.595 0.712 . . . . 71.23 111.137 -179.908 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.75 -2.2 9.76 Favored 'Trans proline' 0 C--N 1.341 0.162 0 C-N-CA 122.706 2.271 . . . . 73.43 112.333 179.992 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 73' ' ' MET . . . . . 0.954 ' HG2' HG23 ' A' ' 77' ' ' THR . 2.0 ttm -117.58 -18.28 9.77 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.232 -0.44 . . . . 71.54 110.889 179.886 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 74' ' ' TYR . . . . . 0.685 ' CD1' ' C ' ' A' ' 74' ' ' TYR . 0.0 OUTLIER -58.58 162.28 6.73 Favored Pre-proline 0 C--N 1.328 -0.354 0 CA-C-O 121.729 0.776 . . . . 71.13 110.875 -179.832 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 75' ' ' PRO . . . . . 0.552 ' HA ' ' CD2' ' A' ' 74' ' ' TYR . 53.3 Cg_endo -69.75 -4.83 8.52 Favored 'Cis proline' 0 C--N 1.341 0.156 0 C-N-CA 122.678 -1.801 . . . . 71.45 112.343 -0.087 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 76' ' ' TYR . . . . . 0.447 ' N ' ' HA ' ' A' ' 74' ' ' TYR . 0.3 OUTLIER -35.95 -60.49 0.54 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.199 -0.455 . . . . 74.43 110.877 -179.912 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 77' ' ' THR . . . . . 0.954 HG23 ' HG2' ' A' ' 73' ' ' MET . 33.6 p -88.08 -170.57 3.03 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.141 -0.481 . . . . 71.41 111.123 -179.973 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -105.01 123.1 40.93 Favored Pre-proline 0 C--N 1.33 -0.282 0 CA-C-O 121.593 0.711 . . . . 54.53 111.069 179.878 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 79' ' ' PRO . . . . . 0.634 ' HG3' HD11 ' A' ' 113' ' ' ILE . 53.8 Cg_endo -69.79 -165.46 0.16 Allowed 'Trans proline' 0 C--N 1.341 0.176 0 C-N-CA 122.696 2.264 . . . . 74.23 112.339 179.952 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 80' ' ' GLU . . . . . 0.463 ' HG3' ' N ' ' A' ' 81' ' ' ILE . 1.5 tt0 -128.0 141.7 51.44 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.19 -0.459 . . . . 73.15 110.846 -179.968 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 81' ' ' ILE . . . . . 0.672 HD12 ' HD2' ' A' ' 68' ' ' PHE . 9.1 mm -138.41 138.09 43.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.113 -0.494 . . . . 71.43 111.109 179.969 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 82' ' ' GLU . . . . . 0.492 ' HG3' ' CD ' ' A' ' 84' ' ' LYS . 4.4 pt-20 -147.7 144.69 28.5 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.144 -0.48 . . . . 63.24 110.885 179.958 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 83' ' ' PHE . . . . . 0.745 ' HD2' HG21 ' A' ' 64' ' ' ILE . 1.8 m-85 -95.16 139.82 30.95 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.156 -0.474 . . . . 71.25 110.922 -179.943 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 84' ' ' LYS . . . . . 0.492 ' CD ' ' HG3' ' A' ' 82' ' ' GLU . 10.6 mmmt -124.64 175.26 7.31 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.164 -0.471 . . . . 72.33 110.888 -179.998 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 7.3 m120 61.63 -75.01 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.223 -0.444 . . . . 65.32 110.914 179.956 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 86' ' ' VAL . . . . . 0.472 ' N ' ' O ' ' A' ' 84' ' ' LYS . 4.2 m 37.4 87.04 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.178 -0.465 . . . . 64.31 111.141 179.878 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -98.74 -69.15 0.77 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.207 -0.452 . . . . 74.34 110.889 -179.98 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 88' ' ' ASN . . . . . 0.437 ' CG ' ' HB ' ' A' ' 60' ' ' VAL . 62.3 m-80 -83.28 42.24 0.81 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.248 -0.433 . . . . 54.41 110.889 -179.978 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 89' ' ' VAL . . . . . 0.949 HG21 HD11 ' A' ' 64' ' ' ILE . 38.7 t -134.48 146.75 30.51 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.191 -0.459 . . . . 75.35 111.143 179.923 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 90' ' ' MET . . . . . . . . . . . . . 16.5 mtm -96.51 -70.99 0.69 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.144 -0.48 . . . . 74.41 110.876 179.918 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER 171.29 -31.62 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.192 -0.458 . . . . 73.0 110.92 179.993 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -55.96 -46.66 78.53 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.157 -0.474 . . . . 63.34 110.879 -179.776 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 93' ' ' GLN . . . . . 0.751 ' NE2' ' CE2' ' A' ' 128' ' ' PHE . 11.6 pt20 -70.56 -40.75 73.16 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.155 -0.475 . . . . 74.54 110.935 179.991 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 94' ' ' LEU . . . . . 0.699 ' HG ' HG11 ' A' ' 89' ' ' VAL . 54.8 mt -57.81 -48.98 78.15 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.159 -0.473 . . . . 65.22 110.914 -179.963 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -65.86 -33.83 76.74 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.151 -0.477 . . . . 64.12 110.879 179.949 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 96' ' ' MET . . . . . 0.485 ' HG2' ' N ' ' A' ' 97' ' ' LEU . 0.0 OUTLIER -59.73 -36.49 76.68 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.213 -0.448 . . . . 75.23 110.867 179.98 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 97' ' ' LEU . . . . . 0.558 HD13 HG22 ' A' ' 121' ' ' THR . 17.0 mt -69.01 -41.68 77.42 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.194 -0.457 . . . . 73.14 110.925 -179.962 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -55.04 -36.65 65.76 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.159 -0.473 . . . . 73.44 110.895 179.864 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -67.46 -43.38 81.2 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.226 -0.443 . . . . 55.35 110.883 -179.948 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 100' ' ' GLU . . . . . 0.4 ' O ' HD12 ' A' ' 104' ' ' ILE . 1.9 mp0 -71.92 -25.22 61.82 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.119 -0.491 . . . . 72.14 110.87 -179.953 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 101' ' ' PHE . . . . . 0.645 ' CD2' HD11 ' A' ' 117' ' ' ILE . 10.8 m-30 -59.51 -26.84 65.64 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.188 -0.46 . . . . 71.05 110.897 -179.944 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 102' ' ' LYS . . . . . 0.428 ' HE2' ' C ' ' A' ' 102' ' ' LYS . 0.2 OUTLIER -72.18 -41.72 66.69 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.141 -0.482 . . . . 74.13 110.875 179.967 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.39 -40.48 73.92 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.244 -0.434 . . . . 72.25 110.869 179.895 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 104' ' ' ILE . . . . . 0.661 HD11 ' CD2' ' A' ' 120' ' ' PHE . 4.0 mt -62.46 -47.11 94.55 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-N 116.245 -0.434 . . . . 74.12 111.093 179.881 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 105' ' ' HIS . . . . . 0.48 ' CE1' ' HG3' ' A' ' 109' ' ' ARG . 16.8 t60 -62.97 -41.0 99.4 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.184 -0.462 . . . . 75.43 110.865 179.91 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 1.1 t-20 -59.51 -38.25 80.46 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.205 -0.452 . . . . 60.54 110.927 -179.945 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 107' ' ' THR . . . . . 0.405 HG22 ' O ' ' A' ' 104' ' ' ILE . 6.8 t -83.21 -27.95 29.62 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.155 -0.475 . . . . 75.43 111.096 179.995 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 1.6 m -112.89 46.7 1.18 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.278 -0.419 . . . . 72.11 110.85 -179.837 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 109' ' ' ARG . . . . . 0.48 ' HG3' ' CE1' ' A' ' 105' ' ' HIS . 2.7 ttp-105 -97.89 84.5 3.34 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.143 -0.481 . . . . 72.12 110.873 -179.976 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 110' ' ' GLY . . . . . 0.421 ' HA2' ' CG ' ' A' ' 75' ' ' PRO . . . 137.99 1.3 2.35 Favored Glycine 0 N--CA 1.452 -0.296 0 C-N-CA 120.768 -0.73 . . . . 71.53 112.488 -179.981 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 111' ' ' GLN . . . . . 0.505 ' O ' ' CG ' ' A' ' 112' ' ' GLU . 11.4 mm-40 -127.64 -75.11 0.57 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.732 0.301 . . . . 75.45 110.934 -179.923 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 112' ' ' GLU . . . . . 0.505 ' CG ' ' O ' ' A' ' 111' ' ' GLN . 31.0 mt-10 -163.6 141.74 7.68 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.223 -0.444 . . . . 63.42 110.875 -179.945 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 113' ' ' ILE . . . . . 0.634 HD11 ' HG3' ' A' ' 79' ' ' PRO . 21.7 pt -128.34 -10.93 3.4 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.118 -0.492 . . . . 71.15 111.16 179.963 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 114' ' ' ILE . . . . . 0.759 ' O ' HG23 ' A' ' 118' ' ' THR . 25.5 mm -66.87 -44.72 88.75 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.148 -0.478 . . . . 71.43 111.149 179.846 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 115' ' ' PHE . . . . . 0.93 ' CE1' HD13 ' A' ' 25' ' ' ILE . 11.3 t80 -72.55 -37.04 68.37 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.141 -0.481 . . . . 73.43 110.873 179.976 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 6.7 mm-40 -67.39 -45.51 76.0 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.141 -0.481 . . . . 73.55 110.901 -179.924 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 117' ' ' ILE . . . . . 0.645 HD11 ' CD2' ' A' ' 101' ' ' PHE . 1.0 OUTLIER -66.91 -42.12 88.48 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.101 -0.499 . . . . 73.34 111.137 179.97 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 118' ' ' THR . . . . . 0.759 HG23 ' O ' ' A' ' 114' ' ' ILE . 79.8 p -68.21 -40.16 82.19 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.172 -0.467 . . . . 70.51 111.132 179.953 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 4.5 t -68.03 -44.03 77.39 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.226 -0.443 . . . . 71.23 110.857 -179.82 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 120' ' ' PHE . . . . . 0.661 ' CD2' HD11 ' A' ' 104' ' ' ILE . 0.3 OUTLIER -60.5 -46.23 90.9 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.111 -0.495 . . . . 63.4 110.868 -179.928 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 121' ' ' THR . . . . . 0.713 HG21 HD11 ' A' ' 66' ' ' LEU . 44.4 p -69.34 -39.09 78.37 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.183 -0.462 . . . . 72.0 111.132 -179.921 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 2.4 tt0 -67.24 -39.68 86.21 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.251 -0.431 . . . . 75.3 110.946 179.958 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 123' ' ' GLU . . . . . 0.502 ' HG3' ' N ' ' A' ' 124' ' ' LYS . 10.1 pt-20 -73.83 -40.47 63.31 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.167 -0.47 . . . . 61.43 110.889 -179.946 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 124' ' ' LYS . . . . . 0.502 ' N ' ' HG3' ' A' ' 123' ' ' GLU . 2.0 mmpt? -78.73 -19.52 52.14 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.174 -0.466 . . . . 63.54 110.894 179.949 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 125' ' ' LEU . . . . . 0.738 HD11 ' HB2' ' A' ' 62' ' ' SER . 1.9 tp -69.49 -52.45 26.46 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.255 -0.429 . . . . 54.53 110.941 179.863 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 10.7 t70 -69.51 -36.86 76.84 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.199 -0.455 . . . . 63.21 110.826 179.854 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 127' ' ' GLU . . . . . 0.471 ' HG3' ' N ' ' A' ' 128' ' ' PHE . 0.4 OUTLIER -59.73 -36.22 76.14 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.221 -0.445 . . . . 71.14 110.858 -179.865 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 128' ' ' PHE . . . . . 0.751 ' CE2' ' NE2' ' A' ' 93' ' ' GLN . 0.0 OUTLIER -78.89 -42.26 27.69 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.15 -0.477 . . . . 62.13 110.894 -179.927 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 129' ' ' GLN . . . . . 0.476 ' CG ' HG22 ' A' ' 60' ' ' VAL . 1.3 tm0? -65.52 -29.52 70.17 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.165 -0.47 . . . . 70.41 110.908 -179.963 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 130' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -72.71 -35.36 67.58 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.176 -0.466 . . . . 63.01 110.887 -179.938 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 131' ' ' VAL . . . . . 0.425 ' O ' HG12 ' A' ' 131' ' ' VAL . 3.6 t -123.09 30.8 2.16 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.17 -0.468 . . . . 63.43 111.143 179.882 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 132' ' ' VAL . . . . . 0.582 HG22 ' H ' ' A' ' 134' ' ' THR . 3.6 p -59.55 131.41 24.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.187 -0.46 . . . . 44.54 111.123 179.9 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 133' ' ' ASN . . . . . . . . . . . . . 42.1 p-10 -103.46 43.15 1.1 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.156 -0.475 . . . . 73.02 110.904 179.96 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 134' ' ' THR . . . . . 0.582 ' H ' HG22 ' A' ' 132' ' ' VAL . 11.1 m -155.9 103.93 2.27 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.146 -0.479 . . . . 72.53 111.151 -179.997 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 2.7 tt0 -89.83 98.93 12.05 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.254 -0.43 . . . . 64.5 110.926 179.979 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 29.1 p -167.64 179.8 4.68 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.177 -0.465 . . . . 62.52 110.87 -179.819 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 137' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -161.68 163.15 29.97 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.165 -0.47 . . . . 64.24 110.936 -179.991 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 1.1 pt-20 . . . . . 0 C--N 1.329 -0.299 0 CA-C-N 116.2 -0.455 . . . . 72.14 110.905 179.945 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 4.2 mmt . . . . . 0 C--O 1.231 0.089 0 CA-C-O 120.826 0.346 . . . . 63.34 110.86 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 25.0 p 52.87 -175.14 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.228 -0.442 . . . . 60.43 110.872 -179.801 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER 61.37 112.13 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.135 -0.484 . . . . 72.34 110.929 180.0 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 29.1 t -62.72 96.63 0.09 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.155 -0.475 . . . . 74.32 110.875 -179.931 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 1.6 t-80 -144.71 36.54 1.17 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.17 -0.468 . . . . 72.52 110.87 -179.993 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER 56.17 108.5 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.229 -0.441 . . . . 73.4 110.899 -179.938 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 7' ' ' THR . . . . . 0.466 HG23 ' HB3' ' A' ' 9' ' ' ASP . 5.9 t -166.6 172.28 10.85 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.192 -0.458 . . . . 73.33 111.131 179.894 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.618 HD13 ' O ' ' A' ' 72' ' ' PRO . 20.5 mt -64.72 -24.88 67.71 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.18 -0.464 . . . . 72.4 110.91 179.977 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 9' ' ' ASP . . . . . 0.466 ' HB3' HG23 ' A' ' 7' ' ' THR . 9.3 t0 -55.13 -34.97 64.2 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.202 -0.454 . . . . 74.3 110.862 179.856 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 94.2 mm-40 -63.59 -35.78 81.63 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.223 -0.444 . . . . 73.04 110.859 -179.891 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 21.6 m-85 -65.77 -24.97 67.05 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.236 -0.438 . . . . 74.44 110.897 -179.853 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -58.93 -41.05 86.43 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.167 -0.47 . . . . 74.01 110.893 -179.898 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 2.0 mm-40 -59.65 -45.94 90.51 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.142 -0.481 . . . . 72.4 110.904 -179.964 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 14' ' ' ILE . . . . . 0.528 HG22 ' OE2' ' A' ' 18' ' ' GLU . 4.2 mp -68.03 -41.08 84.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.138 -0.483 . . . . 70.33 111.145 179.955 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 15' ' ' GLN . . . . . 0.446 ' HB3' HG21 ' A' ' 46' ' ' ILE . 57.1 mt-30 -62.79 -48.06 80.77 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.192 -0.458 . . . . 72.34 110.944 179.922 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -61.84 -45.1 95.28 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.152 -0.477 . . . . 65.1 110.887 -179.981 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -57.84 -33.82 69.05 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.215 -0.448 . . . . 73.44 110.883 -179.907 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 18' ' ' GLU . . . . . 0.528 ' OE2' HG22 ' A' ' 14' ' ' ILE . 2.9 mt-10 -64.03 -38.62 91.72 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.197 -0.456 . . . . 64.34 110.887 -179.96 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 7.8 mp -66.06 -51.52 57.4 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.116 -0.493 . . . . 75.43 110.95 179.986 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 1.5 pt-20 -68.91 -33.77 74.3 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.145 -0.479 . . . . 70.11 110.869 179.948 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -65.98 -50.04 65.71 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.21 -0.45 . . . . 43.2 111.122 179.896 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 22' ' ' ILE . . . . . 0.781 ' HA ' HD12 ' A' ' 25' ' ' ILE . 0.7 OUTLIER -72.19 -34.16 48.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.22 -0.446 . . . . 60.1 111.166 179.975 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 23' ' ' ARG . . . . . 0.428 ' NH2' ' NH2' ' A' ' 36' ' ' ARG . 0.0 OUTLIER -52.39 -36.19 53.46 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.164 -0.471 . . . . 73.3 110.899 179.931 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -67.27 -30.23 70.06 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.165 -0.47 . . . . 52.34 110.799 -179.777 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 25' ' ' ILE . . . . . 0.919 HD13 ' CE1' ' A' ' 115' ' ' PHE . 4.3 mt -83.31 -45.21 18.8 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.141 -0.481 . . . . 61.42 111.112 179.976 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 25.7 m-85 -108.5 42.25 1.43 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.168 -0.469 . . . . 65.23 110.923 -179.96 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER -40.12 -59.07 1.32 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.128 -0.487 . . . . 75.2 110.887 179.884 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -86.14 -20.89 27.97 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.25 -0.432 . . . . 64.32 110.834 179.99 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 42.4 m-20 -96.29 34.79 1.54 Allowed 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.204 -0.453 . . . . 72.35 110.864 -179.996 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 16.1 t80 -118.67 138.48 52.59 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.215 -0.448 . . . . 74.31 110.899 -179.928 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 94.7 m -117.66 134.11 55.24 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.145 -0.48 . . . . 74.1 111.116 -179.894 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -101.23 118.51 37.13 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.249 -0.432 . . . . 74.22 110.901 179.923 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.981 HD21 HG12 ' A' ' 47' ' ' ILE . 0.4 OUTLIER -125.69 -5.68 6.95 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.235 -0.438 . . . . 74.31 110.916 -179.94 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 34' ' ' THR . . . . . 0.609 ' N ' HD23 ' A' ' 33' ' ' LEU . 0.2 OUTLIER -59.72 -158.72 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.171 -0.468 . . . . 64.53 111.141 179.914 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 35' ' ' LYS . . . . . 0.6 ' H ' HG22 ' A' ' 34' ' ' THR . 0.4 OUTLIER -106.88 23.14 14.84 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.183 -0.462 . . . . 64.33 110.905 179.912 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 36' ' ' ARG . . . . . 0.428 ' NH2' ' NH2' ' A' ' 23' ' ' ARG . 0.0 OUTLIER -39.07 -71.08 0.09 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.205 -0.452 . . . . 72.31 110.898 179.99 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 37' ' ' LYS . . . . . 0.467 ' O ' ' CB ' ' A' ' 38' ' ' SER . 0.0 OUTLIER -175.45 125.81 0.24 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.187 -0.46 . . . . 54.54 110.847 179.96 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 38' ' ' SER . . . . . 0.467 ' CB ' ' O ' ' A' ' 37' ' ' LYS . 1.0 OUTLIER 162.51 -69.94 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.254 -0.43 . . . . 43.01 110.823 -179.945 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 70.9 m -79.61 -171.41 2.79 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.163 -0.471 . . . . 71.22 110.867 -179.823 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 40' ' ' TRP . . . . . . . . . . . . . 75.7 t-105 -104.2 -35.59 7.96 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.14 -0.482 . . . . 75.35 110.91 179.984 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 33.2 t70 -136.63 138.44 41.16 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.272 -0.422 . . . . 63.42 110.879 179.946 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 42' ' ' LYS . . . . . 0.543 ' CB ' ' HD3' ' A' ' 44' ' ' PRO . 0.1 OUTLIER -145.22 -53.01 0.28 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.204 -0.453 . . . . 73.25 110.886 -179.975 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 43' ' ' GLN . . . . . 0.57 ' N ' ' CD ' ' A' ' 44' ' ' PRO . 12.3 mm100 56.73 46.54 2.24 Favored Pre-proline 0 C--N 1.329 -0.311 0 CA-C-O 121.619 0.723 . . . . 75.21 110.902 179.966 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 44' ' ' PRO . . . . . 0.57 ' CD ' ' N ' ' A' ' 43' ' ' GLN . 53.7 Cg_endo -69.79 -161.55 0.08 OUTLIER 'Trans proline' 0 C--N 1.341 0.164 0 C-N-CA 122.702 2.268 . . . . 74.01 112.307 -179.972 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 45' ' ' GLN . . . . . 0.733 ' HG2' HG23 ' A' ' 47' ' ' ILE . 26.3 pt20 -159.31 36.05 0.2 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.216 -0.447 . . . . 70.2 110.905 -179.975 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 46' ' ' ILE . . . . . 0.616 HG22 ' O ' ' A' ' 45' ' ' GLN . 0.1 OUTLIER 84.72 -1.27 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 116.235 -0.439 . . . . 62.11 111.144 179.963 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 47' ' ' ILE . . . . . 0.981 HG12 HD21 ' A' ' 33' ' ' LEU . 0.3 OUTLIER -62.61 146.83 12.27 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.167 -0.47 . . . . 73.21 111.137 179.846 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 48' ' ' PHE . . . . . 0.835 ' HA ' HD22 ' A' ' 33' ' ' LEU . 3.6 p90 -151.05 153.8 35.78 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.174 -0.466 . . . . 72.25 110.876 179.943 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 49' ' ' GLU . . . . . 0.705 ' HG3' HD13 ' A' ' 33' ' ' LEU . 10.7 mt-10 -108.52 143.85 36.98 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.117 -0.492 . . . . 73.14 110.864 -179.88 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 30.8 mm -125.94 131.74 71.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.176 -0.466 . . . . 73.2 111.155 179.95 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 85.2 m -85.1 125.6 32.91 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.187 -0.46 . . . . 72.4 111.137 179.975 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 52' ' ' LEU . . . . . 0.873 HD12 HD12 ' A' ' 66' ' ' LEU . 19.9 mt -122.52 164.89 17.29 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.184 -0.462 . . . . 62.01 110.889 179.988 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER 179.11 172.87 0.81 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.205 -0.452 . . . . 74.23 110.861 179.954 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -62.91 170.96 2.38 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.2 -0.454 . . . . 70.41 110.843 -179.799 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 21.8 m -84.85 -24.2 7.21 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 116.14 -0.482 . . . . 55.11 111.143 179.964 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -117.83 -172.72 2.3 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.176 -0.466 . . . . 62.41 110.868 179.92 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -115.19 -12.58 11.85 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.222 -0.444 . . . . 74.34 110.914 -179.972 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 58' ' ' GLU . . . . . 0.545 ' HA ' ' C ' ' A' ' 59' ' ' PRO . 6.3 pm0 -126.79 149.45 68.67 Favored Pre-proline 0 C--N 1.33 -0.257 0 CA-C-O 121.674 0.75 . . . . 61.14 110.879 179.929 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 59' ' ' PRO . . . . . 0.545 ' C ' ' HA ' ' A' ' 58' ' ' GLU . 53.3 Cg_endo -69.8 -8.83 10.78 Favored 'Cis proline' 0 C--N 1.342 0.219 0 C-N-CA 122.674 -1.802 . . . . 72.23 112.303 0.076 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 60' ' ' VAL . . . . . 0.472 HG22 ' CG ' ' A' ' 129' ' ' GLN . 22.3 m -142.51 165.26 16.8 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.197 -0.456 . . . . 41.05 111.093 179.923 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 61' ' ' GLU . . . . . 0.405 ' O ' ' O ' ' A' ' 62' ' ' SER . 7.5 tt0 -93.58 -25.05 17.71 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.143 -0.481 . . . . 74.14 110.848 -179.918 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 62' ' ' SER . . . . . 0.405 ' O ' ' O ' ' A' ' 61' ' ' GLU . 0.5 OUTLIER 41.63 94.15 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.185 -0.461 . . . . 74.2 110.836 -179.79 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 9.2 p -116.57 122.74 45.52 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.145 -0.48 . . . . 72.54 110.874 -179.854 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 64' ' ' ILE . . . . . 1.069 HD11 HG21 ' A' ' 89' ' ' VAL . 21.1 mt -137.89 138.61 43.79 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.132 -0.485 . . . . 60.01 111.097 179.992 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 20.1 m -104.49 113.87 27.72 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.2 -0.455 . . . . 71.3 111.126 179.939 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 66' ' ' LEU . . . . . 0.873 HD12 HD12 ' A' ' 52' ' ' LEU . 6.5 mt -99.17 112.19 24.39 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.174 -0.466 . . . . 71.23 110.927 179.964 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -109.6 114.32 27.84 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.217 -0.447 . . . . 75.31 110.826 179.897 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 68' ' ' PHE . . . . . 0.583 ' CE1' HG23 ' A' ' 114' ' ' ILE . 0.0 OUTLIER -103.31 140.43 37.42 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.213 -0.448 . . . . 63.02 110.865 -179.928 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -117.28 131.33 56.84 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.128 -0.487 . . . . 74.25 111.114 179.944 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 70' ' ' MET . . . . . 0.503 ' SD ' ' CZ ' ' A' ' 74' ' ' TYR . 3.1 mmt -93.49 98.82 11.44 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.224 -0.443 . . . . 73.01 110.858 179.998 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -55.49 163.49 1.84 Allowed Pre-proline 0 C--N 1.33 -0.262 0 CA-C-O 121.57 0.7 . . . . 54.43 111.125 -179.923 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 72' ' ' PRO . . . . . 0.618 ' O ' HD13 ' A' ' 8' ' ' LEU . 53.9 Cg_endo -69.77 3.14 2.95 Favored 'Trans proline' 0 C--N 1.341 0.168 0 C-N-CA 122.668 2.245 . . . . 60.23 112.348 179.935 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 73' ' ' MET . . . . . 0.509 ' HB3' HG23 ' A' ' 77' ' ' THR . 0.1 OUTLIER -126.31 -22.99 3.91 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.21 -0.45 . . . . 55.4 110.868 179.927 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 74' ' ' TYR . . . . . 0.643 ' CD1' ' C ' ' A' ' 74' ' ' TYR . 0.0 OUTLIER -49.56 150.04 3.77 Favored Pre-proline 0 C--N 1.329 -0.32 0 CA-C-O 121.67 0.748 . . . . 61.32 110.959 -179.872 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 75' ' ' PRO . . . . . 0.551 ' C ' ' HA ' ' A' ' 74' ' ' TYR . 53.8 Cg_endo -69.74 -14.06 12.42 Favored 'Cis proline' 0 C--O 1.231 0.157 0 C-N-CA 122.706 -1.789 . . . . 75.31 112.32 -0.006 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 76' ' ' TYR . . . . . 0.507 ' CB ' ' O ' ' A' ' 73' ' ' MET . 9.0 t80 -33.6 -45.75 0.18 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.239 -0.437 . . . . 75.11 110.949 -179.855 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 77' ' ' THR . . . . . 0.509 HG23 ' HB3' ' A' ' 73' ' ' MET . 45.6 p -108.79 164.86 12.01 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.147 -0.479 . . . . 54.41 111.165 -179.997 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -79.84 125.96 81.07 Favored Pre-proline 0 C--N 1.329 -0.292 0 CA-C-O 121.579 0.704 . . . . 51.33 111.119 179.839 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 79' ' ' PRO . . . . . 0.767 ' HG3' HD11 ' A' ' 113' ' ' ILE . 53.8 Cg_endo -69.74 176.43 6.76 Favored 'Trans proline' 0 C--N 1.341 0.147 0 C-N-CA 122.673 2.248 . . . . 72.12 112.343 -179.961 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -119.04 135.13 54.79 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.248 -0.433 . . . . 75.12 110.877 -179.983 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 81' ' ' ILE . . . . . 0.61 HD13 HD13 ' A' ' 117' ' ' ILE . 13.7 mt -143.27 151.29 17.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.156 -0.475 . . . . 71.04 111.135 179.949 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 82' ' ' GLU . . . . . 0.501 ' HG3' ' CD ' ' A' ' 84' ' ' LYS . 11.2 pt-20 -148.99 147.94 29.17 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.144 -0.48 . . . . 74.44 110.868 179.996 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 83' ' ' PHE . . . . . 0.451 ' CE1' HD21 ' A' ' 66' ' ' LEU . 64.6 m-85 -90.63 140.27 29.92 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.16 -0.473 . . . . 72.22 110.897 -179.937 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 84' ' ' LYS . . . . . 0.501 ' CD ' ' HG3' ' A' ' 82' ' ' GLU . 8.0 mmmt -126.4 165.58 18.78 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.201 -0.454 . . . . 73.02 110.877 179.964 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 85' ' ' ASN . . . . . 0.465 ' O ' ' C ' ' A' ' 86' ' ' VAL . 8.2 m120 63.55 -71.82 0.06 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.235 -0.439 . . . . 73.1 110.893 179.97 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 86' ' ' VAL . . . . . 0.687 ' O ' HG23 ' A' ' 86' ' ' VAL . 28.0 m 30.81 91.21 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.156 -0.475 . . . . 73.22 111.106 179.924 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -94.28 -85.25 0.3 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.117 -0.492 . . . . 64.24 110.881 -179.988 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 88' ' ' ASN . . . . . 0.439 ' CG ' HG21 ' A' ' 60' ' ' VAL . 1.0 OUTLIER -45.52 -38.14 6.04 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.207 -0.451 . . . . 74.23 110.923 -179.933 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 89' ' ' VAL . . . . . 1.069 HG21 HD11 ' A' ' 64' ' ' ILE . 3.4 t -61.91 142.92 15.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.134 -0.485 . . . . 74.23 111.103 179.905 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 90' ' ' MET . . . . . . . . . . . . . 7.2 mtm -95.15 -56.46 2.72 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.134 -0.485 . . . . 74.53 110.899 179.91 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER 170.21 -41.87 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.197 -0.456 . . . . 64.53 110.9 179.98 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -54.27 -38.66 66.09 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.188 -0.46 . . . . 55.33 110.87 -179.781 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 93' ' ' GLN . . . . . 0.646 ' CD ' ' CD1' ' A' ' 128' ' ' PHE . 0.0 OUTLIER -68.25 -43.22 78.36 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.151 -0.477 . . . . 70.34 110.906 -179.977 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 62.8 mt -60.52 -48.34 82.21 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.228 -0.442 . . . . 72.41 110.912 -179.957 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -63.38 -34.14 77.07 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.163 -0.471 . . . . 64.12 110.934 179.934 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 96' ' ' MET . . . . . . . . . . . . . 35.3 ttp -60.65 -40.36 91.72 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.175 -0.466 . . . . 73.55 110.832 179.982 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 97' ' ' LEU . . . . . 0.791 HD22 HG22 ' A' ' 121' ' ' THR . 81.2 mt -65.91 -39.88 90.98 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.247 -0.433 . . . . 72.11 110.896 -179.997 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 11.3 mmtm -54.69 -47.19 73.98 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.213 -0.449 . . . . 73.03 110.892 179.831 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 15.7 m -60.3 -36.75 78.59 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.235 -0.438 . . . . 45.32 110.87 -179.888 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 78.2 mm-40 -71.13 -30.21 66.21 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.16 -0.473 . . . . 71.22 110.885 -179.951 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 101' ' ' PHE . . . . . 0.864 ' CD2' HD11 ' A' ' 117' ' ' ILE . 9.0 m-30 -59.33 -37.52 78.01 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.173 -0.467 . . . . 72.44 110.877 -179.98 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -64.8 -40.36 95.09 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.201 -0.454 . . . . 41.2 110.93 179.986 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 25.8 ttpp -70.16 -43.39 70.94 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.197 -0.456 . . . . 75.55 110.88 179.859 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 104' ' ' ILE . . . . . 0.408 ' O ' ' N ' ' A' ' 108' ' ' SER . 4.5 mt -62.14 -47.53 92.68 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 116.232 -0.44 . . . . 62.45 111.128 179.903 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 105' ' ' HIS . . . . . . . . . . . . . 3.2 t60 -62.98 -43.47 98.71 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.187 -0.46 . . . . 73.21 110.839 179.889 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -57.38 -40.26 77.79 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.229 -0.441 . . . . 72.34 110.92 -179.997 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 14.3 t -89.14 -21.22 23.45 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.167 -0.469 . . . . 64.5 111.146 -179.968 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 108' ' ' SER . . . . . 0.594 ' CB ' HG22 ' A' ' 113' ' ' ILE . 60.0 m -109.54 31.16 6.0 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.229 -0.441 . . . . 71.54 110.838 -179.846 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 6.6 ttp180 -79.5 88.1 5.08 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.14 -0.482 . . . . 62.11 110.855 -179.92 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 113.31 44.82 0.77 Allowed Glycine 0 N--CA 1.451 -0.339 0 C-N-CA 120.747 -0.74 . . . . 50.03 112.473 -179.981 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 111' ' ' GLN . . . . . . . . . . . . . 21.5 pt20 -174.77 28.31 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.775 0.321 . . . . 74.42 110.924 -179.886 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER 70.97 140.45 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.198 -0.455 . . . . 71.54 110.935 -179.901 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 113' ' ' ILE . . . . . 0.767 HD11 ' HG3' ' A' ' 79' ' ' PRO . 34.1 pt -134.78 0.1 1.15 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.167 -0.469 . . . . 72.23 111.158 179.987 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 114' ' ' ILE . . . . . 0.737 ' O ' HG23 ' A' ' 118' ' ' THR . 18.8 mm -63.29 -45.88 97.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.148 -0.478 . . . . 74.22 111.158 179.872 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 115' ' ' PHE . . . . . 0.919 ' CE1' HD13 ' A' ' 25' ' ' ILE . 22.2 t80 -72.66 -32.03 65.53 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.114 -0.494 . . . . 75.43 110.835 179.964 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 20.5 mm-40 -67.91 -45.97 72.9 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.187 -0.46 . . . . 74.03 110.915 -179.967 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 117' ' ' ILE . . . . . 0.864 HD11 ' CD2' ' A' ' 101' ' ' PHE . 0.9 OUTLIER -66.39 -43.7 91.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.194 -0.457 . . . . 71.21 111.105 179.989 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 118' ' ' THR . . . . . 0.737 HG23 ' O ' ' A' ' 114' ' ' ILE . 43.9 p -67.95 -41.78 81.95 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.145 -0.48 . . . . 53.23 111.122 179.979 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 43.2 t -68.06 -43.18 79.24 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.242 -0.435 . . . . 73.05 110.833 -179.839 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 3.7 t80 -67.83 -48.63 65.66 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.179 -0.464 . . . . 63.45 110.894 -179.965 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 121' ' ' THR . . . . . 0.791 HG22 HD22 ' A' ' 97' ' ' LEU . 29.0 p -61.88 -39.56 92.38 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.18 -0.464 . . . . 71.22 111.128 -179.919 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -66.68 -50.81 61.67 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.216 -0.447 . . . . 54.25 110.883 -179.968 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 123' ' ' GLU . . . . . 0.417 ' HG3' ' N ' ' A' ' 124' ' ' LYS . 5.5 pt-20 -63.01 -38.17 90.12 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.221 -0.445 . . . . 72.23 110.88 -179.96 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 124' ' ' LYS . . . . . 0.434 ' HA ' ' CE ' ' A' ' 124' ' ' LYS . 0.0 OUTLIER -75.82 -35.08 60.13 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.182 -0.463 . . . . 63.02 110.895 179.996 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 125' ' ' LEU . . . . . 0.69 ' C ' HD23 ' A' ' 125' ' ' LEU . 4.2 tt -70.57 -50.85 33.02 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.201 -0.454 . . . . 74.53 110.927 179.88 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 126' ' ' ASP . . . . . 0.81 ' OD1' HG22 ' A' ' 134' ' ' THR . 0.0 OUTLIER -57.56 -46.58 83.78 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.147 -0.478 . . . . 74.33 110.827 179.888 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 127' ' ' GLU . . . . . 0.472 ' HB2' ' N ' ' A' ' 133' ' ' ASN . 0.9 OUTLIER -65.08 -28.15 69.26 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.221 -0.445 . . . . 74.41 110.872 -179.896 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 128' ' ' PHE . . . . . 0.646 ' CD1' ' CD ' ' A' ' 93' ' ' GLN . 0.2 OUTLIER -73.5 -46.78 45.92 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.155 -0.475 . . . . 75.41 110.878 -179.908 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 129' ' ' GLN . . . . . 0.472 ' CG ' HG22 ' A' ' 60' ' ' VAL . 1.5 tm0? -60.17 -39.25 85.8 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.183 -0.462 . . . . 74.14 110.95 -179.956 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 130' ' ' ASN . . . . . 0.822 ' O ' HG13 ' A' ' 131' ' ' VAL . 2.3 m-20 -71.25 -79.73 0.06 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.186 -0.461 . . . . 65.43 110.916 -179.978 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 131' ' ' VAL . . . . . 0.822 HG13 ' O ' ' A' ' 130' ' ' ASN . 0.0 OUTLIER -173.82 -48.65 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.176 -0.465 . . . . 53.34 111.151 179.948 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 132' ' ' VAL . . . . . 0.402 HG23 ' C ' ' A' ' 131' ' ' VAL . 91.8 t -157.29 129.22 0.99 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.206 -0.452 . . . . 73.44 111.174 179.895 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 133' ' ' ASN . . . . . 0.472 ' N ' ' HB2' ' A' ' 127' ' ' GLU . 14.9 m-20 50.31 -179.57 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.17 -0.468 . . . . 72.53 110.855 -179.98 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 134' ' ' THR . . . . . 0.81 HG22 ' OD1' ' A' ' 126' ' ' ASP . 60.4 p -76.21 -179.19 4.89 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.134 -0.484 . . . . 71.12 111.131 -179.952 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 4.6 tp-100 -158.6 -39.41 0.06 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.211 -0.45 . . . . 72.35 110.91 -179.997 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 18.1 t -99.54 -42.03 7.1 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.217 -0.447 . . . . 74.22 110.863 -179.807 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 137' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER 71.54 -69.37 0.19 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.124 -0.489 . . . . 63.44 110.924 179.978 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--N 1.329 -0.286 0 CA-C-N 116.204 -0.453 . . . . 74.13 110.876 179.951 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.232 0.136 0 CA-C-O 120.754 0.311 . . . . 60.23 110.919 . . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 173.54 108.36 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.265 -0.425 . . . . 55.12 110.884 -179.771 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 3' ' ' LEU . . . . . 0.695 ' H ' HD23 ' A' ' 3' ' ' LEU . 1.2 pt? -90.16 177.82 6.33 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.145 -0.48 . . . . 75.25 110.959 179.958 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 13.3 p -102.16 92.62 4.83 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.188 -0.46 . . . . 43.45 110.879 -179.896 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 17.0 t-80 -161.2 172.94 15.83 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.121 -0.49 . . . . 64.41 110.863 -179.966 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -99.37 44.37 1.03 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.223 -0.444 . . . . 74.02 110.913 -179.962 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 7' ' ' THR . . . . . 0.903 HG23 ' H ' ' A' ' 9' ' ' ASP . 14.2 t -95.07 -167.62 1.66 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.184 -0.462 . . . . 74.31 111.109 179.979 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 29.0 mt -69.07 -24.64 64.18 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.188 -0.46 . . . . 62.02 110.925 179.913 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 9' ' ' ASP . . . . . 0.903 ' H ' HG23 ' A' ' 7' ' ' THR . 0.3 OUTLIER -55.2 -30.18 59.42 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.201 -0.454 . . . . 73.1 110.835 179.867 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 77.5 mm-40 -67.2 -35.75 80.28 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.232 -0.44 . . . . 74.52 110.916 -179.852 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 11' ' ' TYR . . . . . 0.49 ' CD1' ' HD2' ' A' ' 75' ' ' PRO . 26.9 m-85 -66.6 -28.1 68.24 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.158 -0.474 . . . . 72.34 110.875 -179.876 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -59.3 -39.24 82.39 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.131 -0.486 . . . . 73.3 110.923 -179.865 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -59.04 -44.25 91.76 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.163 -0.471 . . . . 63.14 110.894 179.976 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 14' ' ' ILE . . . . . 0.618 HG22 ' OE1' ' A' ' 18' ' ' GLU . 3.8 mp -66.94 -48.01 80.77 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.156 -0.475 . . . . 63.01 111.108 179.976 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 57.6 mt-30 -57.85 -46.55 84.63 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.231 -0.44 . . . . 73.11 110.927 179.934 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 6.7 t -58.6 -44.93 90.03 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.226 -0.443 . . . . 71.12 110.91 -179.964 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 1.1 t30 -59.03 -33.88 71.27 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.152 -0.476 . . . . 74.31 110.918 -179.912 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 18' ' ' GLU . . . . . 0.618 ' OE1' HG22 ' A' ' 14' ' ' ILE . 2.2 mp0 -64.35 -39.09 93.2 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.174 -0.466 . . . . 73.4 110.91 179.961 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.846 HD11 HG13 ' A' ' 46' ' ' ILE . 5.7 mt -63.56 -51.27 66.12 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.165 -0.471 . . . . 71.33 110.92 -179.971 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 6.6 pt-20 -68.59 -35.02 76.78 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.163 -0.471 . . . . 73.5 110.894 179.914 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -62.7 -50.67 70.2 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.161 -0.472 . . . . 71.42 111.072 179.962 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 22' ' ' ILE . . . . . 0.796 ' HA ' HD12 ' A' ' 25' ' ' ILE . 0.6 OUTLIER -74.72 -34.98 35.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.234 -0.439 . . . . 64.24 111.163 179.96 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 16.4 mtt180 -52.6 -35.78 54.95 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.151 -0.477 . . . . 74.2 110.846 179.95 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -67.51 -31.2 71.16 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.212 -0.449 . . . . 60.24 110.88 -179.798 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 25' ' ' ILE . . . . . 0.796 HD12 ' HA ' ' A' ' 22' ' ' ILE . 4.8 mt -80.32 -45.22 22.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.114 -0.494 . . . . 71.55 111.102 -179.997 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 17.5 m-85 -109.84 44.02 1.26 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.17 -0.468 . . . . 74.23 110.925 -179.975 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 1.3 mtm -43.49 -40.81 4.04 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.124 -0.489 . . . . 73.41 110.843 179.929 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -104.72 -20.12 13.72 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.275 -0.42 . . . . 61.43 110.863 179.963 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 3.6 m-20 -95.17 22.9 6.21 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.238 -0.437 . . . . 75.13 110.852 179.996 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 30' ' ' PHE . . . . . 0.577 ' CD1' ' C ' ' A' ' 30' ' ' PHE . 0.1 OUTLIER -114.52 143.78 44.42 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.231 -0.441 . . . . 74.24 110.866 -179.912 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 23.7 m -123.99 130.94 53.4 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.11 -0.495 . . . . 73.5 111.147 -179.936 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 1.2 t70 -94.05 114.3 26.43 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.202 -0.454 . . . . 74.11 110.849 179.926 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.985 HD23 ' N ' ' A' ' 34' ' ' THR . 0.2 OUTLIER -117.89 -17.36 9.79 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.229 -0.441 . . . . 62.34 110.934 -179.967 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 34' ' ' THR . . . . . 0.985 ' N ' HD23 ' A' ' 33' ' ' LEU . 4.7 m -50.22 137.27 18.32 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.181 -0.463 . . . . 65.24 111.123 179.952 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 11.6 mttm -56.5 89.9 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.167 -0.469 . . . . 74.45 110.91 179.925 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 1.4 mmt180 -126.02 54.49 1.53 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.205 -0.452 . . . . 74.41 110.918 179.978 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 2.8 mmpt? -78.72 170.23 16.98 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.171 -0.468 . . . . 73.54 110.88 179.996 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 5.4 t -85.02 -62.16 1.6 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.187 -0.46 . . . . 64.52 110.839 -179.88 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 4.6 m -141.95 95.5 2.82 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.142 -0.481 . . . . 62.12 110.891 -179.836 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 40' ' ' TRP . . . . . . . . . . . . . 12.4 t-105 -178.36 -48.05 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.136 -0.484 . . . . 74.13 110.932 -179.98 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 20.5 t0 -159.68 164.14 34.24 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.24 -0.436 . . . . 72.13 110.905 179.92 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 42' ' ' LYS . . . . . 0.412 ' C ' ' HD3' ' A' ' 44' ' ' PRO . 0.0 OUTLIER -154.23 68.28 0.74 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.216 -0.447 . . . . 71.22 110.897 179.987 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 43' ' ' GLN . . . . . 0.462 ' N ' ' CD ' ' A' ' 44' ' ' PRO . 12.7 mt-30 -118.71 53.47 1.92 Allowed Pre-proline 0 C--N 1.329 -0.3 0 CA-C-O 121.599 0.714 . . . . 74.41 110.937 179.942 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 44' ' ' PRO . . . . . 0.462 ' CD ' ' N ' ' A' ' 43' ' ' GLN . 53.9 Cg_endo -69.75 157.0 61.91 Favored 'Trans proline' 0 C--N 1.341 0.155 0 C-N-CA 122.694 2.262 . . . . 70.34 112.343 -179.985 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 45' ' ' GLN . . . . . 0.819 ' HB3' HD12 ' A' ' 47' ' ' ILE . 22.4 tt0 -139.71 12.81 2.5 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.238 -0.437 . . . . 72.42 110.917 -179.977 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 46' ' ' ILE . . . . . 0.846 HG13 HD11 ' A' ' 19' ' ' LEU . 0.0 OUTLIER 79.72 -42.35 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.24 -0.436 . . . . 65.22 111.13 179.991 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 47' ' ' ILE . . . . . 0.897 HG12 HD21 ' A' ' 33' ' ' LEU . 0.2 OUTLIER -34.03 143.27 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.206 -0.452 . . . . 73.32 111.156 179.87 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 48' ' ' PHE . . . . . 0.855 ' HA ' HD22 ' A' ' 33' ' ' LEU . 1.1 p90 -150.05 164.7 34.85 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.16 -0.473 . . . . 74.32 110.833 -179.989 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 49' ' ' GLU . . . . . 0.912 ' HG3' HD13 ' A' ' 33' ' ' LEU . 34.3 mt-10 -108.84 147.56 31.92 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.123 -0.489 . . . . 75.12 110.879 -179.945 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 50' ' ' ILE . . . . . 0.48 HD13 ' HA ' ' A' ' 30' ' ' PHE . 14.4 mm -128.31 135.89 61.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.185 -0.461 . . . . 74.02 111.157 179.951 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 25.9 m -93.73 125.19 38.22 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.168 -0.469 . . . . 71.14 111.14 179.974 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 52' ' ' LEU . . . . . 0.418 HD23 ' HA ' ' A' ' 52' ' ' LEU . 13.9 mt -119.72 165.02 15.06 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.206 -0.452 . . . . 64.15 110.869 179.979 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -166.41 154.35 10.16 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.178 -0.464 . . . . 71.53 110.894 179.985 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 1.9 m -56.8 -172.95 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.162 -0.472 . . . . 73.44 110.868 -179.797 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 34.5 m -87.75 -33.04 6.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.145 -0.48 . . . . 51.31 111.096 179.978 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 5.1 t0 -119.42 -166.55 1.28 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.23 -0.441 . . . . 63.44 110.875 179.922 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 57' ' ' LYS . . . . . 0.446 ' O ' ' C ' ' A' ' 60' ' ' VAL . 1.6 mmmp? -119.31 -25.9 5.99 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.215 -0.448 . . . . 73.22 110.866 -179.995 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 58' ' ' GLU . . . . . 0.555 ' HA ' ' C ' ' A' ' 59' ' ' PRO . 7.0 pt-20 -112.14 144.46 30.82 Favored Pre-proline 0 C--N 1.329 -0.286 0 CA-C-O 121.613 0.721 . . . . 73.31 110.877 179.982 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 59' ' ' PRO . . . . . 0.555 ' C ' ' HA ' ' A' ' 58' ' ' GLU . 53.4 Cg_endo -69.81 -14.44 12.57 Favored 'Cis proline' 0 C--O 1.231 0.171 0 C-N-CA 122.684 -1.798 . . . . 72.1 112.348 0.051 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 60' ' ' VAL . . . . . 0.725 HG11 ' OD1' ' A' ' 88' ' ' ASN . 15.5 m -140.95 -177.88 1.37 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.211 -0.45 . . . . 73.55 111.128 179.938 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 61' ' ' GLU . . . . . 0.441 ' O ' ' C ' ' A' ' 62' ' ' SER . 2.3 pt-20 -119.6 -12.91 9.22 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.177 -0.465 . . . . 61.44 110.891 -179.98 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 62' ' ' SER . . . . . 0.757 ' CB ' HD11 ' A' ' 125' ' ' LEU . 3.6 m 34.26 90.02 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.162 -0.472 . . . . 73.03 110.869 -179.769 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 9.7 p -110.19 122.97 48.89 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.152 -0.476 . . . . 63.33 110.891 -179.865 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 64' ' ' ILE . . . . . 0.733 HD11 HG21 ' A' ' 89' ' ' VAL . 19.8 mt -135.69 142.0 40.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.127 -0.488 . . . . 53.12 111.124 179.944 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 99.6 m -109.71 116.2 31.26 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.194 -0.457 . . . . 74.33 111.115 179.94 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 66' ' ' LEU . . . . . 0.596 HD11 HG21 ' A' ' 121' ' ' THR . 53.0 mt -95.16 116.52 28.84 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.2 -0.454 . . . . 72.33 110.942 179.904 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 5.0 t-80 -105.64 113.83 27.63 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.152 -0.477 . . . . 63.34 110.87 179.861 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 68' ' ' PHE . . . . . 0.551 ' CE1' HG23 ' A' ' 114' ' ' ILE . 0.0 OUTLIER -103.83 139.92 38.37 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.229 -0.441 . . . . 70.22 110.899 -179.927 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -115.47 107.25 14.94 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.188 -0.46 . . . . 61.11 111.122 179.921 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 70' ' ' MET . . . . . 0.425 ' H ' HG22 ' A' ' 47' ' ' ILE . 0.3 OUTLIER -74.7 81.98 2.07 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.248 -0.433 . . . . 73.33 110.911 179.949 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -40.61 158.75 0.16 Allowed Pre-proline 0 C--N 1.33 -0.273 0 CA-C-O 121.579 0.704 . . . . 43.35 111.143 -179.928 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.74 -1.12 7.92 Favored 'Trans proline' 0 C--N 1.341 0.179 0 C-N-CA 122.701 2.267 . . . . 62.42 112.39 179.886 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 73' ' ' MET . . . . . 0.634 ' HB3' HG23 ' A' ' 77' ' ' THR . 0.1 OUTLIER -112.75 -26.02 8.79 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.198 -0.455 . . . . 72.24 110.88 179.899 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 74' ' ' TYR . . . . . 0.635 ' CD1' ' C ' ' A' ' 74' ' ' TYR . 0.0 OUTLIER -48.87 149.93 2.92 Favored Pre-proline 0 C--N 1.328 -0.327 0 CA-C-O 121.681 0.753 . . . . 73.1 110.939 -179.893 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 75' ' ' PRO . . . . . 0.551 ' C ' ' HA ' ' A' ' 74' ' ' TYR . 53.9 Cg_endo -69.72 -12.88 12.24 Favored 'Cis proline' 0 C--O 1.232 0.187 0 C-N-CA 122.761 -1.766 . . . . 73.4 112.329 -0.056 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 76' ' ' TYR . . . . . 0.49 ' CB ' ' O ' ' A' ' 73' ' ' MET . 6.5 t80 -35.74 -51.29 0.67 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.251 -0.431 . . . . 74.13 110.93 -179.9 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 77' ' ' THR . . . . . 0.634 HG23 ' HB3' ' A' ' 73' ' ' MET . 48.2 p -107.1 167.51 9.85 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.12 -0.491 . . . . 74.42 111.122 -179.992 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -88.93 129.39 48.53 Favored Pre-proline 0 C--N 1.329 -0.314 0 CA-C-O 121.59 0.709 . . . . 61.43 111.122 179.858 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 79' ' ' PRO . . . . . 0.58 ' HG3' HD11 ' A' ' 113' ' ' ILE . 53.0 Cg_endo -69.77 -172.47 0.58 Allowed 'Trans proline' 0 C--N 1.341 0.171 0 C-N-CA 122.667 2.244 . . . . 72.34 112.321 -179.948 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -120.57 132.98 55.42 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.212 -0.449 . . . . 63.24 110.871 -179.957 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 81' ' ' ILE . . . . . 0.487 HD13 ' HA ' ' A' ' 68' ' ' PHE . 9.8 mm -122.96 142.31 40.04 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-N 116.161 -0.472 . . . . 43.3 111.159 179.97 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 82' ' ' GLU . . . . . 0.515 ' HG3' ' CD ' ' A' ' 84' ' ' LYS . 4.6 pt-20 -145.09 144.93 31.21 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.217 -0.447 . . . . 51.32 110.893 179.972 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 83' ' ' PHE . . . . . 0.496 ' CE2' ' HD3' ' A' ' 98' ' ' LYS . 33.7 m-85 -99.04 135.28 40.68 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.157 -0.474 . . . . 55.52 110.888 -179.94 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 84' ' ' LYS . . . . . 0.515 ' CD ' ' HG3' ' A' ' 82' ' ' GLU . 9.2 mmmt -125.4 171.84 10.13 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.165 -0.471 . . . . 73.45 110.847 -179.989 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 85' ' ' ASN . . . . . 0.486 ' O ' ' C ' ' A' ' 86' ' ' VAL . 5.6 m120 62.41 -73.87 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.216 -0.447 . . . . 71.34 110.878 179.954 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 86' ' ' VAL . . . . . 0.704 ' O ' HG23 ' A' ' 86' ' ' VAL . 33.6 m 29.74 91.51 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.18 -0.464 . . . . 73.22 111.11 179.911 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -93.64 -63.57 1.19 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.138 -0.483 . . . . 74.05 110.909 -179.958 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 88' ' ' ASN . . . . . 0.725 ' OD1' HG11 ' A' ' 60' ' ' VAL . 17.1 t30 -81.82 39.22 0.54 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.202 -0.454 . . . . 75.11 110.925 -179.987 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 89' ' ' VAL . . . . . 0.733 HG21 HD11 ' A' ' 64' ' ' ILE . 15.6 t -141.2 149.49 20.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.171 -0.468 . . . . 73.41 111.135 179.905 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 90' ' ' MET . . . . . . . . . . . . . 6.2 mtm -107.72 -61.49 1.56 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.152 -0.476 . . . . 54.45 110.865 179.927 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 91' ' ' ASP . . . . . 0.417 ' OD1' ' N ' ' A' ' 92' ' ' SER . 0.0 OUTLIER -177.64 -30.84 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.233 -0.439 . . . . 75.34 110.908 179.988 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 92' ' ' SER . . . . . 0.417 ' N ' ' OD1' ' A' ' 91' ' ' ASP . 47.4 t -55.46 -45.7 76.89 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.175 -0.466 . . . . 63.33 110.89 -179.807 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 93' ' ' GLN . . . . . 0.514 ' HG3' ' CE2' ' A' ' 128' ' ' PHE . 3.9 mp0 -68.58 -41.71 79.28 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.125 -0.489 . . . . 73.24 110.903 -179.985 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 94' ' ' LEU . . . . . 0.668 ' CD1' HG11 ' A' ' 89' ' ' VAL . 7.5 mp -58.61 -48.98 79.16 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.211 -0.45 . . . . 71.24 110.916 -179.986 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 45.7 mt-30 -66.16 -34.45 78.06 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.226 -0.443 . . . . 72.11 110.93 179.928 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 96' ' ' MET . . . . . 0.424 ' SD ' ' CE1' ' A' ' 128' ' ' PHE . 5.7 ttp -59.74 -39.7 85.62 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.159 -0.473 . . . . 73.3 110.864 179.972 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 97' ' ' LEU . . . . . 0.862 HD22 HG22 ' A' ' 121' ' ' THR . 13.4 mt -67.24 -42.18 84.39 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.288 -0.415 . . . . 51.13 110.892 -179.972 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 98' ' ' LYS . . . . . 0.496 ' HD3' ' CE2' ' A' ' 83' ' ' PHE . 3.2 mmmp? -55.23 -42.35 73.28 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.22 -0.445 . . . . 70.35 110.893 179.876 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -59.81 -44.57 93.94 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.206 -0.452 . . . . 72.42 110.883 -179.887 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 100' ' ' GLU . . . . . 0.508 ' O ' HD12 ' A' ' 104' ' ' ILE . 19.3 mt-10 -69.88 -27.44 64.82 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.111 -0.495 . . . . 64.03 110.872 -179.97 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 101' ' ' PHE . . . . . 0.784 ' CD2' HD11 ' A' ' 117' ' ' ILE . 11.8 m-30 -59.37 -28.83 67.22 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.198 -0.455 . . . . 74.11 110.869 -179.945 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 6.5 ttmt -71.79 -43.38 65.77 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.136 -0.484 . . . . 72.51 110.903 179.983 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 16.8 ttpp -69.07 -42.97 75.5 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.235 -0.439 . . . . 72.55 110.882 179.857 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 104' ' ' ILE . . . . . 0.546 HD11 ' CD2' ' A' ' 120' ' ' PHE . 3.5 mt -62.59 -47.46 92.82 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.248 -0.433 . . . . 74.42 111.148 179.854 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 105' ' ' HIS . . . . . . . . . . . . . 35.6 t-80 -62.84 -41.94 99.54 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.185 -0.461 . . . . 63.4 110.872 179.884 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -57.33 -41.25 79.65 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.172 -0.467 . . . . 74.01 110.866 -179.952 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 9.4 t -83.57 -15.61 48.55 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.226 -0.443 . . . . 61.11 111.137 -179.954 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 108' ' ' SER . . . . . 0.578 ' HB2' HG22 ' A' ' 113' ' ' ILE . 1.8 m -124.54 43.55 2.99 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.203 -0.453 . . . . 73.25 110.857 -179.899 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 4.9 ttt180 -90.38 83.23 5.9 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.123 -0.49 . . . . 73.1 110.845 -179.955 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 110' ' ' GLY . . . . . 0.476 ' HA2' ' CG ' ' A' ' 75' ' ' PRO . . . 136.63 -4.43 3.65 Favored Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.712 -0.756 . . . . 53.21 112.486 -179.971 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 111' ' ' GLN . . . . . . . . . . . . . 13.2 mm-40 -116.46 -94.76 0.48 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.784 0.326 . . . . 62.13 110.892 -179.909 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 39.9 mt-10 -149.05 131.4 15.62 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.236 -0.438 . . . . 63.13 110.915 -179.935 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 113' ' ' ILE . . . . . 0.58 HD11 ' HG3' ' A' ' 79' ' ' PRO . 16.3 pt -121.29 -9.52 9.71 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.157 -0.474 . . . . 73.42 111.166 179.932 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 114' ' ' ILE . . . . . 0.924 ' O ' HG23 ' A' ' 118' ' ' THR . 30.2 mm -65.53 -45.85 91.42 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.187 -0.461 . . . . 73.42 111.18 179.819 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 115' ' ' PHE . . . . . 0.726 ' CE1' HD13 ' A' ' 25' ' ' ILE . 31.8 t80 -73.03 -34.49 66.38 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.173 -0.467 . . . . 64.54 110.901 179.917 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 9.0 mm-40 -68.06 -47.88 67.11 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.131 -0.486 . . . . 72.34 110.92 -179.934 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 117' ' ' ILE . . . . . 0.784 HD11 ' CD2' ' A' ' 101' ' ' PHE . 0.9 OUTLIER -63.53 -39.98 87.35 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.13 -0.487 . . . . 71.2 111.133 179.938 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 118' ' ' THR . . . . . 0.924 HG23 ' O ' ' A' ' 114' ' ' ILE . 46.9 p -68.0 -43.54 78.65 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.18 -0.464 . . . . 73.34 111.13 179.972 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -68.01 -44.15 77.21 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.206 -0.452 . . . . 75.24 110.876 -179.877 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 120' ' ' PHE . . . . . 0.546 ' CD2' HD11 ' A' ' 104' ' ' ILE . 1.2 t80 -60.79 -49.45 77.43 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.147 -0.479 . . . . 71.02 110.881 -179.948 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 121' ' ' THR . . . . . 0.862 HG22 HD22 ' A' ' 97' ' ' LEU . 75.5 p -60.04 -40.37 89.14 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.143 -0.481 . . . . 73.23 111.171 -179.891 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -68.07 -51.34 47.65 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.208 -0.451 . . . . 74.11 110.894 179.972 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 123' ' ' GLU . . . . . 0.47 ' CG ' ' N ' ' A' ' 124' ' ' LYS . 4.5 pt-20 -58.91 -46.21 88.43 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.267 -0.424 . . . . 72.11 110.876 -179.908 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 124' ' ' LYS . . . . . 0.47 ' N ' ' CG ' ' A' ' 123' ' ' GLU . 0.0 OUTLIER -73.77 -26.91 60.89 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.17 -0.468 . . . . 63.43 110.896 179.966 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 125' ' ' LEU . . . . . 0.757 HD11 ' CB ' ' A' ' 62' ' ' SER . 2.5 tp -67.9 -50.21 57.5 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.234 -0.439 . . . . 74.32 110.944 179.913 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -61.41 -38.44 87.09 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.175 -0.466 . . . . 60.31 110.872 179.803 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 127' ' ' GLU . . . . . 0.433 ' HG3' ' N ' ' A' ' 128' ' ' PHE . 0.0 OUTLIER -62.27 -28.97 70.09 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.218 -0.446 . . . . 74.13 110.868 -179.879 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 128' ' ' PHE . . . . . 0.514 ' CE2' ' HG3' ' A' ' 93' ' ' GLN . 0.6 OUTLIER -77.09 -47.28 20.92 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.148 -0.478 . . . . 62.02 110.882 -179.912 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 129' ' ' GLN . . . . . 0.498 ' CG ' HG22 ' A' ' 60' ' ' VAL . 1.5 tm0? -67.92 -44.26 77.27 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.14 -0.482 . . . . 75.13 110.883 -179.916 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 130' ' ' ASN . . . . . 0.739 ' C ' HG23 ' A' ' 131' ' ' VAL . 37.8 t30 -62.89 -84.19 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.203 -0.453 . . . . 72.25 110.896 -179.933 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 131' ' ' VAL . . . . . 0.739 HG23 ' C ' ' A' ' 130' ' ' ASN . 2.7 t 86.29 -27.91 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 116.134 -0.485 . . . . 62.24 111.158 179.948 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 132' ' ' VAL . . . . . 0.502 ' CG2' ' O ' ' A' ' 131' ' ' VAL . 91.3 t -160.9 112.71 0.1 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.207 -0.451 . . . . 35.2 111.102 179.924 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 133' ' ' ASN . . . . . 0.42 ' O ' ' CB ' ' A' ' 134' ' ' THR . 11.0 p-10 -37.41 146.53 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.203 -0.453 . . . . 70.41 110.835 -179.987 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 134' ' ' THR . . . . . 0.42 ' CB ' ' O ' ' A' ' 133' ' ' ASN . 0.7 OUTLIER 78.97 -67.64 0.16 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.161 -0.472 . . . . 64.11 111.161 -179.97 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 69.59 159.32 0.18 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.2 -0.455 . . . . 74.25 110.896 179.969 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -84.83 125.17 32.37 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.184 -0.462 . . . . 61.32 110.863 -179.798 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 137' ' ' LEU . . . . . . . . . . . . . 5.5 tp -51.38 -45.82 62.58 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.172 -0.467 . . . . 74.31 110.888 -179.96 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--N 1.329 -0.291 0 CA-C-N 116.246 -0.434 . . . . 52.33 110.868 179.94 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 2.4 mtt . . . . . 0 C--O 1.231 0.084 0 CA-C-O 120.765 0.317 . . . . 73.04 110.861 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 83.6 p -154.01 -46.98 0.09 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.213 -0.448 . . . . 63.5 110.85 -179.798 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -91.35 145.69 24.43 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.116 -0.493 . . . . 65.03 110.881 -179.967 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 4' ' ' SER . . . . . 0.415 ' O ' ' CB ' ' A' ' 5' ' ' HIS . 19.1 m -167.13 162.26 15.15 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.162 -0.472 . . . . 75.31 110.836 -179.944 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 5' ' ' HIS . . . . . 0.415 ' CB ' ' O ' ' A' ' 4' ' ' SER . 0.2 OUTLIER 77.25 121.46 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.123 -0.489 . . . . 73.11 110.839 179.924 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 6' ' ' LEU . . . . . 0.406 ' C ' ' O ' ' A' ' 5' ' ' HIS . 0.2 OUTLIER 37.71 83.59 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.194 -0.457 . . . . 64.34 110.906 -179.951 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 7' ' ' THR . . . . . 0.449 ' OG1' ' N ' ' A' ' 8' ' ' LEU . 6.4 t 177.02 -174.94 0.12 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.201 -0.454 . . . . 65.3 111.181 179.923 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.449 ' N ' ' OG1' ' A' ' 7' ' ' THR . 50.9 mt -65.54 -27.63 68.59 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.231 -0.441 . . . . 65.32 110.916 -180.0 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 37.2 t70 -50.61 -31.13 15.11 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.187 -0.46 . . . . 74.45 110.894 179.819 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 82.6 mm-40 -67.51 -39.65 85.11 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.185 -0.461 . . . . 73.32 110.931 -179.938 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 19.2 m-85 -59.41 -25.4 64.29 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.176 -0.466 . . . . 74.32 110.945 -179.925 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 1.6 t80 -59.33 -38.98 81.7 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.155 -0.475 . . . . 70.3 110.901 -179.905 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -61.43 -42.52 98.88 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.166 -0.47 . . . . 61.11 110.879 -179.964 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 3.1 mp -67.54 -41.9 86.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.171 -0.468 . . . . 73.11 111.169 179.957 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 15' ' ' GLN . . . . . 0.42 ' NE2' ' O ' ' A' ' 71' ' ' THR . 73.0 mt-30 -60.88 -44.7 96.71 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.12 -0.491 . . . . 73.34 110.901 179.917 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 6.9 t -64.02 -39.6 94.47 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.217 -0.447 . . . . 64.22 110.911 -179.919 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 8.0 m-20 -58.02 -33.92 69.48 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.158 -0.474 . . . . 65.43 110.889 -179.9 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 18' ' ' GLU . . . . . 0.4 ' CD ' ' OH ' ' A' ' 74' ' ' TYR . 1.6 mm-40 -65.38 -37.67 87.71 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.173 -0.467 . . . . 73.44 110.886 -179.986 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.419 ' CD2' HG13 ' A' ' 46' ' ' ILE . 5.9 mp -66.14 -51.4 58.23 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.134 -0.485 . . . . 73.34 110.952 179.99 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -68.68 -34.18 75.24 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.196 -0.457 . . . . 74.02 110.881 179.915 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -64.54 -50.85 65.68 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.145 -0.479 . . . . 71.03 111.113 179.906 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 22' ' ' ILE . . . . . 0.748 ' HA ' HD12 ' A' ' 25' ' ' ILE . 0.6 OUTLIER -75.1 -34.46 31.82 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 116.252 -0.431 . . . . 70.33 111.161 179.943 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 23' ' ' ARG . . . . . 0.519 ' O ' ' CA ' ' A' ' 27' ' ' MET . 0.0 OUTLIER -52.43 -35.53 52.33 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.177 -0.465 . . . . 64.54 110.896 179.972 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -68.43 -28.53 67.15 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.132 -0.486 . . . . 74.21 110.908 -179.833 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 25' ' ' ILE . . . . . 0.785 HD13 ' CE1' ' A' ' 115' ' ' PHE . 4.7 mt -84.13 -45.15 18.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.134 -0.485 . . . . 72.52 111.137 179.939 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 26' ' ' TYR . . . . . 0.508 ' O ' ' N ' ' A' ' 29' ' ' ASP . 32.3 m-85 -106.32 21.01 18.1 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.146 -0.479 . . . . 73.31 110.915 -179.991 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 27' ' ' MET . . . . . 0.519 ' CA ' ' O ' ' A' ' 23' ' ' ARG . 0.0 OUTLIER -33.87 -45.56 0.19 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.112 -0.494 . . . . 73.25 110.873 179.951 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 31.1 t70 -86.19 -31.19 21.9 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.209 -0.45 . . . . 74.35 110.871 179.965 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 29' ' ' ASP . . . . . 0.508 ' N ' ' O ' ' A' ' 26' ' ' TYR . 1.3 m-20 -103.21 37.77 1.91 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.151 -0.477 . . . . 44.45 110.907 179.972 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 30' ' ' PHE . . . . . 0.607 ' HA ' HD13 ' A' ' 50' ' ' ILE . 0.6 OUTLIER -109.91 135.13 51.26 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.183 -0.462 . . . . 65.4 110.876 -179.881 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 45.4 m -115.24 130.9 57.04 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.132 -0.485 . . . . 72.5 111.182 -179.934 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -104.9 115.3 30.06 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.283 -0.417 . . . . 62.14 110.904 179.925 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.898 HD21 ' CE1' ' A' ' 67' ' ' HIS . 0.5 OUTLIER -119.18 4.01 11.34 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.223 -0.444 . . . . 54.51 110.882 -179.915 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 34' ' ' THR . . . . . 0.539 ' N ' HD12 ' A' ' 33' ' ' LEU . 1.3 m -68.91 127.26 32.49 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.213 -0.449 . . . . 64.52 111.125 179.945 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 1.4 ptmt -64.08 88.31 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.198 -0.455 . . . . 74.44 110.866 179.904 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 36' ' ' ARG . . . . . 0.443 ' O ' ' C ' ' A' ' 37' ' ' LYS . 0.4 OUTLIER -98.15 -62.17 1.28 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.208 -0.451 . . . . 74.12 110.894 179.929 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 37' ' ' LYS . . . . . 0.443 ' C ' ' O ' ' A' ' 36' ' ' ARG . 1.8 mmtt -34.53 142.06 0.05 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.24 -0.436 . . . . 70.33 110.875 179.957 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 2.8 t -70.12 167.33 17.96 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.245 -0.434 . . . . 64.41 110.812 -179.906 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 39' ' ' SER . . . . . 0.432 ' O ' ' CB ' ' A' ' 40' ' ' TRP . 2.9 m 58.84 164.05 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.09 -0.505 . . . . 42.23 110.868 -179.83 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 40' ' ' TRP . . . . . 0.554 ' CE3' ' O ' ' A' ' 40' ' ' TRP . 0.0 OUTLIER 78.25 -41.98 0.33 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.135 -0.484 . . . . 74.02 110.902 179.991 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 41' ' ' ASP . . . . . 0.553 ' HB2' ' CD2' ' A' ' 40' ' ' TRP . 7.3 t0 -178.74 148.19 0.41 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.247 -0.433 . . . . 51.31 110.872 179.945 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 32.2 mtmt -148.14 76.5 1.37 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.244 -0.435 . . . . 75.33 110.914 179.966 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 2.5 mt-30 -166.17 64.28 0.87 Allowed Pre-proline 0 C--N 1.329 -0.287 0 CA-C-O 121.634 0.73 . . . . 63.14 110.933 179.961 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.73 162.17 43.1 Favored 'Trans proline' 0 C--N 1.342 0.216 0 C-N-CA 122.681 2.254 . . . . 74.23 112.328 179.994 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 45' ' ' GLN . . . . . 0.506 ' O ' HG22 ' A' ' 46' ' ' ILE . 17.6 tt0 -132.65 11.36 4.4 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.192 -0.458 . . . . 71.32 110.899 179.996 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 46' ' ' ILE . . . . . 0.506 HG22 ' O ' ' A' ' 45' ' ' GLN . 0.0 OUTLIER 81.67 -11.56 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.178 -0.465 . . . . 54.35 111.108 179.936 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 47' ' ' ILE . . . . . 0.468 HG12 ' CD1' ' A' ' 33' ' ' LEU . 0.2 OUTLIER -51.5 150.57 0.91 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 116.157 -0.474 . . . . 73.2 111.114 179.879 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 6.8 p90 -161.95 161.19 28.57 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.118 -0.492 . . . . 73.03 110.875 179.968 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 49' ' ' GLU . . . . . 0.57 ' CD ' HD23 ' A' ' 33' ' ' LEU . 8.6 mt-10 -111.25 161.02 16.44 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.137 -0.483 . . . . 71.34 110.858 -179.942 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 50' ' ' ILE . . . . . 0.607 HD13 ' HA ' ' A' ' 30' ' ' PHE . 7.8 mm -140.27 132.38 32.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.114 -0.493 . . . . 73.52 111.173 179.941 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 24.2 m -84.44 123.29 30.07 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.205 -0.452 . . . . 75.21 111.164 179.995 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 52' ' ' LEU . . . . . 0.533 HD12 HD12 ' A' ' 66' ' ' LEU . 31.2 mt -121.72 164.98 16.48 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.229 -0.442 . . . . 61.23 110.928 179.979 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 53' ' ' ARG . . . . . 0.67 ' C ' HD21 ' A' ' 125' ' ' LEU . 7.6 ptt180 175.68 163.42 0.32 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.231 -0.44 . . . . 71.05 110.848 179.943 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 54' ' ' SER . . . . . 0.882 ' CA ' HD11 ' A' ' 125' ' ' LEU . 1.4 t -60.59 -156.47 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.184 -0.462 . . . . 71.22 110.87 -179.842 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 55' ' ' VAL . . . . . 0.417 HG22 ' OD1' ' A' ' 126' ' ' ASP . 15.7 m -122.31 -22.84 2.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.114 -0.494 . . . . 73.3 111.144 179.896 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 56' ' ' ASP . . . . . 0.439 ' OD1' ' N ' ' A' ' 56' ' ' ASP . 0.2 OUTLIER -110.5 -175.39 2.71 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.181 -0.463 . . . . 61.4 110.889 179.906 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 3.9 mmmm -118.47 -10.87 10.04 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.173 -0.467 . . . . 61.14 110.884 179.999 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 58' ' ' GLU . . . . . 0.558 ' HA ' ' C ' ' A' ' 59' ' ' PRO . 44.3 mt-10 -126.34 141.89 41.24 Favored Pre-proline 0 C--N 1.329 -0.288 0 CA-C-O 121.659 0.742 . . . . 74.25 110.885 179.974 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 59' ' ' PRO . . . . . 0.558 ' C ' ' HA ' ' A' ' 58' ' ' GLU . 53.4 Cg_endo -69.79 -3.18 7.58 Favored 'Cis proline' 0 C--N 1.342 0.205 0 C-N-CA 122.653 -1.811 . . . . 63.24 112.36 0.035 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 60' ' ' VAL . . . . . 0.667 HG22 ' HG2' ' A' ' 129' ' ' GLN . 18.3 m -157.61 -173.29 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.232 -0.44 . . . . 74.53 111.144 179.918 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 61' ' ' GLU . . . . . 0.408 ' O ' ' O ' ' A' ' 62' ' ' SER . 8.3 tt0 -114.86 -22.1 9.8 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.184 -0.462 . . . . 72.13 110.873 -179.969 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 62' ' ' SER . . . . . 0.844 ' HB3' HD13 ' A' ' 125' ' ' LEU . 0.4 OUTLIER 49.4 101.63 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.137 -0.483 . . . . 61.15 110.864 -179.787 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 63' ' ' SER . . . . . 0.405 ' HB3' ' CD ' ' A' ' 87' ' ' GLN . 26.0 t -125.31 123.26 39.05 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.14 -0.482 . . . . 75.3 110.887 -179.83 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 64' ' ' ILE . . . . . 0.921 HD11 HG21 ' A' ' 89' ' ' VAL . 64.7 mt -145.16 142.56 22.59 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.178 -0.465 . . . . 55.55 111.163 179.938 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 23.5 m -107.52 119.07 38.4 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.198 -0.455 . . . . 40.02 111.123 -179.994 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 66' ' ' LEU . . . . . 0.565 HD11 HG21 ' A' ' 121' ' ' THR . 54.1 mt -99.01 109.97 22.64 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.242 -0.436 . . . . 72.42 110.915 179.913 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 67' ' ' HIS . . . . . 0.898 ' CE1' HD21 ' A' ' 33' ' ' LEU . 1.9 t60 -96.47 109.76 22.26 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.152 -0.476 . . . . 64.04 110.853 179.869 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 68' ' ' PHE . . . . . 0.493 ' HD2' HD12 ' A' ' 81' ' ' ILE . 0.0 OUTLIER -103.92 139.91 38.42 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.245 -0.434 . . . . 73.14 110.875 -179.911 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 69' ' ' ALA . . . . . 0.451 ' O ' ' CB ' ' A' ' 79' ' ' PRO . . . -126.64 129.04 47.71 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.145 -0.479 . . . . 63.14 111.119 179.908 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 70' ' ' MET . . . . . 0.473 ' CE ' HD11 ' A' ' 114' ' ' ILE . 0.0 OUTLIER -94.64 157.86 15.78 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.234 -0.439 . . . . 73.01 110.854 179.982 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 71' ' ' THR . . . . . 0.42 ' O ' ' NE2' ' A' ' 15' ' ' GLN . 0.1 OUTLIER -112.16 162.93 19.09 Favored Pre-proline 0 C--N 1.33 -0.241 0 CA-C-O 121.601 0.715 . . . . 51.24 111.096 -179.945 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.76 0.1 6.13 Favored 'Trans proline' 0 C--N 1.341 0.173 0 C-N-CA 122.71 2.273 . . . . 60.11 112.348 179.933 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 73' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -115.06 -26.71 7.6 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.241 -0.436 . . . . 63.24 110.911 179.895 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 74' ' ' TYR . . . . . 0.66 ' CD1' ' C ' ' A' ' 74' ' ' TYR . 0.0 OUTLIER -45.76 151.66 0.81 Allowed Pre-proline 0 C--N 1.329 -0.323 0 CA-C-O 121.675 0.75 . . . . 72.33 110.935 -179.873 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 75' ' ' PRO . . . . . 0.552 ' HA ' ' CD2' ' A' ' 74' ' ' TYR . 53.6 Cg_endo -69.8 2.15 5.02 Favored 'Cis proline' 0 C--O 1.232 0.205 0 C-N-CA 122.634 -1.819 . . . . 61.21 112.329 -0.036 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 76' ' ' TYR . . . . . 0.729 ' O ' HG23 ' A' ' 77' ' ' THR . 19.6 t80 -75.3 44.46 0.26 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.258 -0.428 . . . . 72.22 110.967 -179.968 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 77' ' ' THR . . . . . 0.729 HG23 ' O ' ' A' ' 76' ' ' TYR . 0.6 OUTLIER -172.61 -177.57 1.75 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.086 -0.506 . . . . 73.13 111.181 -179.971 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -118.73 116.59 34.58 Favored Pre-proline 0 C--N 1.329 -0.313 0 CA-C-O 121.587 0.708 . . . . 73.1 111.075 179.863 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 79' ' ' PRO . . . . . 0.474 ' HG3' ' CD1' ' A' ' 113' ' ' ILE . 53.7 Cg_endo -69.72 -164.66 0.13 Allowed 'Trans proline' 0 C--N 1.342 0.192 0 C-N-CA 122.674 2.249 . . . . 50.5 112.356 179.978 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 80' ' ' GLU . . . . . 0.578 ' O ' HD13 ' A' ' 81' ' ' ILE . 0.3 OUTLIER -135.32 136.03 41.24 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.19 -0.459 . . . . 71.44 110.907 179.985 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 81' ' ' ILE . . . . . 0.578 HD13 ' O ' ' A' ' 80' ' ' GLU . 10.0 mm -127.99 144.34 37.98 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.113 -0.494 . . . . 60.33 111.168 179.954 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 82' ' ' GLU . . . . . 0.453 ' HG3' ' CD ' ' A' ' 84' ' ' LYS . 1.2 pt-20 -148.51 145.93 28.12 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.162 -0.472 . . . . 72.23 110.888 179.973 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 83' ' ' PHE . . . . . 0.558 ' CE2' ' HD3' ' A' ' 98' ' ' LYS . 7.3 m-85 -99.33 139.95 34.22 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.171 -0.468 . . . . 74.42 110.895 -179.965 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 84' ' ' LYS . . . . . 0.478 ' O ' ' N ' ' A' ' 86' ' ' VAL . 5.3 mmmt -127.06 173.62 9.53 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.172 -0.467 . . . . 74.13 110.889 179.981 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 3.1 m120 61.35 -75.51 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.191 -0.459 . . . . 55.43 110.907 179.946 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 86' ' ' VAL . . . . . 0.672 HG11 HD21 ' A' ' 94' ' ' LEU . 3.6 m 40.22 91.35 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.151 -0.477 . . . . 75.24 111.099 179.858 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 87' ' ' GLN . . . . . 0.405 ' CD ' ' HB3' ' A' ' 63' ' ' SER . 0.1 OUTLIER -96.79 -65.08 0.99 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.143 -0.48 . . . . 74.3 110.934 179.974 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 88' ' ' ASN . . . . . 0.47 ' ND2' ' HB ' ' A' ' 60' ' ' VAL . 8.5 m120 -84.95 34.23 0.54 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.218 -0.447 . . . . 74.14 110.907 -179.995 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 89' ' ' VAL . . . . . 0.921 HG21 HD11 ' A' ' 64' ' ' ILE . 17.1 t -138.06 146.57 26.86 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.205 -0.452 . . . . 61.23 111.148 179.925 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 90' ' ' MET . . . . . . . . . . . . . 13.7 mtm -101.75 -62.97 1.19 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.186 -0.461 . . . . 71.22 110.857 179.932 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -179.53 -32.73 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.215 -0.448 . . . . 74.45 110.848 179.973 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 39.0 t -53.97 -42.3 68.8 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.206 -0.452 . . . . 74.22 110.872 -179.789 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 93' ' ' GLN . . . . . 0.579 ' HG3' ' CZ ' ' A' ' 128' ' ' PHE . 1.9 mp0 -70.36 -39.69 74.46 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.132 -0.485 . . . . 74.13 110.945 -179.98 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 94' ' ' LEU . . . . . 0.672 HD21 HG11 ' A' ' 86' ' ' VAL . 7.4 mp -59.76 -48.16 82.77 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.174 -0.466 . . . . 64.4 110.927 179.992 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 73.7 mt-30 -65.52 -33.91 77.03 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.186 -0.461 . . . . 71.34 110.944 179.91 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 96' ' ' MET . . . . . . . . . . . . . 46.7 ttp -59.8 -38.01 80.73 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.193 -0.458 . . . . 75.54 110.891 179.947 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 97' ' ' LEU . . . . . 0.665 HD22 HG22 ' A' ' 121' ' ' THR . 30.4 mt -72.21 -38.97 68.89 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.226 -0.443 . . . . 74.14 110.954 179.992 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 98' ' ' LYS . . . . . 0.558 ' HD3' ' CE2' ' A' ' 83' ' ' PHE . 2.3 mmmp? -57.1 -38.36 73.28 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.169 -0.469 . . . . 60.13 110.945 179.797 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 5.1 m -63.26 -40.32 97.08 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.185 -0.462 . . . . 74.54 110.872 -179.897 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 100' ' ' GLU . . . . . 0.536 ' O ' HD12 ' A' ' 104' ' ' ILE . 4.2 mm-40 -74.24 -26.46 60.25 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.129 -0.487 . . . . 72.2 110.894 -179.961 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 101' ' ' PHE . . . . . 0.596 ' CD1' ' O ' ' A' ' 97' ' ' LEU . 12.7 m-30 -59.44 -29.95 68.14 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.171 -0.468 . . . . 72.32 110.887 -179.94 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 1.9 tmpt? -74.82 -42.43 58.05 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.158 -0.474 . . . . 73.24 110.86 179.978 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 103' ' ' LYS . . . . . 0.408 ' HG2' ' N ' ' A' ' 104' ' ' ILE . 0.0 OUTLIER -70.13 -37.82 75.4 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.242 -0.436 . . . . 71.22 110.905 179.885 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 104' ' ' ILE . . . . . 0.536 HD12 ' O ' ' A' ' 100' ' ' GLU . 4.2 mt -63.47 -47.52 91.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.217 -0.447 . . . . 71.32 111.088 179.888 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 105' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -61.49 -41.09 96.75 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.223 -0.444 . . . . 74.31 110.879 179.9 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -61.66 -41.05 97.01 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.157 -0.474 . . . . 64.35 110.877 -179.921 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 8.8 t -81.41 -28.27 34.38 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.15 -0.477 . . . . 54.13 111.18 -179.986 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 108' ' ' SER . . . . . 0.555 ' HB2' HG22 ' A' ' 113' ' ' ILE . 67.1 m -100.47 17.48 21.52 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.178 -0.464 . . . . 55.4 110.856 -179.897 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.23 90.86 0.15 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.135 -0.484 . . . . 75.24 110.875 -179.961 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 137.57 -23.39 3.11 Favored Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.737 -0.744 . . . . 63.34 112.447 -179.997 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 111' ' ' GLN . . . . . . . . . . . . . 4.7 pt20 -119.64 -156.8 0.68 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.721 0.296 . . . . 74.21 110.962 -179.903 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 46.8 mt-10 -72.62 139.54 47.45 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.208 -0.451 . . . . 74.12 110.866 -179.918 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 113' ' ' ILE . . . . . 0.555 HG22 ' HB2' ' A' ' 108' ' ' SER . 4.7 pt -123.22 -24.66 2.25 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.196 -0.457 . . . . 73.34 111.139 179.96 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 114' ' ' ILE . . . . . 0.481 ' O ' HG23 ' A' ' 118' ' ' THR . 36.9 mm -59.26 -45.13 93.27 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 116.189 -0.46 . . . . 71.24 111.136 179.856 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 115' ' ' PHE . . . . . 0.785 ' CE1' HD13 ' A' ' 25' ' ' ILE . 28.8 t80 -66.95 -35.29 79.65 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.116 -0.493 . . . . 75.51 110.865 179.967 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 5.2 mm-40 -66.81 -47.91 70.58 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.154 -0.475 . . . . 73.43 110.89 -179.888 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 117' ' ' ILE . . . . . 0.558 ' O ' HG23 ' A' ' 121' ' ' THR . 0.3 OUTLIER -64.42 -41.92 93.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.133 -0.485 . . . . 70.22 111.151 179.959 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 118' ' ' THR . . . . . 0.482 ' N ' ' CG2' ' A' ' 117' ' ' ILE . 66.1 p -67.84 -42.25 81.71 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.208 -0.451 . . . . 64.2 111.141 179.979 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 6.1 t -66.55 -44.25 82.87 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.229 -0.442 . . . . 60.11 110.869 -179.876 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 120' ' ' PHE . . . . . 0.407 ' CE2' ' NZ ' ' A' ' 124' ' ' LYS . 0.2 OUTLIER -64.95 -47.08 78.91 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.132 -0.485 . . . . 73.35 110.88 -179.948 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 121' ' ' THR . . . . . 0.665 HG22 HD22 ' A' ' 97' ' ' LEU . 76.3 p -67.68 -38.96 84.45 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.163 -0.472 . . . . 72.32 111.159 -179.933 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 9.9 tt0 -64.96 -47.99 75.66 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.238 -0.437 . . . . 71.23 110.884 179.986 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 3.0 pt-20 -63.73 -39.25 93.84 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.262 -0.426 . . . . 72.14 110.86 -179.897 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 124' ' ' LYS . . . . . 0.418 ' O ' ' CG ' ' A' ' 127' ' ' GLU . 0.0 OUTLIER -67.49 -40.95 85.25 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.189 -0.46 . . . . 72.42 110.896 179.948 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 125' ' ' LEU . . . . . 0.882 HD11 ' CA ' ' A' ' 54' ' ' SER . 0.2 OUTLIER -68.95 -36.89 78.46 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.17 -0.468 . . . . 72.22 110.94 179.944 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 126' ' ' ASP . . . . . 0.417 ' OD1' HG22 ' A' ' 55' ' ' VAL . 7.9 t0 -64.02 -41.96 97.27 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.166 -0.47 . . . . 74.41 110.889 179.775 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 127' ' ' GLU . . . . . 0.418 ' CG ' ' O ' ' A' ' 124' ' ' LYS . 8.2 pt-20 -69.91 -37.49 75.98 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.152 -0.476 . . . . 75.52 110.87 -179.882 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 128' ' ' PHE . . . . . 0.579 ' CZ ' ' HG3' ' A' ' 93' ' ' GLN . 1.1 m-85 -50.04 -53.27 28.01 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.154 -0.476 . . . . 74.13 110.9 -179.932 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 129' ' ' GLN . . . . . 0.667 ' HG2' HG22 ' A' ' 60' ' ' VAL . 1.9 mt-30 -53.41 -41.77 66.33 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.113 -0.494 . . . . 65.11 110.87 -179.927 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 130' ' ' ASN . . . . . . . . . . . . . 1.2 t30 -44.01 -38.42 3.52 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.2 -0.455 . . . . 73.22 110.874 -179.943 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 131' ' ' VAL . . . . . 0.764 HG22 ' O ' ' A' ' 131' ' ' VAL . 1.4 p -164.99 74.75 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.209 -0.45 . . . . 73.4 111.116 179.95 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 132' ' ' VAL . . . . . 0.649 HG22 HG22 ' A' ' 134' ' ' THR . 7.3 p -94.36 136.87 24.46 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.195 -0.457 . . . . 64.01 111.14 179.904 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 133' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -69.01 92.59 0.53 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.192 -0.458 . . . . 74.12 110.869 -179.985 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 134' ' ' THR . . . . . 0.649 HG22 HG22 ' A' ' 132' ' ' VAL . 0.4 OUTLIER 174.75 -40.4 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.172 -0.467 . . . . 71.31 111.125 179.998 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER 38.49 74.03 0.1 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.215 -0.448 . . . . 74.33 110.887 179.996 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 175.9 173.56 0.32 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.185 -0.462 . . . . 63.01 110.822 -179.824 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 137' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -85.54 -174.52 5.22 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.163 -0.471 . . . . 65.2 110.92 180.0 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--N 1.33 -0.282 0 CA-C-N 116.222 -0.444 . . . . 75.22 110.861 179.933 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 8.0 ptp . . . . . 0 C--O 1.232 0.137 0 CA-C-O 120.787 0.327 . . . . 72.44 110.912 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 51.9 p -120.12 151.06 39.61 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.246 -0.434 . . . . 63.51 110.838 -179.789 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 3.3 mt -128.56 177.54 6.94 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.122 -0.49 . . . . 53.42 110.96 179.987 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 69.5 m -99.09 87.21 3.62 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.214 -0.448 . . . . 73.21 110.858 -179.941 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 5' ' ' HIS . . . . . 0.401 ' O ' ' C ' ' A' ' 6' ' ' LEU . 5.0 p-80 -149.28 105.48 3.5 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.128 -0.487 . . . . 71.51 110.852 179.973 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 6' ' ' LEU . . . . . 0.401 ' C ' ' O ' ' A' ' 5' ' ' HIS . 6.2 tp 37.96 72.74 0.12 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.187 -0.46 . . . . 70.31 110.882 179.999 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 7' ' ' THR . . . . . 0.427 ' OG1' ' N ' ' A' ' 8' ' ' LEU . 1.8 t -162.32 175.16 11.87 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.2 -0.454 . . . . 75.03 111.136 179.922 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.656 HD13 ' O ' ' A' ' 72' ' ' PRO . 47.9 mt -49.98 -23.29 1.93 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.22 -0.446 . . . . 73.32 110.929 179.924 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -51.5 -32.11 26.33 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.2 -0.455 . . . . 63.31 110.885 179.836 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 80.6 mm-40 -68.11 -37.75 81.51 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.149 -0.478 . . . . 74.43 110.903 -179.917 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 22.0 m-85 -59.74 -27.98 66.97 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.214 -0.448 . . . . 72.03 110.95 -179.857 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -59.54 -37.04 77.34 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.091 -0.504 . . . . 73.1 110.911 -179.94 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 1.4 mm-40 -64.13 -45.22 89.5 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.105 -0.498 . . . . 73.31 110.84 -179.944 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 4.2 mp -67.51 -42.64 87.2 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.178 -0.464 . . . . 74.22 111.184 179.95 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 15' ' ' GLN . . . . . 0.603 ' HB3' HG21 ' A' ' 46' ' ' ILE . 62.4 mt-30 -65.59 -48.4 72.47 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.168 -0.469 . . . . 75.13 110.925 179.921 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 4.2 t -58.57 -37.22 75.28 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.223 -0.444 . . . . 71.45 110.903 -179.942 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -57.79 -33.83 68.97 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.143 -0.481 . . . . 63.13 110.913 -179.91 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 14.8 mt-10 -66.97 -38.15 85.55 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.141 -0.481 . . . . 64.32 110.9 -179.992 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.408 ' CD2' HG13 ' A' ' 46' ' ' ILE . 8.9 mp -63.42 -51.34 66.16 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.117 -0.492 . . . . 75.11 110.911 -179.96 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 3.0 pt-20 -68.48 -34.83 76.6 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.147 -0.478 . . . . 75.21 110.877 179.949 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -66.49 -50.44 63.29 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.163 -0.471 . . . . 74.15 111.107 179.923 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 22' ' ' ILE . . . . . 0.592 HD11 ' HB2' ' A' ' 115' ' ' PHE . 0.8 OUTLIER -74.21 -34.46 37.71 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.261 -0.427 . . . . 74.3 111.165 179.968 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 38.1 mtp180 -52.9 -34.8 56.55 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.192 -0.458 . . . . 71.24 110.873 179.91 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -67.13 -35.26 79.35 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.221 -0.445 . . . . 74.5 110.831 -179.762 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 25' ' ' ILE . . . . . 0.651 HD13 ' CE1' ' A' ' 115' ' ' PHE . 3.2 mt -80.05 -45.09 22.74 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.155 -0.475 . . . . 75.13 111.126 179.978 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 25.2 m-85 -107.02 45.14 1.0 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.176 -0.465 . . . . 54.22 110.907 -179.97 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 2.2 mtm -43.08 -54.07 4.56 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.191 -0.459 . . . . 73.43 110.861 179.911 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -92.99 -24.42 18.37 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.236 -0.438 . . . . 73.23 110.865 179.987 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 9.1 m-20 -86.99 28.76 0.87 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.182 -0.463 . . . . 62.0 110.861 179.968 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 30' ' ' PHE . . . . . 0.611 ' CD1' ' C ' ' A' ' 30' ' ' PHE . 0.4 OUTLIER -113.5 144.34 43.01 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.222 -0.445 . . . . 72.13 110.892 -179.917 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 31' ' ' THR . . . . . 0.4 ' N ' ' CD1' ' A' ' 30' ' ' PHE . 52.6 m -123.9 130.07 52.0 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.126 -0.488 . . . . 75.4 111.092 -179.902 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -96.92 114.14 25.74 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.204 -0.453 . . . . 42.42 110.844 179.88 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 1.113 HD23 ' N ' ' A' ' 34' ' ' THR . 0.1 OUTLIER -117.17 -18.35 10.01 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.217 -0.447 . . . . 74.14 110.894 -179.961 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 34' ' ' THR . . . . . 1.113 ' N ' HD23 ' A' ' 33' ' ' LEU . 4.9 m -34.55 94.39 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.199 -0.455 . . . . 70.44 111.122 -179.981 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 35' ' ' LYS . . . . . 0.472 ' N ' ' O ' ' A' ' 33' ' ' LEU . 0.2 OUTLIER -43.55 100.17 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.19 -0.459 . . . . 71.22 110.872 179.913 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 1.9 mmt-85 -98.85 -83.72 0.41 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.222 -0.445 . . . . 74.14 110.86 179.985 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 8.8 mmpt? -109.75 -13.41 14.49 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.255 -0.43 . . . . 71.54 110.908 179.932 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -85.77 -174.23 5.03 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.23 -0.441 . . . . 62.15 110.825 -179.878 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 4.1 m 63.07 -167.07 0.22 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.108 -0.496 . . . . 62.22 110.843 -179.807 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 40' ' ' TRP . . . . . . . . . . . . . 15.3 p90 -112.82 -12.47 13.32 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.112 -0.494 . . . . 72.22 110.943 179.994 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 2.0 t70 -123.14 138.43 54.66 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.223 -0.444 . . . . 74.41 110.821 179.944 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -123.28 73.6 1.18 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.145 -0.48 . . . . 75.31 110.867 179.973 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 1.7 mt-30 -141.55 60.79 12.25 Favored Pre-proline 0 C--N 1.329 -0.289 0 CA-C-O 121.611 0.72 . . . . 73.13 110.958 179.966 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_endo -69.78 -169.37 0.33 Allowed 'Trans proline' 0 C--N 1.341 0.157 0 C-N-CA 122.72 2.28 . . . . 72.54 112.304 -179.925 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 45' ' ' GLN . . . . . 0.808 ' HG2' HG23 ' A' ' 47' ' ' ILE . 24.5 pt20 -170.81 31.64 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.236 -0.438 . . . . 70.35 110.875 -179.964 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 46' ' ' ILE . . . . . 0.699 HG22 ' O ' ' A' ' 45' ' ' GLN . 0.1 OUTLIER 86.68 2.52 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.244 -0.435 . . . . 71.31 111.182 -179.992 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 47' ' ' ILE . . . . . 0.808 HG23 ' HG2' ' A' ' 45' ' ' GLN . 0.2 OUTLIER -66.39 147.68 12.48 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.167 -0.47 . . . . 62.24 111.113 179.864 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 48' ' ' PHE . . . . . 0.926 ' HA ' HD22 ' A' ' 33' ' ' LEU . 6.6 p90 -160.94 163.41 31.86 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.189 -0.46 . . . . 71.32 110.885 179.977 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 49' ' ' GLU . . . . . 0.782 ' HG3' HD13 ' A' ' 33' ' ' LEU . 19.1 mt-10 -110.73 157.39 19.8 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.128 -0.487 . . . . 73.5 110.878 -179.929 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 50' ' ' ILE . . . . . 0.568 HD13 ' HA ' ' A' ' 30' ' ' PHE . 9.5 mm -134.27 135.24 54.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.177 -0.465 . . . . 60.21 111.136 -179.986 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 99.7 m -85.08 135.08 34.15 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.156 -0.474 . . . . 54.41 111.131 -179.996 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 52' ' ' LEU . . . . . 0.574 HD12 HD22 ' A' ' 66' ' ' LEU . 9.1 mt -133.98 156.01 48.95 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.203 -0.453 . . . . 74.15 110.936 179.978 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 53' ' ' ARG . . . . . 0.619 ' C ' HD21 ' A' ' 125' ' ' LEU . 0.0 OUTLIER -155.92 163.43 39.77 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.174 -0.466 . . . . 74.33 110.858 179.956 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 54' ' ' SER . . . . . 0.687 ' N ' HD21 ' A' ' 125' ' ' LEU . 0.3 OUTLIER -58.72 -169.0 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.174 -0.466 . . . . 33.14 110.85 -179.753 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -82.51 -37.65 14.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.128 -0.487 . . . . 72.54 111.131 179.973 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 5.4 t0 -130.43 -153.55 0.57 Allowed 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.157 -0.474 . . . . 50.04 110.873 179.91 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 57' ' ' LYS . . . . . 0.442 ' HD2' ' CD ' ' A' ' 61' ' ' GLU . 0.5 OUTLIER -116.94 -11.09 10.85 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.213 -0.449 . . . . 73.32 110.891 -179.983 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 58' ' ' GLU . . . . . 0.548 ' HA ' ' C ' ' A' ' 59' ' ' PRO . 1.8 pt-20 -126.6 147.07 59.15 Favored Pre-proline 0 C--N 1.329 -0.3 0 CA-C-O 121.664 0.745 . . . . 64.42 110.888 179.982 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 59' ' ' PRO . . . . . 0.548 ' C ' ' HA ' ' A' ' 58' ' ' GLU . 53.6 Cg_endo -69.75 -8.38 10.45 Favored 'Cis proline' 0 C--N 1.342 0.217 0 C-N-CA 122.679 -1.8 . . . . 75.53 112.353 0.011 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 60' ' ' VAL . . . . . 0.43 HG21 ' CG ' ' A' ' 88' ' ' ASN . 14.1 m -149.11 164.77 4.04 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.198 -0.455 . . . . 65.43 111.143 179.924 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 61' ' ' GLU . . . . . 0.442 ' CD ' ' HD2' ' A' ' 57' ' ' LYS . 1.9 tp10 -93.95 -28.2 15.93 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.226 -0.443 . . . . 74.21 110.872 -179.919 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 62' ' ' SER . . . . . 0.869 ' HB3' HD11 ' A' ' 125' ' ' LEU . 5.1 t 40.42 93.82 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.146 -0.479 . . . . 62.4 110.885 -179.796 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 63' ' ' SER . . . . . 0.429 ' HB2' ' CG ' ' A' ' 53' ' ' ARG . 1.3 t -115.17 123.76 49.73 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.142 -0.481 . . . . 43.14 110.845 -179.801 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 64' ' ' ILE . . . . . 0.666 HD13 HD11 ' A' ' 94' ' ' LEU . 38.0 mt -134.8 137.49 50.83 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 116.165 -0.471 . . . . 53.01 111.134 179.934 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 51.6 m -100.16 114.6 28.11 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.159 -0.473 . . . . 73.41 111.156 179.956 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 66' ' ' LEU . . . . . 0.945 HD21 HG21 ' A' ' 121' ' ' THR . 1.5 mp -94.04 111.46 23.18 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.22 -0.445 . . . . 72.13 110.887 179.966 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 1.5 t60 -102.77 111.4 23.7 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.184 -0.462 . . . . 53.11 110.844 179.831 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 68' ' ' PHE . . . . . 0.571 ' CE1' HG23 ' A' ' 114' ' ' ILE . 0.0 OUTLIER -103.83 142.38 34.48 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.199 -0.455 . . . . 70.02 110.904 -179.944 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -124.8 121.94 36.0 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.121 -0.491 . . . . 43.4 111.116 179.93 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 70' ' ' MET . . . . . 0.544 ' CE ' HD11 ' A' ' 114' ' ' ILE . 0.0 OUTLIER -86.61 91.41 8.57 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.205 -0.452 . . . . 75.44 110.869 179.987 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -43.87 157.24 0.28 Allowed Pre-proline 0 C--N 1.33 -0.256 0 CA-C-O 121.589 0.709 . . . . 72.53 111.118 -179.932 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 72' ' ' PRO . . . . . 0.656 ' O ' HD13 ' A' ' 8' ' ' LEU . 53.9 Cg_endo -69.7 2.21 3.71 Favored 'Trans proline' 0 C--N 1.341 0.169 0 C-N-CA 122.671 2.247 . . . . 54.32 112.364 179.93 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 73' ' ' MET . . . . . 0.492 ' O ' ' CB ' ' A' ' 76' ' ' TYR . 0.1 OUTLIER -118.57 -25.84 6.33 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.208 -0.451 . . . . 75.1 110.884 179.943 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 74' ' ' TYR . . . . . 0.658 ' CD1' ' C ' ' A' ' 74' ' ' TYR . 0.0 OUTLIER -47.66 150.45 1.8 Allowed Pre-proline 0 C--N 1.329 -0.316 0 CA-C-O 121.697 0.76 . . . . 73.4 110.915 -179.875 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 75' ' ' PRO . . . . . 0.552 ' C ' ' HA ' ' A' ' 74' ' ' TYR . 53.4 Cg_endo -69.76 -10.97 11.76 Favored 'Cis proline' 0 C--N 1.341 0.182 0 C-N-CA 122.68 -1.8 . . . . 72.42 112.348 -0.038 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 76' ' ' TYR . . . . . 0.492 ' CB ' ' O ' ' A' ' 73' ' ' MET . 25.0 t80 -34.03 -52.21 0.44 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.189 -0.459 . . . . 71.53 110.934 -179.879 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 31.0 p -106.46 -175.74 2.88 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.075 -0.511 . . . . 75.12 111.066 -179.938 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -100.96 132.37 22.13 Favored Pre-proline 0 C--N 1.329 -0.306 0 CA-C-O 121.552 0.691 . . . . 61.23 111.08 179.89 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 79' ' ' PRO . . . . . 0.711 ' HG3' HD11 ' A' ' 113' ' ' ILE . 53.7 Cg_endo -69.71 -167.52 0.23 Allowed 'Trans proline' 0 C--N 1.341 0.155 0 C-N-CA 122.672 2.248 . . . . 61.14 112.339 179.969 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 80' ' ' GLU . . . . . 0.576 ' O ' HD13 ' A' ' 81' ' ' ILE . 1.7 tt0 -130.0 142.63 50.61 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.164 -0.471 . . . . 61.23 110.905 -179.983 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 81' ' ' ILE . . . . . 0.576 HD13 ' O ' ' A' ' 80' ' ' GLU . 6.1 mm -133.94 141.68 43.31 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.18 -0.464 . . . . 71.13 111.135 -179.996 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 82' ' ' GLU . . . . . 0.473 ' HG3' ' CD ' ' A' ' 84' ' ' LYS . 3.5 pt-20 -147.44 140.3 24.94 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.211 -0.45 . . . . 71.33 110.878 179.995 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 83' ' ' PHE . . . . . 0.511 ' CD1' HD11 ' A' ' 66' ' ' LEU . 11.8 m-85 -95.71 140.98 29.74 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.114 -0.493 . . . . 64.31 110.847 -179.899 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 84' ' ' LYS . . . . . 0.473 ' CD ' ' HG3' ' A' ' 82' ' ' GLU . 9.8 mmmt -124.53 171.01 10.34 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.149 -0.478 . . . . 55.5 110.895 179.965 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 85' ' ' ASN . . . . . 0.4 ' C ' HG22 ' A' ' 86' ' ' VAL . 3.2 m120 63.35 -73.17 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.241 -0.436 . . . . 65.13 110.891 179.899 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 86' ' ' VAL . . . . . 0.672 HG11 HD21 ' A' ' 94' ' ' LEU . 2.7 m 40.96 94.5 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.142 -0.481 . . . . 62.44 111.125 179.893 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -97.13 -83.29 0.39 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.136 -0.484 . . . . 62.15 110.946 179.98 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 88' ' ' ASN . . . . . 0.43 ' CG ' HG21 ' A' ' 60' ' ' VAL . 13.2 t30 -59.99 -40.46 89.26 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.209 -0.45 . . . . 73.43 110.879 -179.984 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 89' ' ' VAL . . . . . 1.084 HG21 HD13 ' A' ' 94' ' ' LEU . 0.9 OUTLIER -62.58 141.03 18.5 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.157 -0.474 . . . . 74.32 111.109 179.953 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 90' ' ' MET . . . . . . . . . . . . . 6.8 mtm -97.22 -67.25 0.86 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.149 -0.478 . . . . 71.33 110.848 179.935 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 6.8 p-10 178.77 -32.4 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.249 -0.432 . . . . 74.41 110.889 179.997 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -54.55 -46.45 73.64 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.175 -0.466 . . . . 43.31 110.882 -179.757 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 93' ' ' GLN . . . . . 0.601 ' OE1' ' CE2' ' A' ' 128' ' ' PHE . 1.5 pt20 -70.87 -36.84 72.97 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.136 -0.484 . . . . 72.31 110.943 -179.98 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 94' ' ' LEU . . . . . 1.084 HD13 HG21 ' A' ' 89' ' ' VAL . 0.6 OUTLIER -57.66 -47.42 82.31 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.185 -0.461 . . . . 72.51 110.967 179.991 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 3.5 mm-40 -62.93 -34.09 76.73 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.193 -0.458 . . . . 72.11 110.913 179.89 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 96' ' ' MET . . . . . . . . . . . . . 19.1 ttp -59.95 -40.04 87.61 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.173 -0.467 . . . . 65.13 110.912 179.943 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 97' ' ' LEU . . . . . 0.599 ' O ' ' CD1' ' A' ' 101' ' ' PHE . 27.0 mt -68.02 -40.78 82.87 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.204 -0.453 . . . . 71.33 110.914 179.98 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 98' ' ' LYS . . . . . 0.487 ' HD3' ' CE2' ' A' ' 83' ' ' PHE . 3.7 mmtp -57.26 -36.52 71.08 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.178 -0.465 . . . . 63.45 110.899 179.857 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -68.93 -43.73 74.51 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.209 -0.45 . . . . 74.21 110.847 -179.897 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 100' ' ' GLU . . . . . 0.406 ' O ' HD12 ' A' ' 104' ' ' ILE . 37.3 mm-40 -66.82 -24.0 66.11 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.173 -0.467 . . . . 75.05 110.905 -179.959 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 101' ' ' PHE . . . . . 0.627 ' CD2' HD11 ' A' ' 117' ' ' ILE . 11.1 m-30 -60.53 -37.08 80.03 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.148 -0.478 . . . . 74.34 110.917 -179.972 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 1.7 tmpt? -63.96 -40.22 95.93 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.112 -0.495 . . . . 75.32 110.878 -180.0 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 2.3 mppt? -69.48 -40.35 77.12 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.226 -0.443 . . . . 63.25 110.89 179.868 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 104' ' ' ILE . . . . . 0.455 ' O ' ' CG2' ' A' ' 107' ' ' THR . 4.3 mt -64.12 -47.62 89.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.218 -0.446 . . . . 64.42 111.08 179.913 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 105' ' ' HIS . . . . . 0.474 ' O ' ' N ' ' A' ' 109' ' ' ARG . 3.4 t60 -62.56 -41.28 98.81 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.207 -0.451 . . . . 72.11 110.854 179.898 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 1.3 t-20 -57.66 -36.95 72.58 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.244 -0.435 . . . . 72.22 110.905 -179.946 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 107' ' ' THR . . . . . 0.455 ' CG2' ' O ' ' A' ' 104' ' ' ILE . 5.1 t -84.93 -26.1 27.45 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.149 -0.478 . . . . 65.22 111.141 179.995 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 108' ' ' SER . . . . . 0.49 ' OG ' HG22 ' A' ' 113' ' ' ILE . 27.5 p -109.05 20.87 17.9 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.251 -0.431 . . . . 72.32 110.885 -179.893 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 109' ' ' ARG . . . . . 0.474 ' N ' ' O ' ' A' ' 105' ' ' HIS . 11.6 ttt180 -62.83 77.48 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.104 -0.498 . . . . 70.32 110.875 -179.926 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 110' ' ' GLY . . . . . 0.427 ' N ' ' O ' ' A' ' 108' ' ' SER . . . 136.67 33.55 0.23 Allowed Glycine 0 N--CA 1.451 -0.365 0 C-N-CA 120.745 -0.741 . . . . 73.44 112.488 -179.977 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 111' ' ' GLN . . . . . . . . . . . . . 3.9 pt20 -170.12 -166.27 0.53 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.735 0.302 . . . . 73.32 110.897 -179.898 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 15.2 mt-10 -68.98 129.98 41.46 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.218 -0.446 . . . . 74.03 110.914 -179.926 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 113' ' ' ILE . . . . . 0.711 HD11 ' HG3' ' A' ' 79' ' ' PRO . 22.4 pt -126.69 -8.15 4.83 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.202 -0.453 . . . . 71.32 111.139 179.947 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 114' ' ' ILE . . . . . 0.663 ' O ' HG23 ' A' ' 118' ' ' THR . 42.3 mm -64.88 -44.17 96.25 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-N 116.189 -0.46 . . . . 64.23 111.127 179.8 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 115' ' ' PHE . . . . . 0.651 ' CE1' HD13 ' A' ' 25' ' ' ILE . 19.2 t80 -68.85 -35.24 76.69 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.208 -0.451 . . . . 73.42 110.884 179.966 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 35.5 mm-40 -66.48 -46.03 77.69 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.127 -0.488 . . . . 61.53 110.877 -179.943 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 117' ' ' ILE . . . . . 0.627 HD11 ' CD2' ' A' ' 101' ' ' PHE . 0.4 OUTLIER -64.03 -40.81 90.38 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.149 -0.478 . . . . 73.25 111.168 179.983 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 118' ' ' THR . . . . . 0.663 HG23 ' O ' ' A' ' 114' ' ' ILE . 67.7 p -68.25 -41.56 80.98 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.129 -0.487 . . . . 54.33 111.136 179.974 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 1.2 t -67.98 -43.5 78.82 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.215 -0.448 . . . . 74.14 110.871 -179.852 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -66.64 -41.56 88.07 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.174 -0.466 . . . . 74.52 110.87 -179.971 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 121' ' ' THR . . . . . 0.945 HG21 HD21 ' A' ' 66' ' ' LEU . 11.9 p -67.66 -39.18 84.56 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.119 -0.491 . . . . 51.23 111.133 -179.926 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 59.1 tt0 -64.99 -50.64 65.53 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.245 -0.434 . . . . 74.35 110.899 -179.981 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 123' ' ' GLU . . . . . 0.453 ' HG3' ' N ' ' A' ' 124' ' ' LYS . 12.3 pt-20 -60.16 -36.38 77.43 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.173 -0.467 . . . . 62.3 110.882 -179.921 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 124' ' ' LYS . . . . . 0.49 ' HA ' ' CG ' ' A' ' 127' ' ' GLU . 0.0 OUTLIER -78.52 -32.36 47.99 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.144 -0.48 . . . . 60.31 110.91 179.942 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 125' ' ' LEU . . . . . 0.869 HD11 ' HB3' ' A' ' 62' ' ' SER . 0.5 OUTLIER -72.25 -41.48 66.74 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.217 -0.447 . . . . 61.51 110.952 179.903 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -70.37 -46.28 64.4 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.151 -0.477 . . . . 63.05 110.896 179.835 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 127' ' ' GLU . . . . . 0.571 ' CD ' ' N ' ' A' ' 128' ' ' PHE . 3.1 pp20? -59.15 -50.82 72.56 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.153 -0.476 . . . . 63.44 110.859 -179.91 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 128' ' ' PHE . . . . . 0.601 ' CE2' ' OE1' ' A' ' 93' ' ' GLN . 0.0 OUTLIER -59.41 -37.3 77.7 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.145 -0.479 . . . . 75.12 110.873 -179.881 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 129' ' ' GLN . . . . . 0.417 ' CG ' HG22 ' A' ' 60' ' ' VAL . 1.1 tm0? -72.97 -18.54 61.36 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.122 -0.49 . . . . 73.21 110.885 -179.957 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 130' ' ' ASN . . . . . . . . . . . . . 44.8 t30 -58.05 -70.76 0.13 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.234 -0.439 . . . . 63.23 110.868 -179.889 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 131' ' ' VAL . . . . . 0.418 ' O ' ' C ' ' A' ' 132' ' ' VAL . 40.1 t -136.96 -32.76 0.36 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.177 -0.465 . . . . 72.15 111.148 179.878 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 132' ' ' VAL . . . . . 0.477 ' CG2' ' HA ' ' A' ' 128' ' ' PHE . 26.7 t -35.76 153.7 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 116.167 -0.469 . . . . 73.21 111.135 179.914 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 133' ' ' ASN . . . . . 0.453 ' C ' ' O ' ' A' ' 132' ' ' VAL . 0.8 OUTLIER -32.76 97.09 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.183 -0.462 . . . . 73.43 110.922 179.993 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 134' ' ' THR . . . . . 0.606 HG22 ' H ' ' A' ' 135' ' ' GLN . 0.2 OUTLIER -98.8 -166.09 1.32 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.183 -0.462 . . . . 72.5 111.141 -179.975 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 135' ' ' GLN . . . . . 0.606 ' H ' HG22 ' A' ' 134' ' ' THR . 5.6 tp60 -157.72 130.54 7.45 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.205 -0.452 . . . . 73.03 110.951 179.988 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 136' ' ' SER . . . . . 0.419 ' O ' ' C ' ' A' ' 137' ' ' LEU . 20.1 m -85.93 51.72 2.28 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.242 -0.435 . . . . 33.43 110.866 -179.792 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 137' ' ' LEU . . . . . 0.419 ' C ' ' O ' ' A' ' 136' ' ' SER . 0.4 OUTLIER 36.23 79.66 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.177 -0.465 . . . . 73.04 110.928 -179.954 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 14.9 pt-20 . . . . . 0 C--N 1.329 -0.293 0 CA-C-N 116.22 -0.446 . . . . 61.02 110.917 179.934 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . 0.687 HD13 ' O ' ' A' ' 72' ' ' PRO . 11.0 mt . . . . . 0 C--O 1.231 0.129 0 CA-C-O 120.845 0.355 . . . . 71.109999999999999 110.954 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 -53.02 -32.18 45.26 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.156 -0.475 . . . . 75.140000000000001 110.834 179.868 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 62.8 mm-40 -64.84 -38.42 90.92 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.193 -0.458 . . . . 60.5 110.893 -179.84 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' TYR . . . . . 0.421 ' CD1' ' HD2' ' A' ' 75' ' ' PRO . 20.7 m-85 -64.16 -25.18 67.97 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.183 -0.462 . . . . 74.120000000000005 110.946 -179.887 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -58.98 -37.4 76.72 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.142 -0.481 . . . . 74.230000000000004 110.926 -179.957 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 1.6 mm-40 -65.91 -43.35 88.44 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.125 -0.489 . . . . 73.439999999999998 110.909 179.978 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 4.3 mp -67.22 -43.24 88.44 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 116.135 -0.484 . . . . 61.100000000000001 111.152 179.968 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . 0.543 ' HB3' HG21 ' A' ' 46' ' ' ILE . 81.7 mt-30 -64.69 -46.28 83.03 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.152 -0.476 . . . . 73.209999999999994 110.911 179.965 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 38.9 t -60.96 -38.84 87.33 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.182 -0.463 . . . . 72.219999999999999 110.847 -179.931 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 1.5 m-20 -58.79 -33.87 70.83 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.172 -0.467 . . . . 74.030000000000001 110.899 -179.878 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 15.6 mt-10 -67.71 -38.59 83.81 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.16 -0.473 . . . . 63.219999999999999 110.865 -179.954 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.469 HD13 ' O ' ' A' ' 15' ' ' GLN . 9.8 mp -61.48 -51.68 67.67 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.176 -0.466 . . . . 75.030000000000001 110.932 179.989 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 2.5 pt-20 -68.86 -34.6 75.73 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.192 -0.458 . . . . 75.140000000000001 110.895 179.958 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -65.35 -45.79 82.77 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.142 -0.481 . . . . 72.530000000000001 111.114 179.948 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . 0.783 ' HA ' HD12 ' A' ' 25' ' ' ILE . 0.5 OUTLIER -77.2 -34.59 21.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.186 -0.461 . . . . 73.340000000000003 111.14 179.944 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -53.39 -35.59 60.53 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.177 -0.465 . . . . 75.400000000000006 110.841 179.98 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -66.79 -31.43 72.06 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.167 -0.47 . . . . 72.150000000000006 110.863 -179.77 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . 0.783 HD12 ' HA ' ' A' ' 22' ' ' ILE . 5.0 mt -79.72 -45.09 23.3 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.163 -0.472 . . . . 73.109999999999999 111.112 179.943 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 38.4 m-85 -111.51 45.73 1.18 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.187 -0.46 . . . . 74.310000000000002 110.928 -179.988 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' MET . . . . . 0.44 ' HE2' ' H ' ' A' ' 27' ' ' MET . 0.2 OUTLIER -40.85 -40.56 1.39 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.131 -0.486 . . . . 73.319999999999993 110.884 179.909 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 11.4 m-20 -106.07 -27.2 11.27 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.204 -0.453 . . . . 75.120000000000005 110.887 179.942 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 10.7 m-20 -85.05 29.57 0.64 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.196 -0.456 . . . . 73.040000000000006 110.853 179.998 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' PHE . . . . . 0.545 ' C ' ' CD1' ' A' ' 30' ' ' PHE . 0.3 OUTLIER -113.21 146.04 39.98 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.229 -0.442 . . . . 64.340000000000003 110.853 -179.929 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 42.5 m -122.89 132.9 54.38 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.117 -0.492 . . . . 64.010000000000005 111.17 -179.928 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -98.33 114.72 27.12 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.257 -0.428 . . . . 75.200000000000003 110.852 179.923 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.952 HD21 HG12 ' A' ' 47' ' ' ILE . 0.3 OUTLIER -120.53 -16.47 8.31 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.147 -0.479 . . . . 74.040000000000006 110.951 -179.982 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . 0.787 ' N ' HD23 ' A' ' 33' ' ' LEU . 0.9 OUTLIER . . . . . 0 C--N 1.33 -0.273 0 CA-C-N 116.154 -0.476 . . . . 72.540000000000006 111.14 179.918 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 45' ' ' GLN . . . . . 0.614 ' HB3' HD12 ' A' ' 47' ' ' ILE . 32.0 tt0 . . . . . 0 C--O 1.23 0.063 0 CA-C-O 120.798 0.332 . . . . 73.340000000000003 110.957 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 46' ' ' ILE . . . . . 0.576 HG22 ' O ' ' A' ' 45' ' ' GLN . 0.0 OUTLIER 84.1 -28.26 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.147 -0.479 . . . . 72.430000000000007 111.134 179.958 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . 0.952 HG12 HD21 ' A' ' 33' ' ' LEU . 0.2 OUTLIER -43.32 148.3 0.21 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.157 -0.474 . . . . 74.209999999999994 111.12 179.866 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 48' ' ' PHE . . . . . 0.768 ' HA ' HD22 ' A' ' 33' ' ' LEU . 5.8 p90 -156.53 158.05 36.48 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.197 -0.456 . . . . 70.019999999999996 110.909 179.933 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . 0.701 ' CG ' HD13 ' A' ' 33' ' ' LEU . 40.1 mt-10 -108.99 152.0 25.56 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.128 -0.487 . . . . 73.230000000000004 110.846 -179.891 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . 0.458 HD13 ' HA ' ' A' ' 30' ' ' PHE . 23.2 mm -131.46 137.03 56.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.157 -0.474 . . . . 71.420000000000002 111.101 179.963 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 75.9 m -84.67 124.3 31.33 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.164 -0.471 . . . . 73.349999999999994 111.104 179.974 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . 0.63 HD12 HD22 ' A' ' 66' ' ' LEU . 20.7 mt -126.8 159.55 33.49 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.222 -0.445 . . . . 61.340000000000003 110.886 179.95 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 53' ' ' ARG . . . . . 0.517 ' C ' HD21 ' A' ' 125' ' ' LEU . 0.1 OUTLIER -179.88 168.23 1.31 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.166 -0.47 . . . . 74.450000000000003 110.931 179.944 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . 0.659 ' N ' HD21 ' A' ' 125' ' ' LEU . 16.3 p -56.14 -173.26 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.22 -0.445 . . . . 44.420000000000002 110.869 -179.808 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 18.1 m -94.21 -28.1 4.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.135 -0.484 . . . . 74.200000000000003 111.105 179.94 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 1.6 t0 -121.55 -164.07 1.11 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.224 -0.444 . . . . 71.530000000000001 110.862 179.966 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 3.1 mmmm -118.39 -12.88 9.82 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.196 -0.456 . . . . 72.420000000000002 110.89 179.987 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . 0.563 ' HA ' ' C ' ' A' ' 59' ' ' PRO . 68.1 mt-10 -121.38 145.51 42.61 Favored Pre-proline 0 C--N 1.329 -0.287 0 CA-C-O 121.636 0.732 . . . . 73.040000000000006 110.895 179.972 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 59' ' ' PRO . . . . . 0.563 ' C ' ' HA ' ' A' ' 58' ' ' GLU . 53.7 Cg_endo -69.75 -9.42 10.98 Favored 'Cis proline' 0 C--O 1.231 0.172 0 C-N-CA 122.701 -1.791 . . . . 73.099999999999994 112.326 0.035 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 21.7 m -146.31 178.96 1.06 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.241 -0.436 . . . . 75.329999999999998 111.134 179.91 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . 0.458 ' O ' ' C ' ' A' ' 62' ' ' SER . 15.2 tt0 -108.04 -18.43 13.79 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.169 -0.469 . . . . 65.0 110.886 -179.933 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 62' ' ' SER . . . . . 0.458 ' C ' ' O ' ' A' ' 61' ' ' GLU . 0.9 OUTLIER 33.8 77.56 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.167 -0.47 . . . . 61.020000000000003 110.87 -179.794 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -102.87 126.76 50.15 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.143 -0.48 . . . . 63.43 110.849 -179.804 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 64' ' ' ILE . . . . . . . . . . . . . 21.1 mt -140.24 143.29 29.88 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 116.175 -0.466 . . . . 70.030000000000001 111.102 179.947 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 92.1 m -106.98 118.94 38.02 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.169 -0.469 . . . . 63.240000000000002 111.083 179.99 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . 0.71 HD21 HG21 ' A' ' 121' ' ' THR . 1.7 mp -100.09 114.0 27.03 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.198 -0.456 . . . . 70.200000000000003 110.924 179.913 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 67' ' ' HIS . . . . . 0.492 ' CE1' HD11 ' A' ' 33' ' ' LEU . 7.5 t60 -108.4 113.28 26.22 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.233 -0.44 . . . . 75.430000000000007 110.798 179.888 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 68' ' ' PHE . . . . . 0.56 ' CE1' HG23 ' A' ' 114' ' ' ILE . 0.0 OUTLIER -103.98 139.96 38.38 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.197 -0.456 . . . . 74.409999999999997 110.866 -179.937 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -119.66 119.46 33.79 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.135 -0.484 . . . . 73.030000000000001 111.108 179.94 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 70' ' ' MET . . . . . 0.491 ' CE ' HD11 ' A' ' 114' ' ' ILE . 2.5 mmt -84.25 89.41 7.33 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.223 -0.444 . . . . 74.409999999999997 110.919 179.946 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -45.02 157.76 0.32 Allowed Pre-proline 0 C--N 1.33 -0.274 0 CA-C-O 121.583 0.706 . . . . 71.129999999999995 111.124 -179.903 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 72' ' ' PRO . . . . . 0.687 ' O ' HD13 ' A' ' 8' ' ' LEU . 54.0 Cg_endo -69.77 2.87 3.15 Favored 'Trans proline' 0 C--N 1.341 0.173 0 C-N-CA 122.643 2.229 . . . . 53.009999999999998 112.368 179.899 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 73' ' ' MET . . . . . 0.486 ' O ' ' CB ' ' A' ' 76' ' ' TYR . 0.0 OUTLIER -117.7 -26.38 6.58 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.23 -0.441 . . . . 74.030000000000001 110.879 179.918 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 74' ' ' TYR . . . . . 0.637 ' CD1' ' C ' ' A' ' 74' ' ' TYR . 0.0 OUTLIER -47.14 148.71 1.95 Allowed Pre-proline 0 C--N 1.328 -0.327 0 CA-C-O 121.712 0.768 . . . . 64.129999999999995 110.915 -179.862 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 75' ' ' PRO . . . . . 0.561 ' C ' ' HA ' ' A' ' 74' ' ' TYR . 54.1 Cg_endo -69.78 -13.46 12.44 Favored 'Cis proline' 0 C--N 1.342 0.185 0 C-N-CA 122.67 -1.804 . . . . 74.140000000000001 112.361 -0.009 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 76' ' ' TYR . . . . . 0.486 ' CB ' ' O ' ' A' ' 73' ' ' MET . 9.4 t80 -34.95 -46.3 0.3 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.207 -0.452 . . . . 62.439999999999998 110.867 -179.866 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 77' ' ' THR . . . . . 0.449 HG23 ' CB ' ' A' ' 73' ' ' MET . 66.7 p -111.58 177.7 4.57 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.14 -0.482 . . . . 75.450000000000003 111.16 -179.953 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -98.33 135.03 21.39 Favored Pre-proline 0 C--N 1.328 -0.327 0 CA-C-O 121.578 0.704 . . . . 72.239999999999995 111.058 179.893 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 79' ' ' PRO . . . . . 0.806 ' HG3' HD11 ' A' ' 113' ' ' ILE . 53.5 Cg_endo -69.74 -167.27 0.22 Allowed 'Trans proline' 0 C--N 1.341 0.159 0 C-N-CA 122.667 2.245 . . . . 33.509999999999998 112.374 179.97 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -131.09 127.23 37.72 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.259 -0.428 . . . . 51.140000000000001 110.853 -179.97 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 81' ' ' ILE . . . . . 0.507 HD13 ' HA ' ' A' ' 68' ' ' PHE . 10.0 mm -119.54 140.59 43.03 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.144 -0.48 . . . . 74.329999999999998 111.202 179.9 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . 0.471 ' HG3' ' CD ' ' A' ' 84' ' ' LYS . 1.0 OUTLIER -146.27 137.92 24.79 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.229 -0.441 . . . . 71.230000000000004 110.908 179.969 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 83' ' ' PHE . . . . . 0.45 ' CD1' HD11 ' A' ' 66' ' ' LEU . 9.9 m-85 -93.48 140.0 30.08 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.158 -0.474 . . . . 71.340000000000003 110.871 -179.919 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 84' ' ' LYS . . . . . 0.471 ' CD ' ' HG3' ' A' ' 82' ' ' GLU . 10.6 mmmt -123.78 172.0 9.2 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.14 -0.482 . . . . 74.129999999999995 110.914 179.956 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 85' ' ' ASN . . . . . 0.478 HD22 ' N ' ' A' ' 85' ' ' ASN . 1.5 m-80 62.8 -74.19 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.23 -0.441 . . . . 74.109999999999999 110.947 179.971 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 86' ' ' VAL . . . . . 0.522 HG12 HD21 ' A' ' 94' ' ' LEU . 3.5 m 41.54 91.15 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.158 -0.473 . . . . 74.439999999999998 111.078 179.859 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -97.19 -85.72 0.35 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.179 -0.464 . . . . 72.540000000000006 110.893 179.979 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -52.58 -46.38 66.87 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.222 -0.444 . . . . 74.299999999999997 110.865 -179.943 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 89' ' ' VAL . . . . . 0.479 HG21 ' CD2' ' A' ' 94' ' ' LEU . 0.7 OUTLIER -60.45 141.38 17.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.221 -0.445 . . . . 71.120000000000005 111.154 179.926 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 90' ' ' MET . . . . . 0.432 ' C ' ' OD1' ' A' ' 91' ' ' ASP . 7.6 mtm -95.71 -54.76 3.24 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.181 -0.463 . . . . 75.140000000000001 110.895 179.979 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 91' ' ' ASP . . . . . 0.432 ' OD1' ' C ' ' A' ' 90' ' ' MET . 1.3 p-10 175.36 -34.58 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.184 -0.462 . . . . 63.5 110.874 179.911 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -54.55 -40.27 68.53 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.238 -0.437 . . . . 74.219999999999999 110.826 -179.77 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 93' ' ' GLN . . . . . 0.577 ' HG3' ' CZ ' ' A' ' 128' ' ' PHE . 1.5 mp0 -70.98 -37.46 72.74 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.134 -0.484 . . . . 70.430000000000007 110.95 -179.979 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . 0.522 HD21 HG12 ' A' ' 86' ' ' VAL . 39.5 mt -65.58 -49.21 69.68 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.187 -0.461 . . . . 75.120000000000005 110.941 179.95 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 41.2 mt-30 -65.91 -34.02 77.17 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.141 -0.481 . . . . 65.150000000000006 110.904 179.937 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 96' ' ' MET . . . . . . . . . . . . . 2.3 ttp -60.08 -41.15 91.83 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.194 -0.457 . . . . 75.230000000000004 110.839 -179.971 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 97' ' ' LEU . . . . . 0.855 HD22 HG22 ' A' ' 121' ' ' THR . 34.3 mt -65.99 -39.69 90.52 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.201 -0.454 . . . . 63.43 110.871 -179.941 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 98' ' ' LYS . . . . . 0.411 ' HD3' ' CZ ' ' A' ' 83' ' ' PHE . 3.2 mmtp -55.31 -39.33 69.8 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.19 -0.459 . . . . 74.219999999999999 110.892 179.846 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -66.24 -37.84 86.46 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.239 -0.437 . . . . 44.219999999999999 110.89 -179.917 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 100' ' ' GLU . . . . . 0.611 ' O ' HD12 ' A' ' 104' ' ' ILE . 2.4 mm-40 -74.14 -24.57 59.44 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.113 -0.494 . . . . 64.239999999999995 110.818 -179.924 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 101' ' ' PHE . . . . . 0.621 ' CD2' HD11 ' A' ' 117' ' ' ILE . 10.8 m-30 -59.38 -26.88 65.48 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.222 -0.444 . . . . 73.120000000000005 110.935 -179.929 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.27 -42.98 64.97 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.107 -0.497 . . . . 64.510000000000005 110.899 179.968 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.76 -40.87 84.0 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.213 -0.449 . . . . 64.340000000000003 110.917 179.862 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 104' ' ' ILE . . . . . 0.66 HD11 ' CD2' ' A' ' 120' ' ' PHE . 2.6 mt -63.55 -47.6 90.74 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.225 -0.443 . . . . 72.349999999999994 111.111 179.863 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 105' ' ' HIS . . . . . 0.478 ' O ' ' N ' ' A' ' 109' ' ' ARG . 28.2 t-80 -62.89 -42.51 99.8 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.148 -0.478 . . . . 71.510000000000005 110.888 179.912 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -56.52 -40.9 75.81 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.164 -0.471 . . . . 74.019999999999996 110.865 -179.924 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 107' ' ' THR . . . . . 0.449 HG22 ' O ' ' A' ' 104' ' ' ILE . 8.0 t -80.47 -31.18 37.42 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.222 -0.444 . . . . 55.340000000000003 111.146 -179.97 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 108' ' ' SER . . . . . 0.706 ' HB3' HG22 ' A' ' 113' ' ' ILE . 0.5 OUTLIER -103.9 21.91 15.48 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.201 -0.454 . . . . 43.439999999999998 110.877 -179.901 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 109' ' ' ARG . . . . . 0.478 ' N ' ' O ' ' A' ' 105' ' ' HIS . 0.0 OUTLIER -62.0 84.9 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.125 -0.488 . . . . 71.340000000000003 110.846 -179.93 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 110' ' ' GLY . . . . . 0.443 ' HA2' ' CB ' ' A' ' 75' ' ' PRO . . . 134.19 -23.15 3.7 Favored Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.705 -0.759 . . . . 65.219999999999999 112.452 179.988 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 111' ' ' GLN . . . . . . . . . . . . . 2.6 pt20 -109.06 -171.81 1.92 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.757 0.313 . . . . 73.530000000000001 110.894 -179.858 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 20.1 mt-10 -66.03 134.55 53.13 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.181 -0.463 . . . . 75.540000000000006 110.905 -179.987 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 113' ' ' ILE . . . . . 0.806 HD11 ' HG3' ' A' ' 79' ' ' PRO . 24.8 pt -123.23 -7.8 7.88 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.172 -0.467 . . . . 75.230000000000004 111.154 179.915 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 114' ' ' ILE . . . . . 0.83 ' O ' HG23 ' A' ' 118' ' ' THR . 28.6 mm -64.18 -44.19 97.46 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.161 -0.472 . . . . 73.209999999999994 111.101 179.865 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 115' ' ' PHE . . . . . 0.716 ' CD1' HD13 ' A' ' 25' ' ' ILE . 28.2 t80 -72.08 -36.9 69.65 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.194 -0.457 . . . . 71.439999999999998 110.864 179.99 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 50.2 mm-40 -65.93 -47.63 74.08 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.165 -0.47 . . . . 72.129999999999995 110.868 -179.927 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 117' ' ' ILE . . . . . 0.621 HD11 ' CD2' ' A' ' 101' ' ' PHE . 0.9 OUTLIER -64.26 -41.55 92.74 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.19 -0.459 . . . . 51.340000000000003 111.127 179.965 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 118' ' ' THR . . . . . 0.83 HG23 ' O ' ' A' ' 114' ' ' ILE . 71.1 p -68.03 -42.55 80.44 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.192 -0.458 . . . . 74.329999999999998 111.14 179.975 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 2.8 m -66.88 -43.48 83.4 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.249 -0.432 . . . . 54.25 110.861 -179.859 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 120' ' ' PHE . . . . . 0.66 ' CD2' HD11 ' A' ' 104' ' ' ILE . 0.3 OUTLIER -61.78 -47.65 84.23 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.115 -0.493 . . . . 73.219999999999999 110.871 -179.941 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 121' ' ' THR . . . . . 0.855 HG22 HD22 ' A' ' 97' ' ' LEU . 73.4 p -67.81 -40.76 83.83 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.13 -0.486 . . . . 61.140000000000001 111.116 -179.893 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 47.6 tt0 -64.3 -48.8 74.26 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.203 -0.453 . . . . 55.350000000000001 110.896 -179.94 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 123' ' ' GLU . . . . . 0.54 ' CG ' ' N ' ' A' ' 124' ' ' LYS . 3.5 pt-20 -61.84 -50.54 71.85 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.194 -0.457 . . . . 74.239999999999995 110.855 -179.929 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 124' ' ' LYS . . . . . 0.54 ' N ' ' CG ' ' A' ' 123' ' ' GLU . 0.0 OUTLIER -65.6 -37.18 85.88 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.159 -0.473 . . . . 63.340000000000003 110.871 -179.991 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 125' ' ' LEU . . . . . 0.659 HD21 ' N ' ' A' ' 54' ' ' SER . 1.1 tp -64.34 -51.5 63.09 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.249 -0.432 . . . . 71.540000000000006 110.912 179.901 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -57.2 -45.4 83.82 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.212 -0.449 . . . . 62.409999999999997 110.878 179.86 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 127' ' ' GLU . . . . . 0.448 ' HG3' ' N ' ' A' ' 128' ' ' PHE . 0.4 OUTLIER -61.27 -29.39 69.82 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.218 -0.446 . . . . 74.219999999999999 110.851 -179.885 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 128' ' ' PHE . . . . . 0.577 ' CZ ' ' HG3' ' A' ' 93' ' ' GLN . 0.3 OUTLIER . . . . . 0 C--N 1.329 -0.323 0 CA-C-N 116.18 -0.463 . . . . 71.310000000000002 110.863 -179.942 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . 0.532 HD13 ' O ' ' A' ' 72' ' ' PRO . 24.4 mt . . . . . 0 C--O 1.231 0.101 0 CA-C-O 120.798 0.333 . . . . 61.240000000000002 110.93 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -49.93 -34.08 19.47 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.195 -0.457 . . . . 73.120000000000005 110.868 179.794 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 7.0 mm100 -68.11 -39.26 82.84 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.181 -0.463 . . . . 53.520000000000003 110.847 -179.863 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 18.2 m-85 -58.9 -27.41 65.2 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.229 -0.441 . . . . 70.409999999999997 110.927 -179.858 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -60.72 -37.12 80.66 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.146 -0.479 . . . . 74.120000000000005 110.907 -179.906 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 3.1 mm-40 -58.58 -43.35 89.44 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.142 -0.481 . . . . 72.120000000000005 110.901 179.974 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 3.1 mp -66.06 -43.02 92.56 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.123 -0.489 . . . . 75.109999999999999 111.157 179.963 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . 0.49 ' HB3' HG21 ' A' ' 46' ' ' ILE . 73.0 mt-30 -62.62 -42.2 99.45 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.165 -0.47 . . . . 71.319999999999993 110.907 179.943 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -61.1 -42.02 97.76 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.187 -0.46 . . . . 73.230000000000004 110.89 -179.948 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 1.5 m-20 -59.04 -33.72 71.08 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.165 -0.47 . . . . 43.43 110.9 -179.889 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 1.7 mt-10 -64.74 -37.89 89.15 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.18 -0.464 . . . . 73.239999999999995 110.866 -179.966 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.407 ' CD2' HG13 ' A' ' 46' ' ' ILE . 7.2 mp -66.15 -51.61 56.27 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.159 -0.473 . . . . 73.329999999999998 110.93 -179.989 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -68.74 -33.35 73.76 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.171 -0.468 . . . . 73.519999999999996 110.925 179.923 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -66.44 -50.57 62.92 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.109 -0.496 . . . . 63.329999999999998 111.121 179.919 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . 0.75 HD11 ' HB2' ' A' ' 115' ' ' PHE . 0.5 OUTLIER -73.37 -37.15 50.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.201 -0.454 . . . . 72.519999999999996 111.176 179.968 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 30.8 mtp180 -52.79 -34.5 53.72 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.131 -0.486 . . . . 71.400000000000006 110.918 179.937 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -66.75 -31.2 71.69 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.187 -0.461 . . . . 61.200000000000003 110.844 -179.799 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . 0.771 HG21 ' HE1' ' A' ' 115' ' ' PHE . 3.5 mt -85.08 -44.5 17.33 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.142 -0.481 . . . . 52.340000000000003 111.123 179.926 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 27.7 m-85 -107.06 42.76 1.25 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.202 -0.453 . . . . 74.340000000000003 110.888 -179.925 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 1.9 mtm -41.29 -45.82 3.06 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.096 -0.502 . . . . 65.349999999999994 110.902 179.891 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -101.68 -14.23 17.46 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.202 -0.453 . . . . 70.200000000000003 110.878 179.928 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 3.1 m-20 -97.66 21.03 10.92 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.182 -0.463 . . . . 72.519999999999996 110.873 179.984 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' PHE . . . . . 0.75 ' HA ' HD13 ' A' ' 50' ' ' ILE . 5.4 t80 -109.87 137.23 47.95 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.204 -0.453 . . . . 73.310000000000002 110.878 -179.916 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 59.3 m -116.51 134.8 54.43 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.134 -0.485 . . . . 70.310000000000002 111.156 -179.914 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . 0.456 ' O ' ' CG ' ' A' ' 32' ' ' ASP . 0.0 OUTLIER -99.22 117.34 33.47 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.225 -0.443 . . . . 74.420000000000002 110.867 179.89 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.916 HD21 HG12 ' A' ' 47' ' ' ILE . 0.2 OUTLIER -121.19 -21.4 6.42 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.194 -0.457 . . . . 71.239999999999995 110.918 -179.972 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . 0.896 ' N ' HD23 ' A' ' 33' ' ' LEU . 0.6 OUTLIER . . . . . 0 C--N 1.329 -0.302 0 CA-C-N 116.204 -0.453 . . . . 71.120000000000005 111.108 179.918 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 45' ' ' GLN . . . . . 0.567 ' O ' HG22 ' A' ' 46' ' ' ILE . 15.7 tt0 . . . . . 0 C--O 1.231 0.114 0 CA-C-O 120.807 0.337 . . . . 70.120000000000005 110.908 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 46' ' ' ILE . . . . . 0.567 HG22 ' O ' ' A' ' 45' ' ' GLN . 0.2 OUTLIER 83.57 -29.55 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.21 -0.45 . . . . 73.439999999999998 111.163 -179.991 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . 0.916 HG12 HD21 ' A' ' 33' ' ' LEU . 0.2 OUTLIER -45.1 146.14 0.44 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.151 -0.477 . . . . 63.200000000000003 111.145 179.827 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 48' ' ' PHE . . . . . 0.854 ' HA ' HD22 ' A' ' 33' ' ' LEU . 5.3 p90 -150.82 163.09 39.47 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.157 -0.474 . . . . 55.009999999999998 110.881 179.964 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . 0.818 ' HG3' HD13 ' A' ' 33' ' ' LEU . 33.5 mt-10 -108.87 149.57 28.93 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.147 -0.478 . . . . 60.140000000000001 110.863 -179.9 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . 0.75 HD13 ' HA ' ' A' ' 30' ' ' PHE . 6.2 mm -131.74 136.27 57.35 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.138 -0.483 . . . . 65.230000000000004 111.098 179.982 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 50.7 m -83.75 130.96 34.95 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.172 -0.467 . . . . 54.210000000000001 111.157 179.947 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . 0.673 HD12 HD12 ' A' ' 66' ' ' LEU . 12.6 mt -133.46 156.44 47.73 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.221 -0.445 . . . . 73.230000000000004 110.898 179.962 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -175.09 168.06 3.45 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.207 -0.451 . . . . 71.310000000000002 110.916 179.977 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 1.7 m -60.88 168.21 2.47 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.207 -0.452 . . . . 74.530000000000001 110.859 -179.837 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 35.0 m -80.54 -29.58 12.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.137 -0.483 . . . . 74.310000000000002 111.089 179.943 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -114.56 -169.69 1.59 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.214 -0.448 . . . . 44.200000000000003 110.873 179.944 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 5.1 mmmt -115.64 -21.93 9.45 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.2 -0.455 . . . . 73.530000000000001 110.92 179.998 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . 0.548 ' HA ' ' C ' ' A' ' 59' ' ' PRO . 8.3 pt-20 -113.6 144.49 31.47 Favored Pre-proline 0 C--N 1.33 -0.258 0 CA-C-O 121.65 0.738 . . . . 54.030000000000001 110.913 179.932 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 59' ' ' PRO . . . . . 0.548 ' C ' ' HA ' ' A' ' 58' ' ' GLU . 53.6 Cg_endo -69.77 -7.39 9.97 Favored 'Cis proline' 0 C--N 1.341 0.144 0 C-N-CA 122.646 -1.814 . . . . 75.310000000000002 112.348 -0.036 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 60' ' ' VAL . . . . . 0.479 ' HB ' ' ND2' ' A' ' 88' ' ' ASN . 13.2 m -154.37 -179.92 0.3 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.176 -0.465 . . . . 74.310000000000002 111.122 179.877 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . 0.464 ' O ' ' C ' ' A' ' 62' ' ' SER . 1.2 pt-20 -112.83 -16.25 12.77 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.171 -0.468 . . . . 62.32 110.909 -179.953 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 62' ' ' SER . . . . . 0.464 ' C ' ' O ' ' A' ' 61' ' ' GLU . 0.3 OUTLIER 33.14 91.54 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.126 -0.488 . . . . 52.030000000000001 110.867 -179.825 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 3.9 m -102.93 123.13 45.97 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.106 -0.497 . . . . 60.420000000000002 110.88 -179.832 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 64' ' ' ILE . . . . . 0.602 HD13 HD11 ' A' ' 94' ' ' LEU . 13.9 mt -138.15 150.94 24.74 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.142 -0.481 . . . . 73.040000000000006 111.156 179.944 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 65' ' ' THR . . . . . 0.573 HG23 ' O ' ' A' ' 50' ' ' ILE . 39.1 m -120.89 115.17 22.71 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.18 -0.464 . . . . 71.030000000000001 111.124 179.942 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . 0.716 HD11 HG21 ' A' ' 121' ' ' THR . 19.2 mt -90.95 110.77 22.02 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.192 -0.458 . . . . 54.219999999999999 110.944 179.96 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 9.1 t60 -100.92 114.52 28.46 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.21 -0.45 . . . . 74.329999999999998 110.855 179.892 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 68' ' ' PHE . . . . . 0.579 ' CG ' HD12 ' A' ' 114' ' ' ILE . 0.0 OUTLIER -105.17 141.13 37.26 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.195 -0.457 . . . . 73.400000000000006 110.885 -179.953 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -120.5 117.14 26.89 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.133 -0.485 . . . . 63.350000000000001 111.066 179.94 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 70' ' ' MET . . . . . 0.451 ' HE2' HD11 ' A' ' 114' ' ' ILE . 1.4 mmt -84.11 93.72 8.19 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.192 -0.458 . . . . 70.129999999999995 110.881 179.986 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -51.13 159.2 1.08 Allowed Pre-proline 0 C--N 1.329 -0.283 0 CA-C-O 121.582 0.706 . . . . 71.140000000000001 111.154 -179.922 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 72' ' ' PRO . . . . . 0.532 ' O ' HD13 ' A' ' 8' ' ' LEU . 53.9 Cg_endo -69.72 -4.5 14.12 Favored 'Trans proline' 0 C--O 1.231 0.174 0 C-N-CA 122.711 2.274 . . . . 65.019999999999996 112.339 179.973 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 73' ' ' MET . . . . . 0.527 ' HB3' HG23 ' A' ' 77' ' ' THR . 0.0 OUTLIER -109.28 -24.21 11.2 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.203 -0.453 . . . . 72.299999999999997 110.852 179.942 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 74' ' ' TYR . . . . . 0.651 ' CD1' ' C ' ' A' ' 74' ' ' TYR . 0.0 OUTLIER -48.29 150.75 2.1 Favored Pre-proline 0 C--N 1.328 -0.342 0 CA-C-O 121.688 0.756 . . . . 62.43 110.931 -179.859 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 75' ' ' PRO . . . . . 0.556 ' C ' ' HA ' ' A' ' 74' ' ' TYR . 54.2 Cg_endo -69.72 -11.69 11.89 Favored 'Cis proline' 0 C--N 1.341 0.171 0 C-N-CA 122.698 -1.792 . . . . 72.209999999999994 112.367 -0.124 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 76' ' ' TYR . . . . . 0.476 ' CB ' ' O ' ' A' ' 73' ' ' MET . 10.4 t80 -35.27 -52.88 0.62 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.221 -0.445 . . . . 64.010000000000005 110.969 -179.943 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 77' ' ' THR . . . . . 0.527 HG23 ' HB3' ' A' ' 73' ' ' MET . 53.2 p -101.39 175.3 5.62 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.087 -0.506 . . . . 75.510000000000005 111.139 -179.961 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -98.86 131.36 25.74 Favored Pre-proline 0 C--N 1.329 -0.288 0 CA-C-O 121.554 0.692 . . . . 72.140000000000001 111.079 179.884 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 79' ' ' PRO . . . . . 0.747 ' HG3' HD11 ' A' ' 113' ' ' ILE . 53.7 Cg_endo -69.77 176.84 6.23 Favored 'Trans proline' 0 C--N 1.341 0.171 0 C-N-CA 122.668 2.246 . . . . 74.049999999999997 112.369 179.957 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 2.0 tt0 -111.66 133.44 53.91 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.234 -0.439 . . . . 70.310000000000002 110.951 179.996 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 81' ' ' ILE . . . . . 0.473 HD13 ' HA ' ' A' ' 68' ' ' PHE . 10.0 mm -124.08 127.25 73.37 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.157 -0.474 . . . . 61.539999999999999 111.182 179.988 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . 0.478 ' HG3' ' CD ' ' A' ' 84' ' ' LYS . 7.3 pt-20 -135.07 142.13 46.24 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.22 -0.445 . . . . 74.140000000000001 110.902 179.975 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 83' ' ' PHE . . . . . 0.663 ' CE1' HD21 ' A' ' 66' ' ' LEU . 31.1 m-85 -93.23 140.88 29.04 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.165 -0.471 . . . . 71.219999999999999 110.839 -179.884 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 84' ' ' LYS . . . . . 0.478 ' CD ' ' HG3' ' A' ' 82' ' ' GLU . 9.7 mmmt -123.66 170.36 10.55 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.137 -0.483 . . . . 53.530000000000001 110.936 179.964 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 85' ' ' ASN . . . . . 0.44 ' O ' ' C ' ' A' ' 86' ' ' VAL . 2.7 m-80 62.92 -73.38 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.22 -0.446 . . . . 73.310000000000002 110.891 179.946 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 86' ' ' VAL . . . . . 1.096 HG11 HD21 ' A' ' 94' ' ' LEU . 6.4 m 34.94 90.67 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.131 -0.486 . . . . 75.099999999999994 111.166 179.942 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -101.92 -84.74 0.44 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.17 -0.468 . . . . 72.400000000000006 110.911 -179.954 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 88' ' ' ASN . . . . . 0.479 ' ND2' ' HB ' ' A' ' 60' ' ' VAL . 27.8 m120 -49.5 -40.21 36.72 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.185 -0.461 . . . . 74.349999999999994 110.856 -179.913 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 89' ' ' VAL . . . . . 0.813 HG21 HD13 ' A' ' 94' ' ' LEU . 2.4 p -68.17 139.08 21.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.167 -0.47 . . . . 43.210000000000001 111.119 179.909 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 90' ' ' MET . . . . . . . . . . . . . 5.4 mtm -87.22 -67.43 0.82 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.155 -0.475 . . . . 73.450000000000003 110.892 179.91 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -178.77 -30.44 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.21 -0.45 . . . . 73.329999999999998 110.832 179.954 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -53.79 -42.72 68.63 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.198 -0.456 . . . . 74.299999999999997 110.861 -179.775 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -69.92 -40.11 75.73 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.136 -0.484 . . . . 73.450000000000003 110.94 -179.985 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . 1.096 HD21 HG11 ' A' ' 86' ' ' VAL . 0.1 OUTLIER -59.52 -46.3 89.26 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.208 -0.451 . . . . 63.399999999999999 110.95 179.997 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 9.9 mm-40 -64.89 -38.88 92.45 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.129 -0.487 . . . . 64.540000000000006 110.951 179.907 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 96' ' ' MET . . . . . 0.561 ' SD ' ' CE1' ' A' ' 128' ' ' PHE . 19.8 ttp -61.06 -36.96 80.99 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.178 -0.465 . . . . 64.409999999999997 110.856 179.965 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 97' ' ' LEU . . . . . 1.015 HD22 HG22 ' A' ' 121' ' ' THR . 90.3 mt -62.2 -42.45 99.3 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.221 -0.445 . . . . 54.240000000000002 110.902 -179.942 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 98' ' ' LYS . . . . . 0.578 ' HA ' ' CD2' ' A' ' 101' ' ' PHE . 13.2 mmtm -54.86 -44.56 74.11 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.181 -0.463 . . . . 72.219999999999999 110.872 179.845 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 66.3 m -57.63 -39.23 76.5 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.253 -0.43 . . . . 60.130000000000003 110.836 -179.897 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 100' ' ' GLU . . . . . 0.569 ' O ' HD12 ' A' ' 104' ' ' ILE . 3.6 mm-40 -71.36 -26.67 62.9 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.177 -0.465 . . . . 72.400000000000006 110.879 -179.928 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 101' ' ' PHE . . . . . 0.591 ' CD1' ' O ' ' A' ' 97' ' ' LEU . 8.7 m-30 -59.38 -30.36 68.37 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.147 -0.479 . . . . 65.439999999999998 110.937 -179.963 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 1.4 tmpt? -71.56 -40.76 69.77 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.113 -0.494 . . . . 75.530000000000001 110.882 179.98 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 3.2 tmmm? -70.35 -43.25 70.57 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.227 -0.442 . . . . 65.219999999999999 110.88 179.913 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 104' ' ' ILE . . . . . 0.569 HD12 ' O ' ' A' ' 100' ' ' GLU . 3.0 mt -62.36 -47.5 92.74 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.202 -0.454 . . . . 72.420000000000002 111.159 179.861 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 105' ' ' HIS . . . . . 0.409 ' O ' ' N ' ' A' ' 109' ' ' ARG . 14.4 t-80 -62.53 -41.78 99.09 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.151 -0.477 . . . . 72.409999999999997 110.874 179.851 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 1.1 t-20 -58.03 -42.35 85.13 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.218 -0.446 . . . . 73.340000000000003 110.902 -179.978 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 107' ' ' THR . . . . . 0.457 HG22 ' O ' ' A' ' 104' ' ' ILE . 8.0 t -77.95 -35.55 50.24 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.157 -0.474 . . . . 71.319999999999993 111.159 -179.996 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 108' ' ' SER . . . . . 0.524 ' HB2' HG22 ' A' ' 113' ' ' ILE . 19.8 m -103.97 29.96 5.51 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.21 -0.45 . . . . 73.329999999999998 110.865 -179.871 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 109' ' ' ARG . . . . . 0.409 ' N ' ' O ' ' A' ' 105' ' ' HIS . 26.1 ttt180 -72.13 80.64 0.96 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.133 -0.485 . . . . 60.140000000000001 110.872 -179.956 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 141.15 -9.23 2.72 Favored Glycine 0 N--CA 1.452 -0.254 0 C-N-CA 120.699 -0.763 . . . . 44.439999999999998 112.477 -179.971 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 111' ' ' GLN . . . . . . . . . . . . . 9.2 pt20 -126.44 -161.68 1.08 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.761 0.315 . . . . 52.219999999999999 110.921 -179.873 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 33.7 mt-10 -70.86 134.22 47.12 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.219 -0.446 . . . . 72.530000000000001 110.862 -179.95 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 113' ' ' ILE . . . . . 0.747 HD11 ' HG3' ' A' ' 79' ' ' PRO . 31.1 pt -126.65 -11.31 4.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.149 -0.478 . . . . 24.329999999999998 111.161 179.972 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 114' ' ' ILE . . . . . 0.776 ' O ' HG23 ' A' ' 118' ' ' THR . 33.7 mm -61.87 -45.72 98.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.156 -0.475 . . . . 53.299999999999997 111.136 179.855 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 115' ' ' PHE . . . . . 0.771 ' HE1' HG21 ' A' ' 25' ' ' ILE . 13.1 t80 -72.51 -32.65 66.32 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.171 -0.468 . . . . 74.439999999999998 110.932 179.9 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 42.9 mm-40 -67.45 -47.65 69.53 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.105 -0.498 . . . . 43.299999999999997 110.901 -179.971 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 117' ' ' ILE . . . . . 0.478 ' CG2' ' N ' ' A' ' 118' ' ' THR . 0.8 OUTLIER -64.15 -41.92 93.95 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.142 -0.481 . . . . 71.430000000000007 111.111 179.979 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 118' ' ' THR . . . . . 0.776 HG23 ' O ' ' A' ' 114' ' ' ILE . 46.7 p -67.85 -42.43 81.37 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.201 -0.454 . . . . 71.230000000000004 111.158 179.958 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 6.8 m -66.14 -43.96 85.54 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.245 -0.434 . . . . 70.420000000000002 110.838 -179.842 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 120' ' ' PHE . . . . . 0.506 ' CG ' HD11 ' A' ' 104' ' ' ILE . 0.2 OUTLIER -62.11 -49.97 73.8 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.161 -0.472 . . . . 73.329999999999998 110.883 -179.979 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 121' ' ' THR . . . . . 1.015 HG22 HD22 ' A' ' 97' ' ' LEU . 53.5 p -63.28 -39.3 94.21 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.141 -0.481 . . . . 61.450000000000003 111.169 -179.96 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -64.49 -46.33 83.49 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.201 -0.454 . . . . 72.340000000000003 110.945 179.999 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 4.8 pt-20 -70.99 -38.19 72.71 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.219 -0.446 . . . . 73.450000000000003 110.842 -179.968 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 124' ' ' LYS . . . . . 0.441 ' CE ' ' HA ' ' A' ' 124' ' ' LYS . 0.2 OUTLIER -74.51 -29.93 61.59 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.218 -0.446 . . . . 53.420000000000002 110.902 -179.999 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 125' ' ' LEU . . . . . 0.847 ' O ' HD12 ' A' ' 125' ' ' LEU . 0.9 OUTLIER -68.34 -46.36 70.38 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.221 -0.445 . . . . 74.219999999999999 110.92 179.945 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 6.4 m-20 -59.84 -37.43 79.23 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.214 -0.448 . . . . 70.239999999999995 110.85 179.819 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 3.0 mm-40 -60.41 -49.74 76.36 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.198 -0.455 . . . . 72.239999999999995 110.947 -179.931 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 128' ' ' PHE . . . . . 0.561 ' CE1' ' SD ' ' A' ' 96' ' ' MET . 11.3 m-85 . . . . . 0 C--N 1.329 -0.323 0 CA-C-N 116.124 -0.489 . . . . 73.099999999999994 110.856 -179.949 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 44.2 mt . . . . . 0 C--O 1.232 0.148 0 CA-C-O 120.817 0.341 . . . . 62.509999999999998 110.93 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -49.96 -30.6 10.72 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.217 -0.447 . . . . 73.140000000000001 110.847 179.863 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 5.1 mm100 -68.09 -40.01 82.72 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.213 -0.449 . . . . 73.049999999999997 110.884 -179.902 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 22.8 m-85 -61.9 -26.95 68.47 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.197 -0.456 . . . . 74.329999999999998 110.88 -179.805 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -58.96 -37.66 77.28 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.158 -0.474 . . . . 72.109999999999999 110.937 -179.958 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 2.2 mm-40 -63.07 -42.9 99.78 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.167 -0.47 . . . . 71.310000000000002 110.877 -179.97 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 3.8 mp -65.92 -41.99 91.03 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.163 -0.471 . . . . 73.230000000000004 111.126 179.989 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . 0.444 ' HB3' HG21 ' A' ' 46' ' ' ILE . 47.5 mt-30 -65.42 -44.02 88.68 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.199 -0.455 . . . . 73.230000000000004 110.897 179.944 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 1.7 t -62.35 -38.29 88.93 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.203 -0.453 . . . . 75.150000000000006 110.924 -179.952 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 1.6 m-20 -58.08 -33.9 69.56 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.126 -0.488 . . . . 65.409999999999997 110.896 -179.921 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 4.1 mt-10 -67.14 -39.1 86.51 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.165 -0.471 . . . . 73.109999999999999 110.859 -179.946 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.438 ' CD2' HG13 ' A' ' 46' ' ' ILE . 8.7 mp -63.87 -51.25 65.48 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.203 -0.453 . . . . 53.130000000000003 110.869 -179.941 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -68.51 -35.84 78.04 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.184 -0.462 . . . . 73.329999999999998 110.886 179.938 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -66.64 -50.36 63.21 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.133 -0.485 . . . . 74.430000000000007 111.137 179.907 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . 0.525 ' HA ' HD12 ' A' ' 25' ' ' ILE . 0.8 OUTLIER -73.12 -34.67 45.73 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.235 -0.439 . . . . 74.120000000000005 111.132 179.927 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -52.8 -35.46 56.91 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.17 -0.468 . . . . 64.109999999999999 110.891 179.977 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 53.3 p -67.18 -31.44 71.84 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.155 -0.475 . . . . 54.119999999999997 110.855 -179.782 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . 0.708 HD13 ' CE1' ' A' ' 115' ' ' PHE . 3.5 mt -83.84 -44.16 18.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.134 -0.484 . . . . 65.319999999999993 111.119 179.954 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' TYR . . . . . 0.44 ' CD2' HD12 ' A' ' 50' ' ' ILE . 19.8 m-85 -106.7 45.68 0.97 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.174 -0.466 . . . . 71.109999999999999 110.941 -179.982 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER -46.7 -54.88 8.73 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.117 -0.492 . . . . 74.409999999999997 110.9 179.919 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -96.49 -11.79 25.06 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.198 -0.456 . . . . 75.430000000000007 110.882 179.975 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -101.86 25.79 8.23 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.2 -0.454 . . . . 75.510000000000005 110.875 179.99 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' PHE . . . . . 0.483 ' HA ' HD13 ' A' ' 50' ' ' ILE . 3.9 t80 -111.41 134.65 52.84 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.205 -0.452 . . . . 63.100000000000001 110.865 -179.9 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 24.2 m -110.7 132.46 54.18 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.138 -0.483 . . . . 70.299999999999997 111.175 -179.947 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -95.73 114.28 26.0 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.228 -0.442 . . . . 71.200000000000003 110.89 179.936 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.645 HD12 ' N ' ' A' ' 34' ' ' THR . 0.2 OUTLIER -124.95 -0.13 7.92 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.174 -0.467 . . . . 51.409999999999997 110.88 -179.891 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . 0.645 ' N ' HD12 ' A' ' 33' ' ' LEU . 1.4 m . . . . . 0 C--N 1.33 -0.261 0 CA-C-N 116.187 -0.461 . . . . 71.400000000000006 111.151 179.915 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 45' ' ' GLN . . . . . 0.649 ' HB3' HD12 ' A' ' 47' ' ' ILE . 24.3 tt0 . . . . . 0 C--O 1.231 0.12 0 CA-C-O 120.76 0.314 . . . . 62.32 110.937 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 46' ' ' ILE . . . . . 0.486 HG22 ' O ' ' A' ' 45' ' ' GLN . 0.0 OUTLIER 82.43 -34.19 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.179 -0.464 . . . . 74.310000000000002 111.166 179.978 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . 0.649 HD12 ' HB3' ' A' ' 45' ' ' GLN . 0.2 OUTLIER -34.94 148.66 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.181 -0.463 . . . . 31.149999999999999 111.101 179.843 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 48' ' ' PHE . . . . . 0.617 ' CZ ' HG21 ' A' ' 114' ' ' ILE . 14.3 p90 -159.43 158.0 31.25 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.165 -0.47 . . . . 54.219999999999999 110.909 179.889 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . 0.462 ' CG ' ' HB2' ' A' ' 67' ' ' HIS . 5.7 mt-10 -109.61 160.74 16.01 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.157 -0.474 . . . . 75.040000000000006 110.94 -179.949 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . 0.483 HD13 ' HA ' ' A' ' 30' ' ' PHE . 19.0 mm -137.61 139.04 43.93 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 116.148 -0.478 . . . . 75.310000000000002 111.161 179.987 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 24.1 m -85.26 117.07 23.98 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.186 -0.461 . . . . 75.099999999999994 111.134 179.979 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . 0.598 HD12 HD22 ' A' ' 66' ' ' LEU . 17.1 mt -121.59 161.08 23.03 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.234 -0.439 . . . . 75.129999999999995 110.939 179.932 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -177.51 178.79 1.0 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.23 -0.441 . . . . 64.099999999999994 110.915 179.906 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -64.89 175.48 1.5 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.201 -0.454 . . . . 74.209999999999994 110.85 -179.75 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 16.4 m -80.69 -29.45 11.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.155 -0.475 . . . . 62.119999999999997 111.081 179.962 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 1.7 t0 -117.02 -169.13 1.59 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.201 -0.454 . . . . 43.530000000000001 110.901 179.954 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . 0.472 ' CD ' ' N ' ' A' ' 57' ' ' LYS . 0.0 OUTLIER -117.55 -12.62 10.34 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.257 -0.429 . . . . 71.340000000000003 110.88 -179.985 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . 0.543 ' HA ' ' C ' ' A' ' 59' ' ' PRO . 9.8 pt-20 -126.06 150.98 71.0 Favored Pre-proline 0 C--N 1.329 -0.294 0 CA-C-O 121.639 0.733 . . . . 73.420000000000002 110.924 179.895 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 59' ' ' PRO . . . . . 0.543 ' C ' ' HA ' ' A' ' 58' ' ' GLU . 53.7 Cg_endo -69.77 -5.94 9.17 Favored 'Cis proline' 0 C--N 1.342 0.191 0 C-N-CA 122.686 -1.798 . . . . 75.230000000000004 112.349 0.041 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 60' ' ' VAL . . . . . 0.729 HG11 ' OD1' ' A' ' 88' ' ' ASN . 33.4 m -140.75 172.32 11.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.25 -0.432 . . . . 74.140000000000001 111.165 179.93 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . 0.447 ' O ' ' C ' ' A' ' 62' ' ' SER . 5.4 tt0 -102.45 -21.97 14.14 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.163 -0.471 . . . . 73.420000000000002 110.86 -179.979 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 62' ' ' SER . . . . . 0.816 ' HB3' HD11 ' A' ' 125' ' ' LEU . 41.7 m 34.0 90.78 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.181 -0.463 . . . . 55.009999999999998 110.889 -179.784 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 10.4 p -118.61 123.05 44.04 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.124 -0.489 . . . . 64.209999999999994 110.869 -179.836 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 64' ' ' ILE . . . . . 1.066 HD11 HG21 ' A' ' 89' ' ' VAL . 30.1 mt -133.05 139.31 49.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.093 -0.503 . . . . 73.230000000000004 111.125 179.976 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 20.4 m -104.53 116.87 32.85 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.176 -0.465 . . . . 74.019999999999996 111.157 179.959 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . 1.027 HD21 HG21 ' A' ' 121' ' ' THR . 1.4 mp -94.48 109.97 21.81 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.247 -0.433 . . . . 75.409999999999997 110.915 179.977 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 67' ' ' HIS . . . . . 0.531 ' CE1' HD21 ' A' ' 33' ' ' LEU . 1.9 t60 -97.4 109.96 22.61 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.18 -0.464 . . . . 73.140000000000001 110.833 179.875 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 68' ' ' PHE . . . . . 0.572 ' CE2' ' HB3' ' A' ' 66' ' ' LEU . 0.0 OUTLIER -105.11 139.97 38.98 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.206 -0.452 . . . . 73.299999999999997 110.839 -179.896 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -123.87 128.39 49.42 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.148 -0.478 . . . . 61.420000000000002 111.07 179.943 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 70' ' ' MET . . . . . 0.738 ' CE ' HD11 ' A' ' 114' ' ' ILE . 0.0 OUTLIER -96.32 103.42 15.32 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.23 -0.441 . . . . 65.209999999999994 110.882 179.953 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -57.33 161.17 5.82 Favored Pre-proline 0 C--N 1.33 -0.272 0 CA-C-O 121.564 0.697 . . . . 62.329999999999998 111.134 -179.935 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.8 -4.19 13.55 Favored 'Trans proline' 0 C--N 1.342 0.195 0 C-N-CA 122.692 2.261 . . . . 64.030000000000001 112.346 179.93 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 73' ' ' MET . . . . . 0.5 ' O ' ' CB ' ' A' ' 76' ' ' TYR . 0.0 OUTLIER -111.85 -24.26 10.09 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.199 -0.455 . . . . 74.319999999999993 110.891 179.92 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 74' ' ' TYR . . . . . 0.635 ' CD1' ' C ' ' A' ' 74' ' ' TYR . 0.0 OUTLIER -47.98 149.9 2.25 Favored Pre-proline 0 C--N 1.329 -0.319 0 CA-C-O 121.638 0.732 . . . . 75.439999999999998 110.924 -179.865 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 75' ' ' PRO . . . . . 0.542 ' C ' ' HA ' ' A' ' 74' ' ' TYR . 53.7 Cg_endo -69.79 -12.34 12.22 Favored 'Cis proline' 0 C--N 1.341 0.165 0 C-N-CA 122.696 -1.793 . . . . 75.120000000000005 112.302 -0.041 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 76' ' ' TYR . . . . . 0.5 ' CB ' ' O ' ' A' ' 73' ' ' MET . 9.4 t80 -33.95 -47.31 0.26 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.264 -0.425 . . . . 71.319999999999993 110.934 -179.925 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 77' ' ' THR . . . . . 0.41 HG23 ' CB ' ' A' ' 73' ' ' MET . 72.0 p -105.8 179.68 4.2 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.121 -0.491 . . . . 70.319999999999993 111.105 -179.964 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -100.74 129.95 26.44 Favored Pre-proline 0 C--N 1.329 -0.309 0 CA-C-O 121.638 0.733 . . . . 45.039999999999999 111.108 179.84 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 79' ' ' PRO . . . . . 0.616 ' HG3' HD11 ' A' ' 113' ' ' ILE . 53.9 Cg_endo -69.75 -175.18 1.07 Allowed 'Trans proline' 0 C--N 1.342 0.203 0 C-N-CA 122.685 2.256 . . . . 64.310000000000002 112.353 179.992 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . 0.58 ' O ' HD13 ' A' ' 81' ' ' ILE . 0.4 OUTLIER -124.18 141.2 52.26 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.26 -0.427 . . . . 73.230000000000004 110.871 -179.981 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 81' ' ' ILE . . . . . 0.58 HD13 ' O ' ' A' ' 80' ' ' GLU . 8.0 mm -133.02 143.89 38.12 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.141 -0.481 . . . . 61.539999999999999 111.096 179.983 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . 0.509 ' HG3' ' CD ' ' A' ' 84' ' ' LYS . 4.4 pt-20 -149.02 143.65 26.22 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.156 -0.475 . . . . 70.430000000000007 110.916 179.906 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 83' ' ' PHE . . . . . 0.465 ' CZ ' ' HD3' ' A' ' 98' ' ' LYS . 10.3 m-85 -96.21 136.85 36.13 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.167 -0.469 . . . . 74.219999999999999 110.898 -179.904 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 84' ' ' LYS . . . . . 0.509 ' CD ' ' HG3' ' A' ' 82' ' ' GLU . 12.8 mmmt -123.99 169.02 12.05 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.201 -0.454 . . . . 73.329999999999998 110.941 179.964 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 85' ' ' ASN . . . . . 0.571 HD22 ' N ' ' A' ' 85' ' ' ASN . 1.0 OUTLIER 64.26 -72.46 0.06 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.249 -0.432 . . . . 74.049999999999997 110.888 179.942 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 86' ' ' VAL . . . . . 0.513 HG11 HD11 ' A' ' 94' ' ' LEU . 6.8 m 33.76 90.84 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.18 -0.464 . . . . 74.140000000000001 111.101 179.904 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -99.95 -53.65 3.1 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.173 -0.467 . . . . 71.209999999999994 110.934 179.995 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 88' ' ' ASN . . . . . 0.729 ' OD1' HG11 ' A' ' 60' ' ' VAL . 20.9 t30 -85.4 20.88 1.89 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.206 -0.452 . . . . 63.340000000000003 110.866 -179.954 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 89' ' ' VAL . . . . . 1.066 HG21 HD11 ' A' ' 64' ' ' ILE . 2.8 t -130.81 154.62 40.96 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.175 -0.466 . . . . 74.019999999999996 111.133 179.918 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 90' ' ' MET . . . . . . . . . . . . . 3.0 mtm -108.31 -69.44 0.85 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.19 -0.459 . . . . 72.299999999999997 110.933 179.874 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 9.8 p-10 -170.82 -33.41 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.183 -0.462 . . . . 72.310000000000002 110.88 179.959 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 4.1 m -54.34 -46.47 72.93 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.197 -0.456 . . . . 64.099999999999994 110.869 -179.788 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 93' ' ' GLN . . . . . 0.441 ' HB2' ' CG1' ' A' ' 89' ' ' VAL . 4.1 mp0 -68.74 -38.78 80.39 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.131 -0.486 . . . . 74.319999999999993 110.897 -179.942 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . 0.521 ' CD1' HG11 ' A' ' 89' ' ' VAL . 8.2 mp -57.86 -49.16 77.63 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.185 -0.461 . . . . 64.340000000000003 110.931 179.977 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 74.2 mt-30 -66.08 -37.33 85.53 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.144 -0.48 . . . . 61.32 110.9 179.956 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 96' ' ' MET . . . . . . . . . . . . . 32.8 ttp -59.76 -41.27 90.66 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.205 -0.452 . . . . 62.240000000000002 110.884 179.958 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 97' ' ' LEU . . . . . 0.609 HD22 ' HA ' ' A' ' 121' ' ' THR . 87.6 mt -61.76 -44.8 96.18 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.21 -0.45 . . . . 75.129999999999995 110.945 -179.982 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 98' ' ' LYS . . . . . 0.48 ' HA ' ' CD2' ' A' ' 101' ' ' PHE . 5.5 mmtp -58.47 -34.98 71.48 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.169 -0.469 . . . . 74.239999999999995 110.893 179.81 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -63.89 -42.76 97.4 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.183 -0.462 . . . . 73.439999999999998 110.86 -179.847 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 100' ' ' GLU . . . . . 0.558 ' O ' HD12 ' A' ' 104' ' ' ILE . 69.5 mm-40 -71.0 -24.56 62.41 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.114 -0.494 . . . . 73.219999999999999 110.837 -179.948 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 101' ' ' PHE . . . . . 0.576 ' CD2' HD11 ' A' ' 117' ' ' ILE . 10.5 m-30 -59.57 -38.23 80.61 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.146 -0.479 . . . . 75.519999999999996 110.864 -179.905 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.28 -44.0 95.72 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.166 -0.47 . . . . 75.019999999999996 110.867 -179.988 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -67.36 -42.88 82.73 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.247 -0.433 . . . . 73.019999999999996 110.888 179.881 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 104' ' ' ILE . . . . . 0.904 HD11 ' CG ' ' A' ' 120' ' ' PHE . 3.4 mt -61.82 -47.68 92.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.245 -0.434 . . . . 60.420000000000002 111.158 179.855 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 105' ' ' HIS . . . . . 0.454 ' O ' ' N ' ' A' ' 109' ' ' ARG . 64.6 t-80 -62.97 -41.2 99.47 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.135 -0.484 . . . . 65.150000000000006 110.888 179.864 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 1.4 m-80 -56.82 -40.47 76.06 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.199 -0.455 . . . . 62.210000000000001 110.87 -179.941 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 107' ' ' THR . . . . . 0.413 ' CG2' ' O ' ' A' ' 104' ' ' ILE . 5.2 t -81.26 -26.31 35.88 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.212 -0.449 . . . . 72.230000000000004 111.112 -179.971 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 108' ' ' SER . . . . . 0.58 ' OG ' HG22 ' A' ' 113' ' ' ILE . 39.3 p -111.31 26.84 10.26 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.251 -0.431 . . . . 42.439999999999998 110.848 -179.813 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 109' ' ' ARG . . . . . 0.454 ' N ' ' O ' ' A' ' 105' ' ' HIS . 13.4 ttt-85 -68.34 76.55 0.26 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.154 -0.476 . . . . 74.239999999999995 110.868 -179.928 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 145.09 -20.22 1.94 Allowed Glycine 0 N--CA 1.451 -0.343 0 C-N-CA 120.78 -0.724 . . . . 55.439999999999998 112.501 -179.986 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 111' ' ' GLN . . . . . . . . . . . . . 7.3 pt20 -114.54 -170.2 1.69 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.749 0.309 . . . . 74.420000000000002 110.91 -179.877 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 32.8 mt-10 -62.3 128.92 38.34 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.204 -0.453 . . . . 75.420000000000002 110.874 -179.962 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 113' ' ' ILE . . . . . 0.616 HD11 ' HG3' ' A' ' 79' ' ' PRO . 21.2 pt -120.67 -15.08 7.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.133 -0.485 . . . . 63.25 111.098 179.999 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 114' ' ' ILE . . . . . 0.92 ' O ' HG23 ' A' ' 118' ' ' THR . 35.0 mm -60.11 -43.64 93.33 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.175 -0.466 . . . . 73.430000000000007 111.166 179.816 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 115' ' ' PHE . . . . . 0.708 ' CE1' HD13 ' A' ' 25' ' ' ILE . 22.0 t80 -72.31 -35.35 68.61 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.176 -0.465 . . . . 65.340000000000003 110.925 179.929 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 56.6 mm-40 -67.89 -47.62 68.3 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.096 -0.502 . . . . 74.430000000000007 110.929 -179.97 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 117' ' ' ILE . . . . . 0.576 HD11 ' CD2' ' A' ' 101' ' ' PHE . 1.1 tt -64.27 -40.45 89.11 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.133 -0.485 . . . . 61.310000000000002 111.15 179.947 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 118' ' ' THR . . . . . 0.92 HG23 ' O ' ' A' ' 114' ' ' ILE . 62.5 p -67.43 -43.38 81.32 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.181 -0.463 . . . . 74.019999999999996 111.149 179.978 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 1.7 t -67.83 -32.02 72.27 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.189 -0.459 . . . . 62.439999999999998 110.841 -179.867 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 120' ' ' PHE . . . . . 0.904 ' CG ' HD11 ' A' ' 104' ' ' ILE . 0.4 OUTLIER -76.01 -39.64 55.32 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.155 -0.475 . . . . 75.5 110.893 -179.932 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 121' ' ' THR . . . . . 1.027 HG21 HD21 ' A' ' 66' ' ' LEU . 14.8 p -69.36 -41.65 76.29 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.14 -0.482 . . . . 75.510000000000005 111.134 -179.933 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 122' ' ' GLN . . . . . 0.442 ' CG ' ' N ' ' A' ' 123' ' ' GLU . 9.0 pt20 -68.25 -46.97 69.01 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.227 -0.442 . . . . 65.150000000000006 110.904 -179.976 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 123' ' ' GLU . . . . . 0.442 ' N ' ' CG ' ' A' ' 122' ' ' GLN . 5.7 pt-20 -60.36 -36.61 78.41 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.197 -0.456 . . . . 73.25 110.869 -179.916 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 124' ' ' LYS . . . . . 0.459 ' CE ' ' HA ' ' A' ' 124' ' ' LYS . 0.0 OUTLIER -77.03 -38.54 52.62 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.146 -0.479 . . . . 74.420000000000002 110.921 179.969 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 125' ' ' LEU . . . . . 0.816 HD11 ' HB3' ' A' ' 62' ' ' SER . 2.3 tp -67.69 -43.2 80.69 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.203 -0.453 . . . . 64.230000000000004 110.938 179.927 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -63.19 -43.13 99.08 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.157 -0.474 . . . . 63.109999999999999 110.836 179.875 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 127' ' ' GLU . . . . . 0.446 ' HG3' ' N ' ' A' ' 128' ' ' PHE . 0.0 OUTLIER -67.22 -29.25 68.86 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.208 -0.451 . . . . 73.430000000000007 110.915 -179.912 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 128' ' ' PHE . . . . . 0.446 ' N ' ' HG3' ' A' ' 127' ' ' GLU . 0.2 OUTLIER . . . . . 0 C--N 1.329 -0.285 0 CA-C-N 116.117 -0.492 . . . . 73.439999999999998 110.916 -179.966 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 36.6 mt . . . . . 0 C--O 1.231 0.083 0 CA-C-O 120.847 0.356 . . . . 73.109999999999999 110.965 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 33.6 t70 -54.89 -30.04 57.14 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.191 -0.459 . . . . 72.439999999999998 110.819 179.843 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . 0.405 ' HA ' ' NE2' ' A' ' 10' ' ' GLN . 4.2 mm-40 -66.27 -33.81 76.59 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.207 -0.451 . . . . 73.120000000000005 110.916 -179.915 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' TYR . . . . . 0.55 ' CE1' ' HD2' ' A' ' 75' ' ' PRO . 14.1 m-85 -64.37 -26.93 68.68 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.211 -0.45 . . . . 74.120000000000005 110.904 -179.864 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -59.58 -37.01 77.39 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.15 -0.477 . . . . 75.109999999999999 110.899 -179.854 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 2.9 mm-40 -61.45 -45.94 92.17 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.152 -0.476 . . . . 73.409999999999997 110.92 179.976 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' ILE . . . . . 0.487 ' H ' HD12 ' A' ' 14' ' ' ILE . 4.9 mp -67.79 -45.05 85.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.141 -0.481 . . . . 73.129999999999995 111.163 179.945 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . 0.498 ' NE2' ' O ' ' A' ' 71' ' ' THR . 86.8 mt-30 -61.29 -45.36 94.8 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.124 -0.489 . . . . 74.310000000000002 110.907 179.966 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 2.8 t -61.18 -41.92 97.64 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.182 -0.463 . . . . 74.120000000000005 110.891 -179.941 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 2.5 m-20 -57.63 -33.51 68.34 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.196 -0.456 . . . . 74.099999999999994 110.913 -179.919 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . 0.571 ' HG2' HD13 ' A' ' 114' ' ' ILE . 2.9 mt-10 -65.51 -41.2 93.45 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.181 -0.463 . . . . 75.409999999999997 110.897 179.987 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 8.9 mp -61.74 -51.84 66.72 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.109 -0.496 . . . . 74.150000000000006 110.921 -179.958 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -68.85 -37.41 79.11 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.192 -0.458 . . . . 74.25 110.901 179.912 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -61.01 -50.58 72.77 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.162 -0.472 . . . . 32.210000000000001 111.109 179.916 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . 0.407 HD11 ' HB2' ' A' ' 115' ' ' PHE . 0.6 OUTLIER -75.0 -36.09 37.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.236 -0.438 . . . . 73.299999999999997 111.168 179.968 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 18.7 mtp180 -52.63 -34.22 50.3 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.16 -0.473 . . . . 72.219999999999999 110.858 179.973 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -66.29 -33.55 75.99 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.219 -0.446 . . . . 65.109999999999999 110.847 -179.782 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . 0.745 HG21 ' HE1' ' A' ' 115' ' ' PHE . 3.3 mt -81.71 -44.9 20.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.12 -0.491 . . . . 73.219999999999999 111.139 179.97 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 21.4 m-85 -109.01 46.03 1.0 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.182 -0.463 . . . . 74.120000000000005 110.883 -179.948 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 3.2 mtm -41.7 -59.32 1.69 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.138 -0.483 . . . . 71.549999999999997 110.902 179.895 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 1.5 t70 -84.38 -25.12 29.35 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.197 -0.456 . . . . 73.129999999999995 110.834 179.968 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -85.38 30.75 0.6 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.234 -0.439 . . . . 73.420000000000002 110.851 -179.998 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' PHE . . . . . 0.579 ' HA ' HD13 ' A' ' 50' ' ' ILE . 6.0 t80 -117.14 139.47 50.7 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.205 -0.452 . . . . 72.329999999999998 110.835 -179.879 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 60.5 m -118.33 135.12 54.5 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.092 -0.504 . . . . 63.420000000000002 111.168 -179.916 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 12.6 t70 -99.92 117.17 33.66 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.256 -0.429 . . . . 75.310000000000002 110.891 179.872 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.895 HD21 HG12 ' A' ' 47' ' ' ILE . 1.2 pt? -118.58 -28.69 5.61 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.182 -0.463 . . . . 73.010000000000005 110.935 -179.98 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . 0.651 ' H ' HD23 ' A' ' 33' ' ' LEU . 0.2 OUTLIER . . . . . 0 C--N 1.33 -0.251 0 CA-C-N 116.209 -0.45 . . . . 60.549999999999997 111.128 179.957 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 45' ' ' GLN . . . . . 0.657 ' HB3' HG23 ' A' ' 47' ' ' ILE . 11.7 tt0 . . . . . 0 C--O 1.231 0.126 0 CA-C-O 120.758 0.313 . . . . 62.409999999999997 110.911 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 46' ' ' ILE . . . . . 0.534 HG22 ' O ' ' A' ' 45' ' ' GLN . 0.0 OUTLIER 78.71 -7.87 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.225 -0.443 . . . . 75.129999999999995 111.132 179.976 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . 0.895 HG12 HD21 ' A' ' 33' ' ' LEU . 0.2 OUTLIER -53.12 147.1 2.27 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.18 -0.464 . . . . 54.030000000000001 111.119 179.829 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 48' ' ' PHE . . . . . 0.659 ' HA ' HD22 ' A' ' 33' ' ' LEU . 25.6 p90 -153.06 153.03 32.03 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.178 -0.464 . . . . 63.240000000000002 110.878 179.954 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . 0.459 ' CG ' HD13 ' A' ' 33' ' ' LEU . 12.4 mt-10 -108.36 150.83 26.82 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.158 -0.474 . . . . 71.450000000000003 110.904 -179.954 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . 0.579 HD13 ' HA ' ' A' ' 30' ' ' PHE . 11.5 mm -132.43 138.58 51.89 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.127 -0.488 . . . . 73.140000000000001 111.145 -179.991 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 96.8 m -85.86 127.36 34.56 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.177 -0.465 . . . . 63.140000000000001 111.141 179.984 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . 0.619 HD12 HD12 ' A' ' 66' ' ' LEU . 17.7 mt -128.02 164.5 22.22 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.19 -0.459 . . . . 63.130000000000003 110.883 179.965 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -178.62 172.21 1.44 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.134 -0.484 . . . . 64.010000000000005 110.886 179.933 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -66.53 173.71 3.21 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.187 -0.461 . . . . 74.209999999999994 110.836 -179.798 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 29.0 m -85.22 -27.35 6.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.146 -0.479 . . . . 61.32 111.14 179.92 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -114.72 -172.7 2.17 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.13 -0.486 . . . . 73.420000000000002 110.859 179.938 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 4.1 mmmm -116.24 -22.4 8.88 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.177 -0.465 . . . . 63.25 110.897 179.979 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . 0.541 ' HA ' ' C ' ' A' ' 59' ' ' PRO . 1.5 pt-20 -113.06 143.05 28.41 Favored Pre-proline 0 C--N 1.329 -0.31 0 CA-C-O 121.701 0.762 . . . . 75.450000000000003 110.899 179.931 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 59' ' ' PRO . . . . . 0.541 ' C ' ' HA ' ' A' ' 58' ' ' GLU . 53.5 Cg_endo -69.79 -13.2 12.43 Favored 'Cis proline' 0 C--N 1.342 0.189 0 C-N-CA 122.624 -1.823 . . . . 72.439999999999998 112.31 0.033 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 60' ' ' VAL . . . . . 0.445 ' HB ' ' CG ' ' A' ' 88' ' ' ASN . 8.5 m -149.49 176.26 0.92 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.263 -0.426 . . . . 71.230000000000004 111.076 179.939 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . 0.458 ' O ' ' C ' ' A' ' 62' ' ' SER . 0.9 OUTLIER -112.46 -16.24 12.93 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.128 -0.487 . . . . 75.540000000000006 110.882 179.994 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 62' ' ' SER . . . . . 0.539 ' CB ' HD21 ' A' ' 125' ' ' LEU . 0.4 OUTLIER 33.67 91.12 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.174 -0.467 . . . . 54.43 110.849 -179.806 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 32.8 t -103.31 122.79 45.53 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.143 -0.48 . . . . 75.340000000000003 110.821 -179.803 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 64' ' ' ILE . . . . . 0.732 HD13 HD21 ' A' ' 94' ' ' LEU . 17.7 mt -137.19 143.05 35.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.164 -0.471 . . . . 71.450000000000003 111.121 179.937 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 15.4 m -107.84 115.03 29.4 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.207 -0.451 . . . . 75.120000000000005 111.13 179.945 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . 1.076 HD11 HG21 ' A' ' 121' ' ' THR . 12.3 mt -91.02 110.14 21.4 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.218 -0.446 . . . . 75.420000000000002 110.88 179.962 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 8.7 t60 -100.78 114.64 28.6 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.191 -0.459 . . . . 64.519999999999996 110.866 179.849 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 68' ' ' PHE . . . . . 0.523 ' HA ' HD13 ' A' ' 81' ' ' ILE . 0.0 OUTLIER -103.66 139.79 38.46 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.254 -0.43 . . . . 75.219999999999999 110.909 -179.942 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -120.04 120.81 37.37 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.182 -0.463 . . . . 73.239999999999995 111.131 179.933 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 70' ' ' MET . . . . . 0.662 ' HE3' HD11 ' A' ' 114' ' ' ILE . 12.6 mmt -85.45 104.3 15.12 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.241 -0.436 . . . . 72.150000000000006 110.875 179.995 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 71' ' ' THR . . . . . 0.498 ' O ' ' NE2' ' A' ' 15' ' ' GLN . 0.7 OUTLIER -59.93 158.12 26.83 Favored Pre-proline 0 C--N 1.329 -0.303 0 CA-C-O 121.593 0.711 . . . . 64.019999999999996 111.163 -179.938 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.76 1.05 4.78 Favored 'Trans proline' 0 C--N 1.342 0.213 0 C-N-CA 122.646 2.231 . . . . 55.549999999999997 112.356 179.94 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 73' ' ' MET . . . . . 0.479 ' O ' ' CB ' ' A' ' 76' ' ' TYR . 0.5 OUTLIER -116.67 -25.57 7.32 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.248 -0.433 . . . . 74.329999999999998 110.894 179.934 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 74' ' ' TYR . . . . . 0.62 ' CD1' ' C ' ' A' ' 74' ' ' TYR . 0.1 OUTLIER -46.6 147.61 2.02 Favored Pre-proline 0 C--N 1.329 -0.324 0 CA-C-O 121.664 0.745 . . . . 73.209999999999994 110.956 -179.933 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 75' ' ' PRO . . . . . 0.557 ' C ' ' HA ' ' A' ' 74' ' ' TYR . 53.4 Cg_endo -69.77 -14.86 12.55 Favored 'Cis proline' 0 C--N 1.342 0.184 0 C-N-CA 122.636 -1.818 . . . . 75.200000000000003 112.333 -0.049 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 76' ' ' TYR . . . . . 0.479 ' CB ' ' O ' ' A' ' 73' ' ' MET . 9.0 t80 -34.16 -45.33 0.21 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.202 -0.454 . . . . 65.409999999999997 110.938 -179.941 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 77' ' ' THR . . . . . 0.473 HG23 ' CB ' ' A' ' 73' ' ' MET . 51.9 p -114.97 163.45 15.56 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.099 -0.5 . . . . 73.319999999999993 111.163 -179.976 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -85.7 132.64 43.72 Favored Pre-proline 0 C--N 1.329 -0.326 0 CA-C-O 121.585 0.707 . . . . 72.340000000000003 111.09 179.865 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 79' ' ' PRO . . . . . 0.844 ' HG3' HD11 ' A' ' 113' ' ' ILE . 54.0 Cg_endo -69.71 -170.72 0.41 Allowed 'Trans proline' 0 C--N 1.341 0.165 0 C-N-CA 122.714 2.276 . . . . 75.129999999999995 112.367 -179.993 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . 0.429 ' HG3' ' N ' ' A' ' 81' ' ' ILE . 0.3 OUTLIER -124.36 140.11 53.26 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.242 -0.435 . . . . 72.230000000000004 110.924 179.955 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 81' ' ' ILE . . . . . 0.523 HD13 ' HA ' ' A' ' 68' ' ' PHE . 6.4 mm -130.42 137.07 57.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.127 -0.488 . . . . 64.519999999999996 111.152 179.957 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . 0.48 ' HG3' ' CD ' ' A' ' 84' ' ' LYS . 6.0 pt-20 -140.04 144.09 36.71 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.174 -0.466 . . . . 74.049999999999997 110.888 179.942 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 83' ' ' PHE . . . . . 0.692 ' CG ' HD22 ' A' ' 94' ' ' LEU . 58.6 m-85 -94.3 140.63 29.54 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.142 -0.481 . . . . 72.409999999999997 110.892 -179.918 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 84' ' ' LYS . . . . . 0.48 ' CD ' ' HG3' ' A' ' 82' ' ' GLU . 10.4 mmmt -124.2 169.62 11.55 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.172 -0.467 . . . . 72.120000000000005 110.904 179.932 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 85' ' ' ASN . . . . . 0.575 HD22 ' N ' ' A' ' 85' ' ' ASN . 1.0 OUTLIER 61.78 -74.69 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.216 -0.447 . . . . 64.450000000000003 110.95 179.982 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 86' ' ' VAL . . . . . 0.497 ' CG1' HD11 ' A' ' 94' ' ' LEU . 3.4 m 41.73 90.87 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.167 -0.469 . . . . 74.430000000000007 111.147 179.896 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 87' ' ' GLN . . . . . 0.472 ' NE2' ' OD1' ' A' ' 88' ' ' ASN . 0.2 OUTLIER -104.06 -95.92 0.32 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.167 -0.47 . . . . 74.540000000000006 110.989 179.957 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 88' ' ' ASN . . . . . 0.472 ' OD1' ' NE2' ' A' ' 87' ' ' GLN . 32.0 m120 -45.76 -36.04 4.79 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.183 -0.462 . . . . 62.009999999999998 110.891 -180.0 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 89' ' ' VAL . . . . . 0.541 HG21 ' HG ' ' A' ' 94' ' ' LEU . 3.2 p -63.94 149.97 10.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.16 -0.473 . . . . 62.140000000000001 111.106 179.942 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 90' ' ' MET . . . . . . . . . . . . . 29.8 mtm -98.75 -74.29 0.59 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.194 -0.457 . . . . 74.319999999999993 110.887 179.914 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 7.7 p-10 176.4 -32.34 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.276 -0.42 . . . . 71.329999999999998 110.85 179.932 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -54.43 -45.86 73.12 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.213 -0.449 . . . . 73.400000000000006 110.823 -179.759 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -70.84 -38.97 73.22 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.165 -0.47 . . . . 74.439999999999998 110.893 -179.928 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . 0.732 HD21 HD13 ' A' ' 64' ' ' ILE . 21.4 mt -58.87 -47.43 84.93 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.208 -0.451 . . . . 70.439999999999998 110.912 -179.979 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 26.4 mt-30 -61.06 -34.56 75.08 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.166 -0.47 . . . . 64.25 110.91 179.941 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 96' ' ' MET . . . . . 0.498 ' SD ' ' CE1' ' A' ' 128' ' ' PHE . 9.2 ttp -61.25 -37.94 84.89 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.212 -0.449 . . . . 75.239999999999995 110.838 -179.992 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 97' ' ' LEU . . . . . 0.571 ' O ' ' CD1' ' A' ' 101' ' ' PHE . 27.8 mt -64.32 -43.07 95.8 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.224 -0.444 . . . . 64.299999999999997 110.93 179.994 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 5.0 mmtp -55.06 -38.51 68.12 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.227 -0.442 . . . . 73.409999999999997 110.91 179.82 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -70.19 -42.14 72.8 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.196 -0.456 . . . . 73.129999999999995 110.854 -179.903 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 100' ' ' GLU . . . . . 0.566 ' O ' HD12 ' A' ' 104' ' ' ILE . 6.0 mt-10 -66.69 -24.3 66.24 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.149 -0.478 . . . . 61.509999999999998 110.899 -179.953 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 101' ' ' PHE . . . . . 0.65 ' CD2' HD11 ' A' ' 117' ' ' ILE . 9.4 m-30 -60.1 -31.12 69.74 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.138 -0.483 . . . . 74.230000000000004 110.905 -179.95 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.01 -40.76 87.37 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.148 -0.478 . . . . 71.109999999999999 110.877 179.948 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 1.6 mppt? -67.9 -42.95 80.39 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.226 -0.443 . . . . 74.400000000000006 110.92 179.853 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 104' ' ' ILE . . . . . 0.566 HD12 ' O ' ' A' ' 100' ' ' GLU . 2.3 mt -62.17 -47.59 92.39 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.218 -0.446 . . . . 72.209999999999994 111.1 179.879 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 105' ' ' HIS . . . . . . . . . . . . . 7.7 t-80 -62.93 -42.83 99.93 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.16 -0.473 . . . . 74.439999999999998 110.815 179.94 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -56.49 -41.76 77.18 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.218 -0.446 . . . . 64.150000000000006 110.927 -179.954 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 9.3 t -81.74 -23.63 36.58 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.147 -0.479 . . . . 74.230000000000004 111.157 -179.999 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 108' ' ' SER . . . . . 0.429 ' HB2' HG22 ' A' ' 113' ' ' ILE . 24.2 m -107.93 26.39 10.41 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.236 -0.438 . . . . 74.200000000000003 110.883 -179.89 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -65.73 86.04 0.08 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.113 -0.494 . . . . 73.200000000000003 110.845 -179.907 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 119.75 38.89 0.68 Allowed Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.779 -0.724 . . . . 62.420000000000002 112.464 -179.996 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 111' ' ' GLN . . . . . . . . . . . . . 10.9 pt20 -171.42 -176.43 1.85 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.735 0.302 . . . . 70.450000000000003 110.893 -179.914 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 63.1 mt-10 -60.57 131.59 51.2 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.214 -0.448 . . . . 62.130000000000003 110.911 -179.966 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 113' ' ' ILE . . . . . 0.844 HD11 ' HG3' ' A' ' 79' ' ' PRO . 7.6 pt -127.02 -5.53 4.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.187 -0.461 . . . . 62.310000000000002 111.137 179.969 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 114' ' ' ILE . . . . . 0.852 ' H ' HD12 ' A' ' 114' ' ' ILE . 3.6 mp -68.3 -46.61 80.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.185 -0.461 . . . . 73.239999999999995 111.134 179.828 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 115' ' ' PHE . . . . . 0.745 ' HE1' HG21 ' A' ' 25' ' ' ILE . 12.5 t80 -69.13 -33.83 74.07 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.187 -0.46 . . . . 65.120000000000005 110.853 179.954 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 51.9 mm-40 -68.06 -44.72 75.72 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.191 -0.459 . . . . 70.530000000000001 110.886 -179.949 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 117' ' ' ILE . . . . . 0.65 HD11 ' CD2' ' A' ' 101' ' ' PHE . 0.4 OUTLIER -66.41 -41.2 88.37 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 116.192 -0.458 . . . . 71.25 111.147 179.982 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 118' ' ' THR . . . . . 0.712 HG23 ' O ' ' A' ' 114' ' ' ILE . 69.8 p -67.88 -43.08 80.16 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.162 -0.472 . . . . 73.150000000000006 111.177 179.906 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -66.49 -31.59 72.41 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.209 -0.451 . . . . 71.129999999999995 110.907 -179.878 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 120' ' ' PHE . . . . . 0.441 ' CG ' HD11 ' A' ' 104' ' ' ILE . 0.3 OUTLIER -77.73 -44.73 26.86 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.091 -0.504 . . . . 75.120000000000005 110.912 -179.988 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 121' ' ' THR . . . . . 1.076 HG21 HD11 ' A' ' 66' ' ' LEU . 18.8 p -66.17 -45.42 80.97 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.167 -0.47 . . . . 55.130000000000003 111.203 -179.979 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 3.6 pp0? -60.91 -38.12 84.64 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.187 -0.46 . . . . 62.210000000000001 110.894 179.978 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 123' ' ' GLU . . . . . 0.497 ' CG ' ' N ' ' A' ' 124' ' ' LYS . 1.6 pt-20 -74.12 -48.26 30.7 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.228 -0.442 . . . . 73.430000000000007 110.894 -179.944 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 124' ' ' LYS . . . . . 0.497 ' N ' ' CG ' ' A' ' 123' ' ' GLU . 0.0 OUTLIER -63.5 -28.51 70.0 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.084 -0.507 . . . . 73.400000000000006 110.865 179.986 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 125' ' ' LEU . . . . . 0.668 HD23 ' O ' ' A' ' 125' ' ' LEU . 1.4 tt -68.36 -51.64 42.12 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.208 -0.451 . . . . 53.149999999999999 110.928 179.947 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 26.8 t70 -60.31 -37.19 79.79 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.208 -0.451 . . . . 50.530000000000001 110.882 179.837 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 1.6 mm-40 -60.18 -48.68 80.69 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.185 -0.461 . . . . 73.409999999999997 110.838 -179.895 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 128' ' ' PHE . . . . . 0.498 ' CE1' ' SD ' ' A' ' 96' ' ' MET . 7.4 m-85 . . . . . 0 C--N 1.328 -0.333 0 CA-C-N 116.152 -0.477 . . . . 73.510000000000005 110.874 -179.907 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . 0.409 HD22 ' O ' ' A' ' 72' ' ' PRO . 23.4 mt . . . . . 0 C--O 1.231 0.126 0 CA-C-O 120.771 0.319 . . . . 65.450000000000003 110.912 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 6.3 m-20 -50.96 -34.59 29.51 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.251 -0.432 . . . . 73.409999999999997 110.86 179.827 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 36.6 mm-40 -66.33 -36.38 82.76 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.178 -0.465 . . . . 51.210000000000001 110.897 -179.892 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 17.9 m-85 -65.2 -26.05 67.97 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.168 -0.469 . . . . 74.239999999999995 110.919 -179.857 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -58.73 -37.59 76.51 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.106 -0.497 . . . . 54.420000000000002 110.927 -179.871 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 1.1 mm-40 -58.26 -41.68 84.78 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.104 -0.498 . . . . 70.230000000000004 110.898 179.987 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 2.3 mp -68.08 -40.16 82.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.208 -0.451 . . . . 73.219999999999999 111.141 179.939 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . 0.602 ' OE1' ' CE1' ' A' ' 74' ' ' TYR . 12.6 mm-40 -62.76 -45.04 94.55 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.133 -0.485 . . . . 64.120000000000005 110.87 179.989 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 3.2 t -58.52 -44.51 89.57 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.163 -0.471 . . . . 62.130000000000003 110.889 -179.925 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' ASN . . . . . 0.4 ' O ' ' HG3' ' A' ' 20' ' ' GLU . 0.6 OUTLIER -57.58 -33.51 68.25 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.217 -0.447 . . . . 71.040000000000006 110.911 -179.931 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 2.0 mm-40 -66.05 -37.69 86.47 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.179 -0.464 . . . . 63.299999999999997 110.896 -179.979 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.647 HD21 HG13 ' A' ' 46' ' ' ILE . 9.2 mp -65.7 -51.39 59.71 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.128 -0.487 . . . . 53.439999999999998 110.929 -179.995 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . 0.4 ' HG3' ' O ' ' A' ' 17' ' ' ASN . 2.0 pt-20 -68.25 -32.58 72.87 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.207 -0.452 . . . . 51.329999999999998 110.902 179.902 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -66.05 -49.92 65.99 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.143 -0.48 . . . . 73.329999999999998 111.103 179.952 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . 0.421 ' HA ' HD12 ' A' ' 25' ' ' ILE . 0.7 OUTLIER -77.01 -34.58 22.03 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.226 -0.443 . . . . 72.409999999999997 111.153 179.966 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . 0.403 ' CG ' ' O ' ' A' ' 19' ' ' LEU . 26.6 mtp180 -52.34 -34.45 47.37 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.184 -0.462 . . . . 75.129999999999995 110.913 179.935 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -67.16 -35.02 78.79 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.187 -0.461 . . . . 74.329999999999998 110.86 -179.758 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . 0.678 HG21 ' HE1' ' A' ' 115' ' ' PHE . 3.2 mt -80.61 -44.4 21.65 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.093 -0.503 . . . . 75.120000000000005 111.132 179.895 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 19.9 m-85 -110.73 45.89 1.11 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.208 -0.451 . . . . 62.310000000000002 110.92 -179.941 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 3.1 mtm -43.49 -57.23 3.2 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.127 -0.488 . . . . 74.209999999999994 110.887 179.884 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 5.4 m-20 -81.84 -35.94 28.85 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.203 -0.453 . . . . 71.409999999999997 110.883 179.949 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -80.62 44.03 0.7 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.218 -0.446 . . . . 73.430000000000007 110.827 -179.983 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' PHE . . . . . 0.542 ' HA ' HD13 ' A' ' 50' ' ' ILE . 10.1 t80 -129.15 123.72 32.85 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.233 -0.44 . . . . 71.140000000000001 110.921 -179.937 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 20.3 m -113.17 135.03 54.26 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.171 -0.468 . . . . 64.530000000000001 111.101 -179.882 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -95.94 113.99 25.67 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.216 -0.447 . . . . 52.109999999999999 110.868 179.924 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 1.115 HD23 ' N ' ' A' ' 34' ' ' THR . 0.1 OUTLIER -113.36 -18.74 11.96 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.162 -0.472 . . . . 73.219999999999999 110.93 -179.935 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . 1.115 ' N ' HD23 ' A' ' 33' ' ' LEU . 2.5 m . . . . . 0 C--N 1.33 -0.266 0 CA-C-N 116.163 -0.471 . . . . 73.329999999999998 111.143 179.94 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 45' ' ' GLN . . . . . 0.997 ' HG2' HG23 ' A' ' 47' ' ' ILE . 0.3 OUTLIER . . . . . 0 C--O 1.232 0.147 0 CA-C-O 120.764 0.316 . . . . 74.239999999999995 110.907 . . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 46' ' ' ILE . . . . . 0.661 HG22 ' O ' ' A' ' 45' ' ' GLN . 0.1 OUTLIER 87.52 -18.01 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.214 -0.448 . . . . 73.150000000000006 111.184 -179.971 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . 0.997 HG23 ' HG2' ' A' ' 45' ' ' GLN . 0.1 OUTLIER -38.28 147.2 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.164 -0.471 . . . . 64.230000000000004 111.139 179.811 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 48' ' ' PHE . . . . . 0.86 ' HA ' HD22 ' A' ' 33' ' ' LEU . 1.9 p90 -162.02 160.93 28.19 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.149 -0.478 . . . . 64.120000000000005 110.871 179.975 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . 0.676 ' CG ' HD13 ' A' ' 33' ' ' LEU . 18.8 mt-10 -110.61 155.61 22.12 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.153 -0.476 . . . . 72.329999999999998 110.929 -179.948 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . 0.542 HD13 ' HA ' ' A' ' 30' ' ' PHE . 9.2 mm -135.44 142.28 40.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.2 -0.454 . . . . 64.120000000000005 111.142 179.935 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 89.7 m -88.12 139.18 30.77 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.168 -0.469 . . . . 74.219999999999999 111.167 179.938 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . 0.679 HD12 HD12 ' A' ' 66' ' ' LEU . 17.4 mt -141.12 162.63 35.04 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.232 -0.44 . . . . 64.310000000000002 110.918 179.957 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 53' ' ' ARG . . . . . 0.491 ' C ' HD21 ' A' ' 125' ' ' LEU . 0.0 OUTLIER -178.27 173.76 1.38 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.179 -0.464 . . . . 74.420000000000002 110.817 179.969 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . 0.535 ' N ' HD21 ' A' ' 125' ' ' LEU . 10.9 p -67.46 -173.6 0.32 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.192 -0.458 . . . . 61.100000000000001 110.888 -179.801 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 55' ' ' VAL . . . . . 0.47 HG13 ' OD1' ' A' ' 126' ' ' ASP . 34.0 m -94.13 -28.94 4.21 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.169 -0.468 . . . . 62.020000000000003 111.148 179.935 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -113.54 -173.8 2.34 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.123 -0.489 . . . . 62.350000000000001 110.861 179.941 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -117.61 -13.56 10.25 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.188 -0.46 . . . . 74.319999999999993 110.878 179.986 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . 0.556 ' HA ' ' C ' ' A' ' 59' ' ' PRO . 5.9 pt-20 -122.67 144.11 41.69 Favored Pre-proline 0 C--N 1.329 -0.296 0 CA-C-O 121.637 0.732 . . . . 75.310000000000002 110.85 -179.975 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 59' ' ' PRO . . . . . 0.556 ' C ' ' HA ' ' A' ' 58' ' ' GLU . 53.9 Cg_endo -69.76 -5.18 8.73 Favored 'Cis proline' 0 C--N 1.342 0.2 0 C-N-CA 122.663 -1.807 . . . . 74.150000000000006 112.316 -0.042 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 14.9 m -154.9 -179.5 0.25 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.256 -0.429 . . . . 72.099999999999994 111.17 179.912 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . 0.429 ' O ' ' C ' ' A' ' 62' ' ' SER . 1.2 pt-20 -118.91 -12.8 9.53 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.193 -0.458 . . . . 71.430000000000007 110.843 179.989 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 62' ' ' SER . . . . . 0.919 ' HB3' HD11 ' A' ' 125' ' ' LEU . 7.8 t 35.51 90.78 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.206 -0.452 . . . . 74.310000000000002 110.841 -179.811 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 6.4 t -104.87 123.04 47.02 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.117 -0.492 . . . . 75.010000000000005 110.85 -179.83 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 64' ' ' ILE . . . . . 0.625 HD11 HG11 ' A' ' 89' ' ' VAL . 20.7 mt -136.2 132.18 49.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.121 -0.491 . . . . 74.519999999999996 111.088 179.992 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 87.0 m -95.84 113.96 25.65 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.218 -0.446 . . . . 75.439999999999998 111.1 179.95 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . 0.774 HD11 HG21 ' A' ' 121' ' ' THR . 11.8 mt -94.54 112.62 24.39 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.236 -0.438 . . . . 75.439999999999998 110.913 179.906 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 67' ' ' HIS . . . . . 0.508 ' CE1' HD11 ' A' ' 33' ' ' LEU . 2.6 t60 -108.78 112.0 24.05 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.188 -0.46 . . . . 44.020000000000003 110.811 179.864 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 68' ' ' PHE . . . . . 0.556 ' CE1' HG23 ' A' ' 114' ' ' ILE . 0.0 OUTLIER -102.95 145.11 30.34 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.181 -0.463 . . . . 51.350000000000001 110.878 -179.946 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 69' ' ' ALA . . . . . 0.628 ' HA ' HG22 ' A' ' 47' ' ' ILE . . . -122.32 110.74 16.05 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.135 -0.484 . . . . 54.32 111.124 179.911 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 70' ' ' MET . . . . . 0.503 ' CE ' HD11 ' A' ' 114' ' ' ILE . 3.9 mmt -76.04 86.46 2.94 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.222 -0.444 . . . . 65.319999999999993 110.848 -179.998 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -40.34 156.57 0.18 Allowed Pre-proline 0 C--N 1.33 -0.274 0 CA-C-O 121.579 0.704 . . . . 70.140000000000001 111.145 -179.944 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 72' ' ' PRO . . . . . 0.409 ' O ' HD22 ' A' ' 8' ' ' LEU . 54.0 Cg_endo -69.73 1.47 4.38 Favored 'Trans proline' 0 C--N 1.341 0.161 0 C-N-CA 122.687 2.258 . . . . 41.219999999999999 112.368 179.923 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 73' ' ' MET . . . . . 0.501 ' O ' ' CB ' ' A' ' 76' ' ' TYR . 0.0 OUTLIER -118.25 -26.14 6.4 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.192 -0.458 . . . . 73.310000000000002 110.909 179.908 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 74' ' ' TYR . . . . . 0.656 ' CD1' ' C ' ' A' ' 74' ' ' TYR . 0.0 OUTLIER -48.05 150.65 1.98 Allowed Pre-proline 0 C--N 1.328 -0.346 0 CA-C-O 121.659 0.742 . . . . 75.239999999999995 110.91 -179.864 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 75' ' ' PRO . . . . . 0.546 ' C ' ' HA ' ' A' ' 74' ' ' TYR . 54.3 Cg_endo -69.76 -11.12 11.79 Favored 'Cis proline' 0 C--N 1.34 0.129 0 C-N-CA 122.684 -1.798 . . . . 75.230000000000004 112.365 -0.09 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 76' ' ' TYR . . . . . 0.501 ' CB ' ' O ' ' A' ' 73' ' ' MET . 16.4 t80 -32.82 -53.9 0.35 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.199 -0.455 . . . . 72.25 110.949 -179.96 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 77' ' ' THR . . . . . 0.427 HG23 ' HB3' ' A' ' 73' ' ' MET . 29.6 p -106.98 171.44 7.37 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.075 -0.511 . . . . 43.420000000000002 111.162 -179.947 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -85.09 130.19 53.09 Favored Pre-proline 0 C--N 1.329 -0.325 0 CA-C-O 121.566 0.698 . . . . 43.210000000000001 111.107 179.881 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 79' ' ' PRO . . . . . 0.573 ' HG3' HD11 ' A' ' 113' ' ' ILE . 53.4 Cg_endo -69.8 174.13 9.99 Favored 'Trans proline' 0 C--N 1.341 0.168 0 C-N-CA 122.675 2.25 . . . . 43.520000000000003 112.338 -179.965 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -120.45 137.69 54.2 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.223 -0.444 . . . . 62.229999999999997 110.857 -179.962 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 81' ' ' ILE . . . . . 0.598 HD13 HD13 ' A' ' 117' ' ' ILE . 13.7 mt -143.68 150.13 17.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.136 -0.484 . . . . 62.350000000000001 111.163 179.953 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . 0.492 ' HG3' ' CD ' ' A' ' 84' ' ' LYS . 9.5 pt-20 -149.0 147.48 28.61 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.21 -0.45 . . . . 75.430000000000007 110.915 179.959 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 83' ' ' PHE . . . . . 0.584 ' CG ' HD22 ' A' ' 94' ' ' LEU . 15.2 m-85 -90.51 140.96 29.24 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.154 -0.476 . . . . 74.019999999999996 110.851 -179.901 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 84' ' ' LYS . . . . . 0.512 ' O ' ' N ' ' A' ' 86' ' ' VAL . 8.9 mmmt -124.57 174.43 7.83 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.166 -0.47 . . . . 71.040000000000006 110.91 179.919 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 85' ' ' ASN . . . . . 0.413 ' O ' ' CG2' ' A' ' 86' ' ' VAL . 2.5 m-80 59.3 -75.75 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.215 -0.448 . . . . 73.140000000000001 110.915 179.998 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 86' ' ' VAL . . . . . 0.595 HG11 HD11 ' A' ' 94' ' ' LEU . 3.5 m 41.73 92.65 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.19 -0.459 . . . . 72.219999999999999 111.104 179.901 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -96.22 -77.82 0.47 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.189 -0.46 . . . . 64.5 110.861 -179.958 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -59.71 -56.82 17.09 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.202 -0.454 . . . . 61.25 110.881 -179.937 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 89' ' ' VAL . . . . . 0.664 HG21 ' HG ' ' A' ' 94' ' ' LEU . 2.1 p -51.07 136.68 9.95 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.19 -0.459 . . . . 74.310000000000002 111.158 179.887 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 90' ' ' MET . . . . . . . . . . . . . 6.8 mtm -88.97 -70.37 0.65 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.121 -0.491 . . . . 44.229999999999997 110.912 179.906 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 91' ' ' ASP . . . . . 0.433 ' HA ' HD12 ' A' ' 94' ' ' LEU . 10.3 t0 -175.19 -31.62 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.217 -0.447 . . . . 73.310000000000002 110.867 179.957 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -53.98 -46.76 71.78 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.191 -0.459 . . . . 71.400000000000006 110.85 -179.722 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 93' ' ' GLN . . . . . 0.545 ' HG3' ' CE1' ' A' ' 128' ' ' PHE . 0.3 OUTLIER -70.24 -37.69 75.01 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.158 -0.474 . . . . 63.229999999999997 110.908 -179.978 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . 0.664 ' HG ' HG21 ' A' ' 89' ' ' VAL . 48.1 mt -59.2 -47.54 84.94 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.203 -0.453 . . . . 74.329999999999998 110.96 179.995 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 1.7 mt-30 -61.42 -35.74 78.39 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.181 -0.463 . . . . 62.340000000000003 110.857 179.932 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 96' ' ' MET . . . . . . . . . . . . . 31.7 ttp -61.44 -42.25 98.46 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.21 -0.45 . . . . 74.400000000000006 110.827 -179.964 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 97' ' ' LEU . . . . . 0.643 HD22 HG22 ' A' ' 121' ' ' THR . 79.8 mt -60.02 -43.82 95.02 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.243 -0.435 . . . . 71.530000000000001 110.965 -179.995 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 98' ' ' LYS . . . . . 0.499 ' HD3' ' CE2' ' A' ' 83' ' ' PHE . 6.0 mmtp -55.49 -39.06 69.96 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.18 -0.464 . . . . 73.319999999999993 110.867 179.809 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 57.1 m -64.11 -40.2 95.69 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.25 -0.432 . . . . 60.43 110.862 -179.888 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 100' ' ' GLU . . . . . 0.575 ' OE1' ' CZ ' ' A' ' 120' ' ' PHE . 19.5 mm-40 -71.44 -27.24 63.14 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.116 -0.493 . . . . 73.310000000000002 110.91 -179.983 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 101' ' ' PHE . . . . . 0.745 ' CG ' HD11 ' A' ' 117' ' ' ILE . 10.5 m-30 -60.19 -31.12 69.84 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.173 -0.467 . . . . 64.349999999999994 110.856 -179.867 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 14.1 ttmt -73.92 -41.54 61.92 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.165 -0.47 . . . . 73.200000000000003 110.898 179.958 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 17.4 ttpp -69.82 -41.25 75.24 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.167 -0.469 . . . . 74.120000000000005 110.905 179.856 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 104' ' ' ILE . . . . . 0.562 HD12 ' O ' ' A' ' 100' ' ' GLU . 3.9 mt -64.45 -47.59 88.72 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 116.257 -0.429 . . . . 55.25 111.131 179.86 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 105' ' ' HIS . . . . . . . . . . . . . 2.1 t60 -62.82 -43.62 98.33 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.197 -0.456 . . . . 73.420000000000002 110.86 179.861 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -56.53 -43.3 79.69 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.196 -0.456 . . . . 72.219999999999999 110.872 -179.913 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 107' ' ' THR . . . . . 0.432 HG22 ' O ' ' A' ' 104' ' ' ILE . 9.9 t -77.87 -30.12 50.7 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.166 -0.47 . . . . 61.130000000000003 111.161 -179.991 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 108' ' ' SER . . . . . 0.425 ' CB ' HG22 ' A' ' 113' ' ' ILE . 27.0 m -107.05 33.08 4.15 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.221 -0.445 . . . . 71.319999999999993 110.846 -179.867 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 34.1 ttt180 -76.57 80.65 3.24 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.149 -0.478 . . . . 71.409999999999997 110.859 -179.93 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 151.21 -29.44 0.98 Allowed Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.694 -0.765 . . . . 51.109999999999999 112.484 -179.953 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 111' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -111.41 -164.43 0.92 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.784 0.326 . . . . 63.5 110.956 -179.909 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 12.2 mt-10 -67.23 133.87 50.56 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.234 -0.439 . . . . 63.219999999999999 110.839 -179.924 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 113' ' ' ILE . . . . . 0.573 HD11 ' HG3' ' A' ' 79' ' ' PRO . 2.8 pt -122.95 -16.94 5.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.096 -0.502 . . . . 44.210000000000001 111.121 179.986 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 114' ' ' ILE . . . . . 0.698 ' O ' HG23 ' A' ' 118' ' ' THR . 9.5 mm -57.18 -43.12 81.09 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 116.152 -0.476 . . . . 61.450000000000003 111.065 179.879 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 115' ' ' PHE . . . . . 0.678 ' HE1' HG21 ' A' ' 25' ' ' ILE . 20.0 t80 -70.58 -31.94 69.14 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.167 -0.47 . . . . 72.430000000000007 110.89 179.991 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 9.1 mm-40 -68.21 -47.79 66.9 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.144 -0.48 . . . . 72.010000000000005 110.862 -179.892 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 117' ' ' ILE . . . . . 0.745 HD11 ' CG ' ' A' ' 101' ' ' PHE . 0.7 OUTLIER -66.02 -42.34 91.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.134 -0.484 . . . . 71.030000000000001 111.117 -179.999 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 118' ' ' THR . . . . . 0.698 HG23 ' O ' ' A' ' 114' ' ' ILE . 70.8 p -68.01 -41.69 81.85 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.192 -0.458 . . . . 74.310000000000002 111.169 179.98 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 29.5 t -67.33 -39.71 85.84 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.199 -0.455 . . . . 71.409999999999997 110.858 -179.873 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 120' ' ' PHE . . . . . 0.575 ' CZ ' ' OE1' ' A' ' 100' ' ' GLU . 1.0 OUTLIER -67.13 -47.75 70.17 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.147 -0.479 . . . . 74.409999999999997 110.894 -179.923 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 121' ' ' THR . . . . . 0.774 HG21 HD11 ' A' ' 66' ' ' LEU . 34.8 p -65.44 -39.72 92.42 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.141 -0.481 . . . . 74.209999999999994 111.133 -179.955 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 37.6 tt0 -65.03 -47.04 78.85 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.223 -0.444 . . . . 75.400000000000006 110.907 -180.0 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 123' ' ' GLU . . . . . 0.438 ' CG ' ' N ' ' A' ' 124' ' ' LYS . 3.6 pt-20 -67.05 -44.42 80.19 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.231 -0.44 . . . . 64.450000000000003 110.88 -179.949 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 124' ' ' LYS . . . . . 0.59 ' O ' ' CE1' ' A' ' 128' ' ' PHE . 0.0 OUTLIER -70.78 -32.32 69.39 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.141 -0.481 . . . . 74.340000000000003 110.848 -180.0 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 125' ' ' LEU . . . . . 0.919 HD11 ' HB3' ' A' ' 62' ' ' SER . 1.9 tp -63.25 -42.42 99.17 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.221 -0.445 . . . . 75.239999999999995 110.91 179.933 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 126' ' ' ASP . . . . . 0.47 ' OD1' HG13 ' A' ' 55' ' ' VAL . 9.3 m-20 -59.65 -38.65 81.98 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.186 -0.461 . . . . 62.409999999999997 110.855 179.834 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 1.6 mt-10 -62.68 -36.12 81.88 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.142 -0.481 . . . . 74.420000000000002 110.862 -179.858 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 128' ' ' PHE . . . . . 0.59 ' CE1' ' O ' ' A' ' 124' ' ' LYS . 7.0 m-30 . . . . . 0 C--N 1.329 -0.308 0 CA-C-N 116.221 -0.445 . . . . 73.439999999999998 110.894 -179.93 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 60.5 mt . . . . . 0 C--O 1.231 0.091 0 CA-C-O 120.811 0.339 . . . . 74.099999999999994 110.924 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . 0.45 ' N ' ' OD1' ' A' ' 9' ' ' ASP . 0.8 OUTLIER -51.82 -35.23 43.63 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.18 -0.463 . . . . 55.109999999999999 110.844 179.886 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 71.5 mm-40 -65.23 -40.42 94.03 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.238 -0.437 . . . . 74.439999999999998 110.914 -179.952 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 13.6 m-85 -54.69 -23.15 16.21 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.199 -0.455 . . . . 74.120000000000005 110.909 -179.862 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER -57.48 -36.39 71.41 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.124 -0.489 . . . . 71.430000000000007 110.974 -179.938 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . 0.496 ' HG3' ' N ' ' A' ' 14' ' ' ILE . 4.8 pt-20 -62.24 -42.09 99.01 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.084 -0.507 . . . . 72.329999999999998 110.898 179.957 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' ILE . . . . . 0.496 ' N ' ' HG3' ' A' ' 13' ' ' GLU . 3.9 mp -68.52 -42.75 83.88 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-N 116.147 -0.478 . . . . 75.109999999999999 111.142 179.989 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . 0.585 ' OE1' ' CE1' ' A' ' 74' ' ' TYR . 10.8 mm-40 -66.06 -45.9 79.71 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.184 -0.462 . . . . 35.509999999999998 110.906 179.931 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 43.2 t -59.56 -41.53 90.33 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.185 -0.461 . . . . 45.340000000000003 110.882 -179.929 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -59.71 -33.65 71.89 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.208 -0.451 . . . . 73.129999999999995 110.918 -179.925 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 7.6 mt-10 -62.67 -38.09 89.0 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.162 -0.472 . . . . 74.319999999999993 110.906 -179.997 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.464 ' CD2' HG13 ' A' ' 46' ' ' ILE . 9.9 mp -66.65 -51.64 53.86 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.122 -0.49 . . . . 53.32 110.887 -179.955 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 3.0 pt-20 -68.74 -32.7 72.67 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.18 -0.464 . . . . 72.329999999999998 110.881 179.94 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -66.66 -48.33 69.72 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.186 -0.461 . . . . 53.520000000000003 111.113 179.923 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . 0.638 HD11 ' HB2' ' A' ' 115' ' ' PHE . 0.9 OUTLIER -75.85 -34.68 28.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.22 -0.446 . . . . 74.409999999999997 111.116 179.984 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -55.55 -34.44 64.74 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.169 -0.469 . . . . 65.030000000000001 110.833 -179.993 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -64.96 -35.73 82.12 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.254 -0.43 . . . . 61.399999999999999 110.861 -179.816 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . 0.663 HG21 ' HE1' ' A' ' 115' ' ' PHE . 3.1 mt -82.86 -41.23 17.16 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.125 -0.489 . . . . 63.109999999999999 111.139 179.967 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 23.0 m-85 -109.9 45.36 1.1 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.158 -0.474 . . . . 65.340000000000003 110.899 -179.97 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 1.8 mtm -43.55 -53.64 5.45 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.144 -0.48 . . . . 54.32 110.891 179.884 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -94.85 -20.86 19.08 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.18 -0.464 . . . . 71.219999999999999 110.836 -179.985 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -88.32 19.76 3.62 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.166 -0.47 . . . . 72.040000000000006 110.887 -179.984 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' PHE . . . . . 0.66 ' HA ' HD13 ' A' ' 50' ' ' ILE . 1.9 t80 -105.97 145.96 30.66 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.23 -0.441 . . . . 74.530000000000001 110.887 -179.887 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 40.1 m -125.71 133.41 52.13 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.121 -0.491 . . . . 52.549999999999997 111.077 -179.849 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 1.1 t0 -97.94 115.5 28.27 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.188 -0.46 . . . . 73.540000000000006 110.891 179.882 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 1.107 HD23 ' N ' ' A' ' 34' ' ' THR . 0.1 OUTLIER -118.91 -21.21 7.85 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.2 -0.454 . . . . 71.109999999999999 110.908 -179.92 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . 1.107 ' N ' HD23 ' A' ' 33' ' ' LEU . 2.1 m . . . . . 0 C--N 1.33 -0.269 0 CA-C-N 116.183 -0.462 . . . . 53.43 111.158 179.922 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 45' ' ' GLN . . . . . 0.961 ' HG2' HG23 ' A' ' 47' ' ' ILE . 0.1 OUTLIER . . . . . 0 C--O 1.232 0.144 0 CA-C-O 120.791 0.329 . . . . 74.209999999999994 110.959 . . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 46' ' ' ILE . . . . . 0.649 HG22 ' O ' ' A' ' 45' ' ' GLN . 0.1 OUTLIER 86.75 -12.55 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.199 -0.455 . . . . 75.450000000000003 111.136 179.964 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . 0.961 HG23 ' HG2' ' A' ' 45' ' ' GLN . 0.1 OUTLIER -52.41 149.18 1.36 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.157 -0.474 . . . . 72.099999999999994 111.143 179.836 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 48' ' ' PHE . . . . . 0.925 ' HA ' HD22 ' A' ' 33' ' ' LEU . 30.2 p90 -161.88 162.8 29.41 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.197 -0.456 . . . . 75.519999999999996 110.909 179.945 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . 0.768 ' CG ' HD13 ' A' ' 33' ' ' LEU . 5.8 mt-10 -111.91 159.74 18.09 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.146 -0.479 . . . . 74.319999999999993 110.908 -179.911 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . 0.66 HD13 ' HA ' ' A' ' 30' ' ' PHE . 13.1 mm -135.25 142.7 39.1 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 116.191 -0.459 . . . . 74.129999999999995 111.143 179.961 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 83.9 m -84.88 129.58 34.79 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.185 -0.461 . . . . 63.43 111.116 179.984 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . 0.464 HD23 ' HA ' ' A' ' 52' ' ' LEU . 12.0 mt -135.74 155.58 50.15 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.18 -0.464 . . . . 71.299999999999997 110.916 179.948 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -175.15 165.56 3.4 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.213 -0.449 . . . . 73.310000000000002 110.853 179.93 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -54.93 170.65 0.17 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.191 -0.459 . . . . 71.439999999999998 110.847 -179.785 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 18.7 m -84.43 -22.65 7.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.133 -0.485 . . . . 74.409999999999997 111.105 179.978 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -115.9 -176.99 3.05 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.151 -0.477 . . . . 75.239999999999995 110.846 179.995 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 6.1 mmmm -115.63 -7.28 12.17 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.192 -0.458 . . . . 72.430000000000007 110.927 179.955 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . 0.551 ' HA ' ' C ' ' A' ' 59' ' ' PRO . 44.6 mt-10 -129.01 148.17 67.89 Favored Pre-proline 0 C--N 1.33 -0.269 0 CA-C-O 121.652 0.739 . . . . 74.519999999999996 110.867 179.986 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 59' ' ' PRO . . . . . 0.551 ' C ' ' HA ' ' A' ' 58' ' ' GLU . 54.0 Cg_endo -69.73 -3.51 7.7 Favored 'Cis proline' 0 C--N 1.342 0.185 0 C-N-CA 122.686 -1.798 . . . . 63.439999999999998 112.369 -0.035 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 60' ' ' VAL . . . . . 0.424 HG21 ' CG ' ' A' ' 88' ' ' ASN . 18.6 m -148.44 179.06 0.74 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.235 -0.439 . . . . 70.319999999999993 111.132 179.94 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . 0.437 ' O ' ' C ' ' A' ' 62' ' ' SER . 8.7 tt0 -107.28 -17.17 14.21 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.137 -0.483 . . . . 61.539999999999999 110.886 -179.988 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 62' ' ' SER . . . . . 0.592 ' CB ' HD21 ' A' ' 125' ' ' LEU . 1.0 OUTLIER 34.15 91.0 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.137 -0.483 . . . . 34.329999999999998 110.829 -179.807 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 35.1 t -112.71 122.98 49.26 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.127 -0.488 . . . . 45.130000000000003 110.86 -179.856 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 64' ' ' ILE . . . . . 0.799 HD13 HD21 ' A' ' 94' ' ' LEU . 17.8 mt -136.53 138.63 46.36 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.121 -0.49 . . . . 63.439999999999998 111.141 179.959 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 90.5 m -104.38 113.89 27.75 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.2 -0.455 . . . . 75.150000000000006 111.112 179.974 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . 0.98 HD11 HG21 ' A' ' 121' ' ' THR . 7.1 mt -93.06 113.26 25.48 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.197 -0.456 . . . . 71.140000000000001 110.883 179.972 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 67' ' ' HIS . . . . . 0.624 ' CE1' HD11 ' A' ' 33' ' ' LEU . 12.6 t60 -105.13 112.56 25.73 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.179 -0.464 . . . . 72.109999999999999 110.859 179.872 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 68' ' ' PHE . . . . . 0.598 ' CZ ' HG23 ' A' ' 114' ' ' ILE . 0.0 OUTLIER -103.65 139.88 38.33 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.183 -0.462 . . . . 54.109999999999999 110.889 -179.927 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 69' ' ' ALA . . . . . 0.457 ' HA ' HG22 ' A' ' 47' ' ' ILE . . . -114.47 115.67 27.62 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.14 -0.482 . . . . 65.129999999999995 111.081 179.949 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 70' ' ' MET . . . . . 0.48 ' HE2' HD11 ' A' ' 114' ' ' ILE . 5.9 mmt -79.11 102.25 8.34 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.229 -0.441 . . . . 62.350000000000001 110.84 179.99 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -60.84 153.95 61.49 Favored Pre-proline 0 C--N 1.33 -0.255 0 CA-C-O 121.632 0.729 . . . . 74.319999999999993 111.123 -179.956 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_endo -69.73 0.47 5.57 Favored 'Trans proline' 0 C--N 1.341 0.18 0 C-N-CA 122.643 2.229 . . . . 64.150000000000006 112.342 179.906 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 73' ' ' MET . . . . . 0.657 ' HB3' HG23 ' A' ' 77' ' ' THR . 0.0 OUTLIER -114.38 -26.92 7.77 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.236 -0.438 . . . . 55.140000000000001 110.932 179.858 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 74' ' ' TYR . . . . . 0.639 ' CD1' ' C ' ' A' ' 74' ' ' TYR . 0.0 OUTLIER -47.3 149.38 1.86 Allowed Pre-proline 0 C--N 1.328 -0.349 0 CA-C-O 121.673 0.749 . . . . 74.340000000000003 110.881 -179.853 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 75' ' ' PRO . . . . . 0.551 ' C ' ' HA ' ' A' ' 74' ' ' TYR . 53.2 Cg_endo -69.78 -13.12 12.39 Favored 'Cis proline' 0 C--N 1.341 0.175 0 C-N-CA 122.709 -1.788 . . . . 61.020000000000003 112.342 -0.031 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 76' ' ' TYR . . . . . 0.476 ' CB ' ' O ' ' A' ' 73' ' ' MET . 3.3 t80 -33.44 -52.4 0.38 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.211 -0.449 . . . . 75.409999999999997 110.934 -179.91 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 77' ' ' THR . . . . . 0.657 HG23 ' HB3' ' A' ' 73' ' ' MET . 43.1 p -106.37 -176.6 3.12 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.099 -0.5 . . . . 52.43 111.189 179.99 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -105.88 130.39 23.09 Favored Pre-proline 0 C--N 1.328 -0.338 0 CA-C-O 121.597 0.713 . . . . 53.530000000000001 111.113 179.865 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 79' ' ' PRO . . . . . 0.842 ' HG3' HD11 ' A' ' 113' ' ' ILE . 53.6 Cg_endo -69.79 -170.88 0.42 Allowed 'Trans proline' 0 C--N 1.342 0.228 0 C-N-CA 122.66 2.24 . . . . 72.319999999999993 112.344 -179.949 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . 0.468 ' HG3' ' N ' ' A' ' 81' ' ' ILE . 0.4 OUTLIER -123.88 142.12 51.41 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.246 -0.434 . . . . 71.409999999999997 110.922 -179.957 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 81' ' ' ILE . . . . . 0.736 ' CG2' HD22 ' A' ' 66' ' ' LEU . 2.3 mm -131.37 143.25 41.15 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.176 -0.465 . . . . 74.109999999999999 111.147 179.972 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . 0.481 ' HG3' ' CD ' ' A' ' 84' ' ' LYS . 4.3 pt-20 -148.58 142.07 25.35 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.182 -0.463 . . . . 74.239999999999995 110.856 179.973 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 83' ' ' PHE . . . . . 0.792 ' CG ' HD22 ' A' ' 94' ' ' LEU . 36.4 m-85 -95.19 141.37 28.88 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.13 -0.487 . . . . 72.109999999999999 110.902 -179.972 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 84' ' ' LYS . . . . . 0.484 ' O ' ' N ' ' A' ' 86' ' ' VAL . 7.7 mmmt -124.17 170.26 10.9 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.116 -0.493 . . . . 73.450000000000003 110.896 179.967 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 85' ' ' ASN . . . . . 0.547 HD22 ' N ' ' A' ' 85' ' ' ASN . 1.1 m-80 60.55 -75.68 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.209 -0.451 . . . . 73.319999999999993 110.904 179.954 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 86' ' ' VAL . . . . . 1.125 HG11 HD11 ' A' ' 94' ' ' LEU . 2.5 m 40.3 93.42 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-N 116.21 -0.45 . . . . 64.239999999999995 111.146 179.91 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -93.72 -93.61 0.17 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.1 -0.5 . . . . 63.030000000000001 110.923 -179.992 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 88' ' ' ASN . . . . . 0.424 ' CG ' HG21 ' A' ' 60' ' ' VAL . 1.3 t30 -44.44 -48.45 9.96 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.197 -0.456 . . . . 75.030000000000001 110.907 -179.931 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 89' ' ' VAL . . . . . 0.675 HG11 HD11 ' A' ' 64' ' ' ILE . 2.0 p -60.1 141.11 17.16 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.171 -0.468 . . . . 72.239999999999995 111.119 179.908 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 90' ' ' MET . . . . . . . . . . . . . 5.5 mtm -92.55 -63.98 1.16 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.182 -0.463 . . . . 72.319999999999993 110.883 179.911 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 1.4 t0 173.88 -27.44 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.231 -0.441 . . . . 74.540000000000006 110.907 -179.997 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -54.38 -47.05 73.12 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.194 -0.457 . . . . 70.219999999999999 110.859 -179.745 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 93' ' ' GLN . . . . . 0.435 ' HB2' ' CD2' ' A' ' 128' ' ' PHE . 0.8 OUTLIER -71.08 -36.94 72.44 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.14 -0.482 . . . . 75.239999999999995 110.934 179.999 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . 1.125 HD11 HG11 ' A' ' 86' ' ' VAL . 21.9 mt -57.95 -44.21 86.87 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.198 -0.456 . . . . 72.310000000000002 110.922 -179.983 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 2.9 mm-40 -63.76 -35.26 80.0 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.203 -0.453 . . . . 72.510000000000005 110.873 179.954 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 96' ' ' MET . . . . . . . . . . . . . 23.1 ttp -59.99 -44.35 94.58 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.226 -0.443 . . . . 75.129999999999995 110.918 179.935 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 97' ' ' LEU . . . . . 0.525 HD22 ' HA ' ' A' ' 121' ' ' THR . 34.5 mt -57.79 -41.95 83.13 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.246 -0.434 . . . . 54.340000000000003 110.903 179.987 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 98' ' ' LYS . . . . . 0.436 ' HD3' ' CE2' ' A' ' 83' ' ' PHE . 12.9 mmtm -54.64 -37.09 65.26 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.151 -0.477 . . . . 62.439999999999998 110.927 179.819 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -68.81 -41.97 77.92 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.249 -0.432 . . . . 73.209999999999994 110.877 -179.894 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -69.17 -26.01 64.64 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.105 -0.498 . . . . 62.409999999999997 110.869 -179.98 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 101' ' ' PHE . . . . . 0.796 ' CD2' HD11 ' A' ' 117' ' ' ILE . 10.6 m-30 -59.7 -33.12 71.19 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.161 -0.472 . . . . 72.230000000000004 110.895 -179.92 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -63.99 -44.13 93.62 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.155 -0.475 . . . . 73.329999999999998 110.899 179.948 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.86 -36.17 77.79 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.238 -0.437 . . . . 73.010000000000005 110.934 179.846 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 104' ' ' ILE . . . . . 0.429 ' O ' HG22 ' A' ' 107' ' ' THR . 5.2 mt -63.22 -47.65 91.25 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.216 -0.447 . . . . 64.420000000000002 111.128 179.865 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 105' ' ' HIS . . . . . . . . . . . . . 5.9 t60 -62.96 -41.8 99.64 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.209 -0.45 . . . . 75.430000000000007 110.872 179.86 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -58.91 -43.6 91.1 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.231 -0.44 . . . . 72.310000000000002 110.896 -179.958 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 107' ' ' THR . . . . . 0.429 HG22 ' O ' ' A' ' 104' ' ' ILE . 10.2 t -76.75 -27.9 55.54 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.144 -0.48 . . . . 74.329999999999998 111.152 -179.973 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 60.2 m -114.37 37.44 3.37 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.188 -0.46 . . . . 71.439999999999998 110.883 -179.83 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 18.7 ttt180 -81.6 77.44 8.45 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.088 -0.506 . . . . 64.040000000000006 110.88 -179.949 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 154.1 -15.12 0.58 Allowed Glycine 0 N--CA 1.451 -0.334 0 C-N-CA 120.757 -0.735 . . . . 51.219999999999999 112.493 -179.97 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 111' ' ' GLN . . . . . . . . . . . . . 14.3 pt20 -130.0 -166.21 1.64 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.754 0.311 . . . . 74.409999999999997 110.901 -179.886 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 66.1 mt-10 -61.4 131.87 51.65 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.158 -0.474 . . . . 65.400000000000006 110.918 -179.921 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 113' ' ' ILE . . . . . 0.842 HD11 ' HG3' ' A' ' 79' ' ' PRO . 20.6 pt -121.25 -8.11 9.91 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-N 116.163 -0.472 . . . . 73.150000000000006 111.128 179.966 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 114' ' ' ILE . . . . . 0.603 ' O ' HG23 ' A' ' 118' ' ' THR . 27.7 mm -66.52 -44.77 90.05 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-N 116.153 -0.476 . . . . 75.439999999999998 111.175 179.867 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 115' ' ' PHE . . . . . 0.663 ' HE1' HG21 ' A' ' 25' ' ' ILE . 28.8 t80 -68.04 -33.47 74.64 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.195 -0.457 . . . . 73.239999999999995 110.856 179.894 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 -67.79 -47.02 70.32 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.195 -0.457 . . . . 42.520000000000003 110.937 -179.928 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 117' ' ' ILE . . . . . 0.796 HD11 ' CD2' ' A' ' 101' ' ' PHE . 0.4 OUTLIER -64.18 -39.4 85.35 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.103 -0.499 . . . . 74.230000000000004 111.151 179.946 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 118' ' ' THR . . . . . 0.603 HG23 ' O ' ' A' ' 114' ' ' ILE . 74.2 p -68.19 -43.38 78.23 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.158 -0.474 . . . . 73.200000000000003 111.144 179.956 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -63.0 -44.09 96.99 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.258 -0.428 . . . . 72.319999999999993 110.906 -179.88 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -68.29 -46.62 69.83 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.103 -0.498 . . . . 72.129999999999995 110.883 -179.964 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 121' ' ' THR . . . . . 0.98 HG21 HD11 ' A' ' 66' ' ' LEU . 14.7 p -62.97 -39.18 93.91 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.089 -0.505 . . . . 75.409999999999997 111.148 -179.905 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 49.0 tp60 -65.71 -45.14 83.87 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.218 -0.446 . . . . 64.140000000000001 110.958 179.999 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 6.4 pt-20 -74.0 -29.89 62.19 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.148 -0.478 . . . . 72.140000000000001 110.881 -179.952 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 124' ' ' LYS . . . . . 0.501 ' CE ' ' HA ' ' A' ' 124' ' ' LYS . 0.0 OUTLIER -75.51 -45.48 37.95 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.165 -0.47 . . . . 74.530000000000001 110.894 179.971 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 125' ' ' LEU . . . . . 0.98 HD13 ' N ' ' A' ' 126' ' ' ASP . 0.0 OUTLIER -69.5 -42.84 74.22 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.205 -0.452 . . . . 73.439999999999998 110.957 179.917 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 126' ' ' ASP . . . . . 0.98 ' N ' HD13 ' A' ' 125' ' ' LEU . 14.3 t0 -60.25 -45.69 92.39 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.181 -0.463 . . . . 73.019999999999996 110.893 179.804 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 127' ' ' GLU . . . . . 0.489 ' HG3' ' N ' ' A' ' 128' ' ' PHE . 0.3 OUTLIER -60.94 -27.86 68.53 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.227 -0.442 . . . . 72.530000000000001 110.87 -179.922 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 128' ' ' PHE . . . . . 0.489 ' N ' ' HG3' ' A' ' 127' ' ' GLU . 0.1 OUTLIER . . . . . 0 C--N 1.328 -0.335 0 CA-C-N 116.194 -0.457 . . . . 55.100000000000001 110.922 -179.95 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . 0.636 HD13 ' O ' ' A' ' 72' ' ' PRO . 19.3 mt . . . . . 0 C--O 1.232 0.146 0 CA-C-O 120.815 0.34 . . . . 75.319999999999993 110.917 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . 0.42 ' OD1' ' N ' ' A' ' 9' ' ' ASP . 0.4 OUTLIER -55.63 -28.0 52.84 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.188 -0.46 . . . . 75.439999999999998 110.903 179.842 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 75.1 mm-40 -68.05 -36.79 80.45 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.227 -0.442 . . . . 45.399999999999999 110.895 -179.931 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 23.8 m-85 -63.94 -25.78 68.29 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.206 -0.452 . . . . 73.129999999999995 110.927 -179.879 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -59.4 -37.55 78.28 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.144 -0.48 . . . . 73.549999999999997 110.913 -179.916 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 2.2 mm-40 -60.23 -45.42 93.28 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.149 -0.478 . . . . 60.020000000000003 110.898 -179.985 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 3.7 mp -68.03 -41.06 84.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.098 -0.501 . . . . 70.219999999999999 111.166 179.954 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . 0.427 ' HG2' ' CB ' ' A' ' 70' ' ' MET . 0.8 OUTLIER -63.16 -47.87 80.84 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.207 -0.451 . . . . 72.409999999999997 110.961 179.895 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 3.8 t -58.83 -43.17 90.62 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.179 -0.464 . . . . 71.430000000000007 110.859 -179.938 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 1.1 t30 -57.79 -33.65 68.77 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.192 -0.458 . . . . 74.310000000000002 110.898 -179.854 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 4.9 mt-10 -66.1 -37.7 86.4 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.155 -0.475 . . . . 70.319999999999993 110.87 179.99 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.446 ' CD2' HG13 ' A' ' 46' ' ' ILE . 9.7 mp -64.99 -51.53 61.18 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.199 -0.455 . . . . 75.400000000000006 110.897 -179.939 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 1.5 pt-20 -68.58 -33.49 74.16 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.2 -0.455 . . . . 65.109999999999999 110.837 179.977 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -65.89 -49.63 67.37 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.214 -0.448 . . . . 74.120000000000005 111.116 179.967 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . 0.73 HD11 ' HB2' ' A' ' 115' ' ' PHE . 0.6 OUTLIER -74.9 -34.41 32.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.2 -0.455 . . . . 60.409999999999997 111.172 179.928 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 4.1 mtp180 -52.32 -36.61 53.74 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.126 -0.488 . . . . 74.019999999999996 110.88 179.957 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -63.5 -34.14 77.12 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.188 -0.46 . . . . 64.439999999999998 110.837 -179.777 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . 0.763 HD13 ' CE1' ' A' ' 115' ' ' PHE . 3.3 mt -82.73 -43.52 18.8 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.145 -0.48 . . . . 71.109999999999999 111.155 179.922 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 26.6 m-85 -108.82 46.62 0.96 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.156 -0.475 . . . . 75.040000000000006 110.929 -179.972 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 1.2 mtm -46.02 -58.35 3.66 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.099 -0.5 . . . . 73.129999999999995 110.846 179.948 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 20.2 m-20 -92.06 -5.65 52.47 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.259 -0.428 . . . . 74.109999999999999 110.881 179.952 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . 0.448 ' O ' HG23 ' A' ' 50' ' ' ILE . 1.7 m-20 -102.96 30.28 4.9 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.213 -0.449 . . . . 72.329999999999998 110.865 179.991 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' PHE . . . . . 0.556 ' CE2' ' HB2' ' A' ' 48' ' ' PHE . 8.8 t80 -117.72 144.09 45.6 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.216 -0.447 . . . . 65.400000000000006 110.901 -179.93 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 21.9 m -123.52 133.07 54.05 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.152 -0.477 . . . . 71.439999999999998 111.115 -179.905 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -94.36 114.23 26.25 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.197 -0.456 . . . . 73.129999999999995 110.879 179.907 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.8 HD21 HG12 ' A' ' 47' ' ' ILE . 1.7 pt? -113.52 -14.49 12.69 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.231 -0.44 . . . . 74.430000000000007 110.92 -179.947 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . 0.407 ' O ' ' O ' ' A' ' 33' ' ' LEU . 0.2 OUTLIER . . . . . 0 C--N 1.329 -0.286 0 CA-C-N 116.148 -0.478 . . . . 42.439999999999998 111.147 179.966 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 45' ' ' GLN . . . . . 0.573 ' O ' HG22 ' A' ' 46' ' ' ILE . 32.6 tt0 . . . . . 0 C--O 1.232 0.14 0 CA-C-O 120.762 0.315 . . . . 75.450000000000003 110.918 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 46' ' ' ILE . . . . . 0.638 HG23 ' O ' ' A' ' 46' ' ' ILE . 0.0 OUTLIER 84.63 5.65 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.247 -0.433 . . . . 65.030000000000001 111.125 179.951 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . 0.8 HG12 HD21 ' A' ' 33' ' ' LEU . 0.2 OUTLIER -63.54 141.57 17.97 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.159 -0.473 . . . . 64.450000000000003 111.15 179.82 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 48' ' ' PHE . . . . . 0.556 ' HB2' ' CE2' ' A' ' 30' ' ' PHE . 8.5 p90 -147.44 150.53 34.8 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.126 -0.488 . . . . 64.519999999999996 110.882 179.964 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . 0.537 ' CG ' HD13 ' A' ' 33' ' ' LEU . 11.5 mt-10 -108.46 157.15 18.7 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.15 -0.477 . . . . 71.430000000000007 110.866 -179.903 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . 0.538 HD13 ' HA ' ' A' ' 30' ' ' PHE . 26.0 mm -136.15 141.87 40.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.159 -0.473 . . . . 74.430000000000007 111.126 179.969 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 52.8 m -89.39 126.36 35.51 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.197 -0.456 . . . . 71.019999999999996 111.125 179.949 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . 0.661 HD12 HD12 ' A' ' 66' ' ' LEU . 23.7 mt -130.34 162.05 29.93 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.212 -0.449 . . . . 73.109999999999999 110.921 179.95 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -179.26 173.88 1.08 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.207 -0.452 . . . . 72.239999999999995 110.859 179.919 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -64.69 166.66 8.42 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.207 -0.451 . . . . 73.319999999999993 110.857 -179.78 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 16.4 m -77.73 -28.56 15.74 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.11 -0.495 . . . . 74.120000000000005 111.099 179.988 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 3.1 t0 -118.78 -168.16 1.5 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.191 -0.459 . . . . 71.510000000000005 110.88 179.878 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 1.3 mmmp? -118.04 -16.81 9.79 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.208 -0.451 . . . . 73.409999999999997 110.877 -179.953 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . 0.563 ' HA ' ' C ' ' A' ' 59' ' ' PRO . 43.0 mt-10 -118.27 143.05 32.26 Favored Pre-proline 0 C--N 1.329 -0.31 0 CA-C-O 121.597 0.713 . . . . 71.129999999999995 110.921 179.969 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 59' ' ' PRO . . . . . 0.563 ' C ' ' HA ' ' A' ' 58' ' ' GLU . 53.6 Cg_endo -69.83 -10.89 11.87 Favored 'Cis proline' 0 C--O 1.232 0.191 0 C-N-CA 122.701 -1.791 . . . . 60.25 112.324 0.095 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 60' ' ' VAL . . . . . 0.445 ' HB ' ' CG ' ' A' ' 88' ' ' ASN . 9.4 m -149.41 172.11 1.68 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.236 -0.438 . . . . 65.219999999999999 111.128 179.91 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . 0.447 ' O ' ' C ' ' A' ' 62' ' ' SER . 1.0 OUTLIER -109.23 -16.64 14.02 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.155 -0.475 . . . . 54.020000000000003 110.879 -179.929 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 62' ' ' SER . . . . . 0.484 ' HB3' HD11 ' A' ' 125' ' ' LEU . 0.3 OUTLIER 34.2 88.54 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.137 -0.483 . . . . 61.240000000000002 110.888 -179.802 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 15.6 t -105.93 123.44 47.99 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.131 -0.486 . . . . 70.019999999999996 110.842 -179.799 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 64' ' ' ILE . . . . . 0.529 HD13 HD11 ' A' ' 94' ' ' LEU . 50.3 mt -141.01 137.88 34.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.124 -0.489 . . . . 73.510000000000005 111.172 179.937 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 62.5 m -97.68 114.75 26.78 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.173 -0.467 . . . . 71.430000000000007 111.206 179.918 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . 0.661 HD12 HD12 ' A' ' 52' ' ' LEU . 11.0 mt -91.46 111.85 23.52 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.221 -0.445 . . . . 44.310000000000002 110.96 179.951 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 1.1 t60 -107.72 112.29 24.9 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.209 -0.451 . . . . 73.319999999999993 110.839 179.899 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 68' ' ' PHE . . . . . 0.593 ' CZ ' HG23 ' A' ' 114' ' ' ILE . 0.0 OUTLIER -103.19 141.06 36.52 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.18 -0.464 . . . . 72.109999999999999 110.857 -179.91 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -122.43 128.72 51.26 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.161 -0.472 . . . . 74.329999999999998 111.101 179.893 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 70' ' ' MET . . . . . 0.427 ' CB ' ' HG2' ' A' ' 15' ' ' GLN . 0.1 OUTLIER -94.6 110.08 21.93 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.222 -0.445 . . . . 75.120000000000005 110.905 179.959 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -62.38 157.98 51.37 Favored Pre-proline 0 C--N 1.33 -0.257 0 CA-C-O 121.61 0.719 . . . . 62.329999999999998 111.157 -179.931 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 72' ' ' PRO . . . . . 0.636 ' O ' HD13 ' A' ' 8' ' ' LEU . 53.8 Cg_endo -69.78 2.52 3.47 Favored 'Trans proline' 0 C--N 1.342 0.2 0 C-N-CA 122.695 2.264 . . . . 71.030000000000001 112.318 179.989 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 73' ' ' MET . . . . . 0.507 ' O ' ' CB ' ' A' ' 76' ' ' TYR . 1.3 mtp -120.01 -25.39 5.8 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.23 -0.441 . . . . 52.229999999999997 110.854 179.952 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 74' ' ' TYR . . . . . 0.648 ' CD1' ' C ' ' A' ' 74' ' ' TYR . 0.1 OUTLIER -47.89 148.65 2.72 Favored Pre-proline 0 C--N 1.329 -0.325 0 CA-C-O 121.699 0.762 . . . . 62.420000000000002 110.885 -179.84 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 75' ' ' PRO . . . . . 0.553 ' C ' ' HA ' ' A' ' 74' ' ' TYR . 53.7 Cg_endo -69.8 -14.41 12.56 Favored 'Cis proline' 0 C--N 1.342 0.207 0 C-N-CA 122.631 -1.82 . . . . 75.319999999999993 112.348 -0.051 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 76' ' ' TYR . . . . . 0.507 ' CB ' ' O ' ' A' ' 73' ' ' MET . 10.3 t80 -33.36 -45.14 0.15 Allowed 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.215 -0.448 . . . . 75.409999999999997 110.928 -179.926 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 77' ' ' THR . . . . . 0.482 HG23 ' CB ' ' A' ' 73' ' ' MET . 59.7 p -110.82 178.12 4.46 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.077 -0.51 . . . . 73.019999999999996 111.147 -179.957 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -94.81 133.22 26.9 Favored Pre-proline 0 C--N 1.329 -0.301 0 CA-C-O 121.571 0.7 . . . . 54.200000000000003 111.091 179.856 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 79' ' ' PRO . . . . . 0.488 ' HG3' ' CD1' ' A' ' 113' ' ' ILE . 53.9 Cg_endo -69.74 -163.74 0.11 Allowed 'Trans proline' 0 C--N 1.341 0.138 0 C-N-CA 122.687 2.258 . . . . 54.439999999999998 112.32 -179.985 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . 0.4 ' O ' HG13 ' A' ' 81' ' ' ILE . 3.3 tt0 -148.52 136.61 21.0 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.192 -0.458 . . . . 24.329999999999998 110.884 -179.996 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 81' ' ' ILE . . . . . 0.533 HD13 HD13 ' A' ' 117' ' ' ILE . 12.4 mt -143.51 150.53 17.3 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.147 -0.479 . . . . 63.130000000000003 111.101 179.995 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . 0.494 ' HG3' ' CD ' ' A' ' 84' ' ' LYS . 10.1 pt-20 -147.69 148.25 30.83 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.156 -0.474 . . . . 72.409999999999997 110.871 179.956 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 83' ' ' PHE . . . . . 0.508 ' CZ ' ' HD3' ' A' ' 98' ' ' LYS . 8.0 m-85 -88.28 140.84 29.06 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.149 -0.478 . . . . 75.019999999999996 110.871 -179.92 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 84' ' ' LYS . . . . . 0.494 ' CD ' ' HG3' ' A' ' 82' ' ' GLU . 7.8 mmmt -125.68 174.57 8.2 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.179 -0.464 . . . . 72.329999999999998 110.91 179.927 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 85' ' ' ASN . . . . . 0.449 HD22 ' N ' ' A' ' 85' ' ' ASN . 1.7 m-80 61.99 -74.32 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.214 -0.448 . . . . 64.409999999999997 110.882 179.938 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 86' ' ' VAL . . . . . 0.867 HG11 HD21 ' A' ' 94' ' ' LEU . 3.5 m 41.42 90.53 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.227 -0.442 . . . . 63.030000000000001 111.132 179.924 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -102.89 -67.8 0.86 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.141 -0.481 . . . . 73.209999999999994 110.962 -179.992 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 88' ' ' ASN . . . . . 0.445 ' CG ' ' HB ' ' A' ' 60' ' ' VAL . 13.3 m120 -88.24 55.46 3.44 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.212 -0.449 . . . . 74.129999999999995 110.857 -179.958 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 89' ' ' VAL . . . . . 0.723 HG21 HD13 ' A' ' 94' ' ' LEU . 1.6 p -156.21 138.48 6.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.171 -0.468 . . . . 73.340000000000003 111.102 179.891 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 90' ' ' MET . . . . . . . . . . . . . 11.2 mtm -83.95 -71.17 0.52 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.146 -0.479 . . . . 73.019999999999996 110.863 179.949 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 1.1 p30 176.9 -28.67 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.2 -0.454 . . . . 52.340000000000003 110.874 179.923 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -53.85 -44.11 70.07 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.228 -0.442 . . . . 74.140000000000001 110.824 -179.791 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 93' ' ' GLN . . . . . 0.527 ' HG3' ' CE2' ' A' ' 128' ' ' PHE . 0.1 OUTLIER -70.55 -38.55 74.17 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.129 -0.487 . . . . 73.140000000000001 110.892 -179.922 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . 0.867 HD21 HG11 ' A' ' 86' ' ' VAL . 0.1 OUTLIER -58.99 -49.2 78.78 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.192 -0.458 . . . . 73.400000000000006 110.891 -179.972 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 43.8 mt-30 -62.84 -34.69 77.86 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.203 -0.453 . . . . 65.25 110.938 179.911 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 96' ' ' MET . . . . . . . . . . . . . 24.2 ttp -61.12 -37.7 83.74 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.2 -0.454 . . . . 53.509999999999998 110.861 179.949 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 97' ' ' LEU . . . . . 0.945 HD22 HG22 ' A' ' 121' ' ' THR . 83.5 mt -65.33 -43.13 91.93 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.264 -0.425 . . . . 75.109999999999999 110.94 179.992 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 98' ' ' LYS . . . . . 0.508 ' HD3' ' CZ ' ' A' ' 83' ' ' PHE . 6.7 mmtp -58.67 -36.68 74.54 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.164 -0.471 . . . . 54.409999999999997 110.922 179.853 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -64.2 -44.93 90.46 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.187 -0.46 . . . . 75.230000000000004 110.817 -179.899 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 100' ' ' GLU . . . . . 0.511 ' HG2' ' CE1' ' A' ' 120' ' ' PHE . 2.5 mp0 -69.62 -25.39 63.92 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.137 -0.483 . . . . 71.540000000000006 110.868 -179.9 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 101' ' ' PHE . . . . . 0.793 ' CG ' HD11 ' A' ' 117' ' ' ILE . 11.9 m-30 -60.06 -34.98 74.16 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.185 -0.461 . . . . 74.340000000000003 110.896 -179.927 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 4.2 tppp? -70.79 -38.78 73.39 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.187 -0.461 . . . . 73.510000000000005 110.877 179.954 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 25.2 mtmm -70.39 -42.9 71.11 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.187 -0.461 . . . . 72.420000000000002 110.881 179.92 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 104' ' ' ILE . . . . . 0.491 HD12 ' O ' ' A' ' 100' ' ' GLU . 3.9 mt -62.19 -47.38 93.39 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.224 -0.444 . . . . 72.120000000000005 111.133 179.883 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 105' ' ' HIS . . . . . . . . . . . . . 7.7 t60 -62.65 -42.63 99.71 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.17 -0.468 . . . . 74.209999999999994 110.815 179.887 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 1.2 m-20 -59.4 -43.52 92.97 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.195 -0.457 . . . . 75.549999999999997 110.888 -179.875 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 107' ' ' THR . . . . . 0.41 HG22 ' O ' ' A' ' 104' ' ' ILE . 8.9 t -76.84 -27.64 55.18 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.192 -0.458 . . . . 62.219999999999999 111.12 -179.995 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 108' ' ' SER . . . . . 0.502 ' HB3' HG22 ' A' ' 113' ' ' ILE . 0.4 OUTLIER -114.84 36.21 3.95 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.267 -0.424 . . . . 70.430000000000007 110.813 -179.83 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -78.38 75.38 4.9 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.185 -0.461 . . . . 73.239999999999995 110.877 -179.972 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 162.06 -27.34 0.26 Allowed Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.765 -0.731 . . . . 73.310000000000002 112.504 -179.986 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 111' ' ' GLN . . . . . . . . . . . . . 2.6 pt20 -120.06 -168.38 1.6 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.779 0.323 . . . . 73.209999999999994 110.94 -179.917 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 28.4 mt-10 -53.71 135.32 41.33 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.198 -0.456 . . . . 73.219999999999999 110.898 -179.961 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 113' ' ' ILE . . . . . 0.502 HG22 ' HB3' ' A' ' 108' ' ' SER . 1.2 pt -126.5 -25.74 1.48 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 116.125 -0.488 . . . . 74.049999999999997 111.11 179.981 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 114' ' ' ILE . . . . . 0.654 ' O ' HG23 ' A' ' 118' ' ' THR . 1.1 mp -57.07 -44.46 83.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.188 -0.46 . . . . 73.030000000000001 111.129 179.865 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 115' ' ' PHE . . . . . 0.763 ' CE1' HD13 ' A' ' 25' ' ' ILE . 39.8 t80 -64.35 -35.33 80.52 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.155 -0.475 . . . . 73.109999999999999 110.875 179.926 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 37.1 mm-40 -67.89 -44.87 76.0 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.13 -0.486 . . . . 75.519999999999996 110.903 -179.92 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 117' ' ' ILE . . . . . 0.793 HD11 ' CG ' ' A' ' 101' ' ' PHE . 0.3 OUTLIER -65.94 -40.83 88.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.153 -0.476 . . . . 61.119999999999997 111.114 179.987 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 118' ' ' THR . . . . . 0.654 HG23 ' O ' ' A' ' 114' ' ' ILE . 66.6 p -67.6 -43.86 79.46 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.177 -0.465 . . . . 73.530000000000001 111.175 179.911 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 45.2 t -68.32 -39.39 81.98 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.218 -0.446 . . . . 72.040000000000006 110.829 -179.814 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 120' ' ' PHE . . . . . 0.511 ' CE1' ' HG2' ' A' ' 100' ' ' GLU . 4.1 t80 -68.98 -48.13 63.9 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.115 -0.493 . . . . 63.109999999999999 110.904 -179.956 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 121' ' ' THR . . . . . 0.945 HG22 HD22 ' A' ' 97' ' ' LEU . 75.6 p -63.7 -39.98 95.66 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.129 -0.487 . . . . 74.129999999999995 111.108 -179.909 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 122' ' ' GLN . . . . . 0.456 ' NE2' ' O ' ' A' ' 122' ' ' GLN . 0.0 OUTLIER -64.63 -50.66 66.25 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.213 -0.449 . . . . 64.120000000000005 110.895 -179.981 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 123' ' ' GLU . . . . . 0.43 ' CG ' ' N ' ' A' ' 124' ' ' LYS . 5.7 pt-20 -65.87 -43.82 87.22 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.191 -0.459 . . . . 62.240000000000002 110.929 -179.97 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 124' ' ' LYS . . . . . 0.468 ' CE ' ' HA ' ' A' ' 124' ' ' LYS . 0.1 OUTLIER -68.77 -31.74 70.99 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.167 -0.47 . . . . 65.109999999999999 110.917 179.949 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 125' ' ' LEU . . . . . 0.846 ' O ' HD12 ' A' ' 125' ' ' LEU . 1.1 tp -71.47 -43.47 66.56 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.194 -0.457 . . . . 74.109999999999999 110.913 179.933 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 6.3 t0 -68.88 -46.6 68.0 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.168 -0.469 . . . . 75.439999999999998 110.881 179.843 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 127' ' ' GLU . . . . . 0.445 ' CG ' ' HA ' ' A' ' 124' ' ' LYS . 1.0 OUTLIER -60.26 -27.85 67.58 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.164 -0.471 . . . . 64.040000000000006 110.886 -179.901 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 128' ' ' PHE . . . . . 0.527 ' CE2' ' HG3' ' A' ' 93' ' ' GLN . 0.2 OUTLIER . . . . . 0 C--N 1.33 -0.265 0 CA-C-N 116.132 -0.485 . . . . 75.540000000000006 110.893 -179.909 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . 0.623 HD13 ' O ' ' A' ' 72' ' ' PRO . 18.3 mt . . . . . 0 C--O 1.23 0.071 0 CA-C-O 120.838 0.351 . . . . 73.219999999999999 110.905 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 9.8 t70 -53.59 -28.47 32.43 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.157 -0.474 . . . . 42.439999999999998 110.891 179.823 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . 0.432 ' O ' ' HG2' ' A' ' 13' ' ' GLU . 6.1 mm-40 -68.13 -38.65 82.43 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.208 -0.451 . . . . 71.510000000000005 110.93 -179.944 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 25.9 m-85 -70.37 -21.85 62.83 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.189 -0.46 . . . . 71.439999999999998 110.893 -179.867 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -57.23 -41.17 79.01 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.133 -0.485 . . . . 75.430000000000007 110.939 -179.952 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . 0.493 ' HG2' HD12 ' A' ' 14' ' ' ILE . 4.1 pt-20 -66.32 -40.23 89.8 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.12 -0.491 . . . . 73.129999999999995 110.908 179.995 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' ILE . . . . . 0.493 HD12 ' HG2' ' A' ' 13' ' ' GLU . 3.4 mp -67.76 -39.86 82.76 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-N 116.12 -0.491 . . . . 73.420000000000002 111.136 179.961 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 93.5 mt-30 -64.09 -48.37 76.41 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.206 -0.452 . . . . 73.409999999999997 110.915 179.933 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -63.9 -36.86 85.33 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.144 -0.48 . . . . 62.329999999999998 110.862 -179.918 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -58.05 -33.92 69.53 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.159 -0.473 . . . . 75.310000000000002 110.906 -179.872 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 1.2 mp0 -66.04 -38.17 87.73 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.182 -0.463 . . . . 74.129999999999995 110.891 179.996 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.405 ' CD1' ' CE1' ' A' ' 48' ' ' PHE . 8.7 mp -65.6 -51.28 60.9 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.117 -0.492 . . . . 71.340000000000003 110.923 -179.954 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -68.64 -35.55 77.42 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.201 -0.454 . . . . 73.129999999999995 110.879 179.944 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -66.57 -50.53 62.79 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.182 -0.463 . . . . 51.420000000000002 111.127 179.884 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . 0.771 ' HA ' HD12 ' A' ' 25' ' ' ILE . 0.7 OUTLIER -73.84 -34.19 39.46 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.239 -0.437 . . . . 62.409999999999997 111.117 179.971 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 34.4 mtp180 -52.25 -35.58 50.16 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.178 -0.464 . . . . 74.0 110.865 179.973 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -67.18 -35.05 78.83 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.173 -0.467 . . . . 73.349999999999994 110.863 -179.78 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . 0.811 HD13 ' CE1' ' A' ' 115' ' ' PHE . 3.9 mt -78.11 -45.23 27.33 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.129 -0.487 . . . . 72.109999999999999 111.165 179.933 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 30.2 m-85 -109.9 43.32 1.36 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.148 -0.478 . . . . 73.230000000000004 110.924 -179.915 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 1.8 mtm -40.72 -55.63 2.35 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.094 -0.503 . . . . 75.439999999999998 110.877 179.926 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -86.85 -25.76 24.35 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.249 -0.432 . . . . 72.230000000000004 110.812 -179.979 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -92.77 31.21 1.42 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.183 -0.462 . . . . 73.510000000000005 110.882 179.989 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' PHE . . . . . 0.615 ' HA ' HD13 ' A' ' 50' ' ' ILE . 10.1 t80 -115.59 130.55 56.91 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.155 -0.475 . . . . 71.319999999999993 110.882 -179.913 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 53.8 m -117.46 126.39 52.54 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.131 -0.486 . . . . 61.219999999999999 111.133 -179.916 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 4.6 t0 -101.04 114.81 29.09 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.201 -0.454 . . . . 63.229999999999997 110.868 179.913 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.854 HD21 ' CE1' ' A' ' 67' ' ' HIS . 0.2 OUTLIER -119.24 5.88 11.23 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.209 -0.451 . . . . 75.409999999999997 110.912 -179.943 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . 0.562 ' N ' HD12 ' A' ' 33' ' ' LEU . 2.1 m . . . . . 0 C--N 1.33 -0.278 0 CA-C-N 116.18 -0.463 . . . . 61.420000000000002 111.14 179.934 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 45' ' ' GLN . . . . . 0.703 ' HB3' HD12 ' A' ' 47' ' ' ILE . 12.8 tt0 . . . . . 0 C--O 1.232 0.133 0 CA-C-O 120.787 0.327 . . . . 74.549999999999997 110.911 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 46' ' ' ILE . . . . . 0.464 ' O ' ' C ' ' A' ' 47' ' ' ILE . 0.0 OUTLIER 81.89 -29.76 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.175 -0.466 . . . . 75.239999999999995 111.149 179.966 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . 0.703 HD12 ' HB3' ' A' ' 45' ' ' GLN . 0.2 OUTLIER -31.33 147.05 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 116.158 -0.474 . . . . 75.319999999999993 111.147 179.815 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 48' ' ' PHE . . . . . 0.478 ' HA ' ' CD1' ' A' ' 33' ' ' LEU . 2.0 p90 -158.9 166.35 32.05 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.207 -0.451 . . . . 74.109999999999999 110.843 179.968 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . 0.766 ' CD ' HD23 ' A' ' 33' ' ' LEU . 6.3 mt-10 -108.87 161.08 15.47 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.125 -0.489 . . . . 74.230000000000004 110.856 -179.926 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . 0.615 HD13 ' HA ' ' A' ' 30' ' ' PHE . 8.6 mm -142.92 138.32 27.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-N 116.138 -0.483 . . . . 70.209999999999994 111.103 179.972 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 78.2 m -91.05 128.99 37.08 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.201 -0.454 . . . . 73.540000000000006 111.137 179.963 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . 0.87 HD12 HD22 ' A' ' 66' ' ' LEU . 16.9 mt -130.32 166.02 21.27 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.254 -0.43 . . . . 74.349999999999994 110.934 179.946 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 53' ' ' ARG . . . . . 0.436 ' CB ' ' O ' ' A' ' 62' ' ' SER . 5.4 ptt180 -177.48 171.18 1.98 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.2 -0.454 . . . . 72.439999999999998 110.876 179.963 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . 0.492 ' H ' ' HG ' ' A' ' 62' ' ' SER . 6.4 p -63.23 -175.8 0.12 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.196 -0.456 . . . . 73.0 110.829 -179.822 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 22.0 m -91.51 -22.96 5.96 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.118 -0.492 . . . . 71.040000000000006 111.13 179.936 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 3.2 t0 -118.55 -172.96 2.38 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.164 -0.471 . . . . 72.430000000000007 110.873 179.904 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -118.83 -4.05 10.72 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.166 -0.47 . . . . 73.540000000000006 110.886 -179.999 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . 0.54 ' HA ' ' C ' ' A' ' 59' ' ' PRO . 5.1 mm-40 -136.33 150.29 70.31 Favored Pre-proline 0 C--N 1.329 -0.287 0 CA-C-O 121.649 0.738 . . . . 73.219999999999999 110.911 179.937 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 59' ' ' PRO . . . . . 0.54 ' C ' ' HA ' ' A' ' 58' ' ' GLU . 54.1 Cg_endo -69.73 -1.85 6.81 Favored 'Cis proline' 0 C--N 1.341 0.162 0 C-N-CA 122.707 -1.789 . . . . 65.219999999999999 112.361 -0.038 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 60' ' ' VAL . . . . . 0.438 ' N ' ' HA ' ' A' ' 58' ' ' GLU . 34.5 m -144.86 168.6 9.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.231 -0.44 . . . . 42.109999999999999 111.162 179.883 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . 0.41 ' O ' ' O ' ' A' ' 62' ' ' SER . 22.3 tt0 -100.03 -29.14 12.7 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.168 -0.469 . . . . 65.420000000000002 110.909 -179.966 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 62' ' ' SER . . . . . 0.492 ' HG ' ' H ' ' A' ' 54' ' ' SER . 20.1 p 50.69 102.86 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.155 -0.475 . . . . 74.340000000000003 110.852 -179.81 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 63' ' ' SER . . . . . 0.468 ' N ' HE21 ' A' ' 87' ' ' GLN . 49.7 p -129.55 122.93 30.18 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.133 -0.485 . . . . 72.230000000000004 110.831 -179.8 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 64' ' ' ILE . . . . . 1.027 HD11 HG21 ' A' ' 89' ' ' VAL . 52.8 mt -143.93 132.03 18.34 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.163 -0.472 . . . . 70.510000000000005 111.179 179.9 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 91.7 m -92.93 119.33 32.11 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.228 -0.442 . . . . 74.540000000000006 111.168 179.954 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . 0.87 HD22 HD12 ' A' ' 52' ' ' LEU . 1.5 mp -97.39 109.82 22.5 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.188 -0.46 . . . . 62.520000000000003 110.917 179.989 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 67' ' ' HIS . . . . . 0.854 ' CE1' HD21 ' A' ' 33' ' ' LEU . 39.9 t60 -102.05 109.69 21.47 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.152 -0.476 . . . . 73.409999999999997 110.841 179.873 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 68' ' ' PHE . . . . . 0.513 ' CE2' ' HB3' ' A' ' 66' ' ' LEU . 0.0 OUTLIER -104.08 139.91 38.51 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.184 -0.462 . . . . 73.239999999999995 110.873 -179.919 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 69' ' ' ALA . . . . . 0.443 ' O ' ' CB ' ' A' ' 79' ' ' PRO . . . -121.23 120.6 35.65 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.168 -0.469 . . . . 65.230000000000004 111.116 179.912 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 1.7 mmt -85.34 89.95 7.8 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.241 -0.436 . . . . 61.509999999999998 110.875 179.998 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -41.26 160.33 0.15 Allowed Pre-proline 0 C--N 1.33 -0.277 0 CA-C-O 121.595 0.712 . . . . 53.240000000000002 111.13 -179.913 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 72' ' ' PRO . . . . . 0.623 ' O ' HD13 ' A' ' 8' ' ' LEU . 53.4 Cg_endo -69.78 2.97 3.06 Favored 'Trans proline' 0 C--N 1.341 0.162 0 C-N-CA 122.704 2.269 . . . . 71.510000000000005 112.34 179.953 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 73' ' ' MET . . . . . 0.501 ' O ' ' CB ' ' A' ' 76' ' ' TYR . 0.1 OUTLIER -121.44 -25.24 5.21 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.216 -0.447 . . . . 73.150000000000006 110.911 179.869 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 74' ' ' TYR . . . . . 0.632 ' CD1' ' C ' ' A' ' 74' ' ' TYR . 0.0 OUTLIER -46.95 149.86 1.47 Allowed Pre-proline 0 C--N 1.329 -0.315 0 CA-C-O 121.684 0.754 . . . . 70.049999999999997 110.945 -179.904 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 75' ' ' PRO . . . . . 0.551 ' C ' ' HA ' ' A' ' 74' ' ' TYR . 53.7 Cg_endo -69.75 -10.79 11.65 Favored 'Cis proline' 0 C--O 1.232 0.186 0 C-N-CA 122.673 -1.803 . . . . 61.450000000000003 112.338 -0.103 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 76' ' ' TYR . . . . . 0.501 ' CB ' ' O ' ' A' ' 73' ' ' MET . 20.9 t80 -33.81 -45.46 0.19 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.262 -0.427 . . . . 74.219999999999999 110.937 -179.924 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 77' ' ' THR . . . . . 0.404 HG23 ' CB ' ' A' ' 73' ' ' MET . 16.8 p -114.86 -175.03 2.6 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.118 -0.492 . . . . 74.209999999999994 111.152 179.998 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -99.94 132.96 22.01 Favored Pre-proline 0 C--N 1.329 -0.291 0 CA-C-O 121.566 0.698 . . . . 72.310000000000002 111.123 179.863 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 79' ' ' PRO . . . . . 0.735 ' HG3' HD11 ' A' ' 113' ' ' ILE . 54.0 Cg_endo -69.75 -164.21 0.12 Allowed 'Trans proline' 0 C--N 1.341 0.175 0 C-N-CA 122.71 2.273 . . . . 73.099999999999994 112.336 180.0 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 9.4 tt0 -131.73 129.2 40.33 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.171 -0.468 . . . . 63.350000000000001 110.857 -179.944 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 81' ' ' ILE . . . . . 0.42 HD13 ' HA ' ' A' ' 68' ' ' PHE . 5.1 mm -120.64 145.58 26.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.157 -0.474 . . . . 74.319999999999993 111.085 179.994 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . 0.504 ' HG3' ' CD ' ' A' ' 84' ' ' LYS . 4.2 pt-20 -149.01 136.44 20.24 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.162 -0.472 . . . . 64.319999999999993 110.898 179.944 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 83' ' ' PHE . . . . . 0.613 ' CB ' HD22 ' A' ' 94' ' ' LEU . 38.5 m-85 -93.08 138.63 31.36 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.156 -0.474 . . . . 75.319999999999993 110.836 -179.888 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 84' ' ' LYS . . . . . 0.504 ' CD ' ' HG3' ' A' ' 82' ' ' GLU . 9.7 mmmt -124.93 171.88 9.84 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.113 -0.494 . . . . 63.130000000000003 110.915 179.942 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 85' ' ' ASN . . . . . 0.414 ' C ' ' CG2' ' A' ' 86' ' ' VAL . 7.8 m-80 61.24 -74.47 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.2 -0.455 . . . . 63.219999999999999 110.923 179.978 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 86' ' ' VAL . . . . . 0.737 HG11 HD11 ' A' ' 94' ' ' LEU . 2.8 m 41.61 84.59 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.179 -0.464 . . . . 61.25 111.092 179.864 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 87' ' ' GLN . . . . . 0.468 HE21 ' N ' ' A' ' 63' ' ' SER . 0.4 OUTLIER -93.06 -79.66 0.4 Allowed 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.18 -0.464 . . . . 65.129999999999995 110.923 -179.984 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -54.41 -44.16 72.12 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.194 -0.457 . . . . 71.0 110.887 -179.988 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 89' ' ' VAL . . . . . 1.027 HG21 HD11 ' A' ' 64' ' ' ILE . 1.7 t -62.21 151.74 7.36 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.163 -0.472 . . . . 42.549999999999997 111.136 179.932 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 90' ' ' MET . . . . . . . . . . . . . 14.8 mtm -102.25 -70.35 0.75 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.192 -0.458 . . . . 70.510000000000005 110.864 179.897 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 91' ' ' ASP . . . . . 0.432 ' HA ' HD12 ' A' ' 94' ' ' LEU . 3.0 p-10 -172.26 -36.95 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.255 -0.429 . . . . 70.409999999999997 110.898 179.989 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -54.28 -41.51 68.95 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.179 -0.464 . . . . 64.129999999999995 110.843 -179.802 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 93' ' ' GLN . . . . . 0.478 ' CD ' ' CD2' ' A' ' 128' ' ' PHE . 0.8 OUTLIER -69.03 -42.03 76.91 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.16 -0.473 . . . . 75.019999999999996 110.95 -179.965 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . 0.737 HD11 HG11 ' A' ' 86' ' ' VAL . 50.8 mt -59.36 -49.03 79.38 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.137 -0.483 . . . . 65.530000000000001 110.931 -179.993 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 1.8 mm100 -65.98 -36.13 82.48 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.148 -0.478 . . . . 74.150000000000006 110.905 179.921 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 96' ' ' MET . . . . . 0.453 ' SD ' ' CE1' ' A' ' 128' ' ' PHE . 49.8 ttp -60.89 -38.58 86.15 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.168 -0.469 . . . . 71.409999999999997 110.851 179.99 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 97' ' ' LEU . . . . . 0.978 HD22 HG22 ' A' ' 121' ' ' THR . 98.4 mt -60.62 -46.8 88.92 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.238 -0.437 . . . . 71.420000000000002 110.959 -179.984 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 12.8 mmtm -55.8 -34.66 65.53 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.148 -0.478 . . . . 61.409999999999997 110.878 179.822 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 67.1 m -68.7 -45.74 70.82 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.25 -0.432 . . . . 42.32 110.861 -179.87 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 100' ' ' GLU . . . . . 0.47 ' O ' HD12 ' A' ' 104' ' ' ILE . 8.6 pt-20 -75.16 -23.47 57.77 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.106 -0.497 . . . . 72.150000000000006 110.885 -179.958 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 101' ' ' PHE . . . . . 0.651 ' CD2' HD11 ' A' ' 117' ' ' ILE . 8.0 m-30 -59.09 -34.37 71.92 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.175 -0.466 . . . . 63.119999999999997 110.877 -179.933 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.34 -42.83 98.97 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.114 -0.494 . . . . 63.109999999999999 110.929 179.989 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 21.0 mtmm -64.91 -37.81 88.89 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.2 -0.455 . . . . 65.540000000000006 110.916 179.818 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 104' ' ' ILE . . . . . 0.621 HD11 ' CD2' ' A' ' 120' ' ' PHE . 3.0 mt -65.01 -47.55 87.58 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 116.236 -0.438 . . . . 51.340000000000003 111.132 179.853 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 105' ' ' HIS . . . . . . . . . . . . . 4.3 t60 -62.97 -41.49 99.55 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.172 -0.467 . . . . 74.329999999999998 110.868 179.901 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -60.63 -43.3 97.67 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.188 -0.46 . . . . 64.439999999999998 110.887 -179.952 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 9.2 t -78.95 -28.74 43.73 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.194 -0.457 . . . . 72.519999999999996 111.172 179.986 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 12.5 m -114.77 40.4 2.61 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.239 -0.437 . . . . 63.450000000000003 110.845 -179.839 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 34.5 ttt180 -84.8 90.32 7.73 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.14 -0.482 . . . . 74.420000000000002 110.837 -179.927 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 110' ' ' GLY . . . . . 0.444 ' HA2' ' CB ' ' A' ' 75' ' ' PRO . . . 110.59 45.33 0.91 Allowed Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.725 -0.75 . . . . 62.32 112.49 -179.973 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 111' ' ' GLN . . . . . 0.422 ' O ' ' CB ' ' A' ' 112' ' ' GLU . 5.1 pt20 -174.33 28.52 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.745 0.307 . . . . 72.420000000000002 110.897 -179.918 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 112' ' ' GLU . . . . . 0.422 ' CB ' ' O ' ' A' ' 111' ' ' GLN . 0.2 OUTLIER 78.07 135.73 0.06 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.207 -0.451 . . . . 62.399999999999999 110.87 -179.989 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 113' ' ' ILE . . . . . 0.735 HD11 ' HG3' ' A' ' 79' ' ' PRO . 31.9 pt -133.46 -0.31 1.43 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.183 -0.462 . . . . 73.109999999999999 111.136 179.968 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 114' ' ' ILE . . . . . 0.831 ' O ' HG23 ' A' ' 118' ' ' THR . 25.6 mm -63.34 -45.43 98.15 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.2 -0.454 . . . . 60.340000000000003 111.132 179.876 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 115' ' ' PHE . . . . . 0.811 ' CE1' HD13 ' A' ' 25' ' ' ILE . 26.6 t80 -72.65 -34.63 67.4 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.188 -0.46 . . . . 75.409999999999997 110.874 179.93 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 4.3 mm-40 -67.8 -47.63 68.57 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.144 -0.48 . . . . 62.229999999999997 110.893 -179.928 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 117' ' ' ILE . . . . . 0.651 HD11 ' CD2' ' A' ' 101' ' ' PHE . 0.9 OUTLIER -63.47 -40.61 89.69 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.14 -0.482 . . . . 73.530000000000001 111.103 179.976 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 118' ' ' THR . . . . . 0.831 HG23 ' O ' ' A' ' 114' ' ' ILE . 64.5 p -68.07 -42.77 79.91 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.169 -0.469 . . . . 53.409999999999997 111.108 -179.955 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 67.6 m -67.89 -44.25 77.43 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.225 -0.443 . . . . 71.329999999999998 110.853 -179.843 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 120' ' ' PHE . . . . . 0.621 ' CD2' HD11 ' A' ' 104' ' ' ILE . 0.2 OUTLIER -60.74 -50.27 74.15 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.139 -0.482 . . . . 74.329999999999998 110.888 -179.959 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 121' ' ' THR . . . . . 0.978 HG22 HD22 ' A' ' 97' ' ' LEU . 81.4 p -65.54 -40.71 93.22 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.171 -0.468 . . . . 65.230000000000004 111.146 -179.95 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 8.4 tm0? -64.23 -38.85 92.52 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.191 -0.459 . . . . 71.329999999999998 110.911 -179.985 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 4.4 pt-20 -77.5 -40.48 42.69 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.216 -0.447 . . . . 72.150000000000006 110.916 -179.976 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 124' ' ' LYS . . . . . 0.472 ' CE ' ' HA ' ' A' ' 124' ' ' LYS . 0.0 OUTLIER -68.57 -41.06 80.27 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.128 -0.487 . . . . 74.120000000000005 110.815 -179.982 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 125' ' ' LEU . . . . . 0.57 HD23 ' O ' ' A' ' 125' ' ' LEU . 0.5 OUTLIER -68.39 -38.26 81.15 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.253 -0.43 . . . . 74.209999999999994 110.926 179.945 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 126' ' ' ASP . . . . . 0.433 ' C ' ' OD1' ' A' ' 126' ' ' ASP . 1.2 t0 -61.78 -45.59 93.22 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.202 -0.454 . . . . 54.329999999999998 110.886 179.817 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 127' ' ' GLU . . . . . 0.447 ' HG3' ' N ' ' A' ' 128' ' ' PHE . 7.4 pt-20 -69.68 -31.17 69.06 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.202 -0.454 . . . . 72.450000000000003 110.899 -179.892 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 128' ' ' PHE . . . . . 0.478 ' CD2' ' CD ' ' A' ' 93' ' ' GLN . 0.3 OUTLIER . . . . . 0 C--N 1.329 -0.302 0 CA-C-N 116.138 -0.483 . . . . 74.420000000000002 110.836 -179.886 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 76.0 mt . . . . . 0 C--O 1.231 0.119 0 CA-C-O 120.813 0.339 . . . . 74.420000000000002 110.955 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -51.62 -34.64 38.43 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.169 -0.469 . . . . 70.310000000000002 110.828 179.883 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . 0.408 ' O ' HD12 ' A' ' 14' ' ' ILE . 16.1 mm-40 -67.95 -35.11 77.83 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.212 -0.449 . . . . 74.349999999999994 110.883 -179.863 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 11' ' ' TYR . . . . . 0.441 ' CD1' ' HD2' ' A' ' 75' ' ' PRO . 15.1 m-85 -65.77 -25.06 67.09 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.2 -0.455 . . . . 64.150000000000006 110.916 -179.852 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -64.59 -37.85 88.99 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.105 -0.498 . . . . 72.329999999999998 110.911 -179.884 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 2.5 mm-40 -61.56 -44.15 97.56 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.144 -0.48 . . . . 73.120000000000005 110.885 179.985 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' ILE . . . . . 0.545 ' H ' HD12 ' A' ' 14' ' ' ILE . 5.2 mp -68.03 -40.12 82.63 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.125 -0.489 . . . . 71.129999999999995 111.135 179.971 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . 0.419 ' HB3' HG21 ' A' ' 46' ' ' ILE . 59.1 mt-30 -65.22 -46.33 81.09 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.159 -0.473 . . . . 60.340000000000003 110.881 179.946 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 7.0 t -63.19 -36.56 84.05 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.254 -0.43 . . . . 73.439999999999998 110.881 -179.946 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' ASN . . . . . 0.432 ' OD1' ' N ' ' A' ' 18' ' ' GLU . 0.2 OUTLIER -58.36 -33.72 69.89 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.154 -0.476 . . . . 73.239999999999995 110.889 -179.907 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . 0.432 ' N ' ' OD1' ' A' ' 17' ' ' ASN . 1.3 mp0 -66.33 -37.78 86.15 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.18 -0.464 . . . . 61.109999999999999 110.886 -179.985 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.459 ' CD2' HG13 ' A' ' 46' ' ' ILE . 8.8 mp -64.44 -51.51 62.75 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.18 -0.464 . . . . 75.049999999999997 110.908 -179.976 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 1.4 pt-20 -68.5 -35.86 78.1 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.202 -0.454 . . . . 73.430000000000007 110.933 179.918 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -66.66 -47.1 73.59 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.124 -0.489 . . . . 74.540000000000006 111.068 179.944 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . 0.621 ' HA ' HD12 ' A' ' 25' ' ' ILE . 0.7 OUTLIER -76.21 -34.27 25.66 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-N 116.261 -0.427 . . . . 52.32 111.167 179.955 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -52.32 -34.18 45.84 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.144 -0.48 . . . . 73.120000000000005 110.87 179.973 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -66.37 -32.15 73.36 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.219 -0.446 . . . . 70.430000000000007 110.879 -179.823 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . 0.854 HD13 ' CE1' ' A' ' 115' ' ' PHE . 3.3 mt -84.77 -43.84 17.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.118 -0.492 . . . . 62.329999999999998 111.121 179.95 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 19.5 m-85 -107.5 45.36 1.0 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.176 -0.465 . . . . 73.450000000000003 110.903 -179.95 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 4.1 mtm -46.26 -47.82 18.07 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.132 -0.485 . . . . 73.540000000000006 110.869 179.887 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 7.1 m-20 -98.74 -27.2 14.07 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.219 -0.446 . . . . 64.450000000000003 110.859 179.952 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 84.6 m-20 -86.11 34.4 0.62 Allowed 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.214 -0.448 . . . . 73.420000000000002 110.862 -179.995 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' PHE . . . . . 0.612 ' C ' ' CD1' ' A' ' 30' ' ' PHE . 0.1 OUTLIER -117.46 144.12 45.35 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.176 -0.465 . . . . 71.310000000000002 110.923 -179.935 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 24.4 m -127.08 135.07 50.25 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.141 -0.481 . . . . 55.439999999999998 111.18 -179.926 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -97.82 114.81 26.94 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.227 -0.442 . . . . 70.140000000000001 110.83 179.948 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.941 HD23 ' N ' ' A' ' 34' ' ' THR . 0.1 OUTLIER -121.81 -9.65 8.8 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.216 -0.447 . . . . 74.430000000000007 110.95 -179.979 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . 0.941 ' N ' HD23 ' A' ' 33' ' ' LEU . 0.2 OUTLIER . . . . . 0 C--N 1.33 -0.262 0 CA-C-N 116.174 -0.466 . . . . 75.200000000000003 111.163 179.933 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 45' ' ' GLN . . . . . 0.879 ' HG2' HG23 ' A' ' 47' ' ' ILE . 15.1 pt20 . . . . . 0 C--O 1.231 0.11 0 CA-C-O 120.79 0.328 . . . . 74.049999999999997 110.929 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 46' ' ' ILE . . . . . 0.643 HG22 ' O ' ' A' ' 45' ' ' GLN . 0.2 OUTLIER 87.16 -21.88 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.174 -0.466 . . . . 54.399999999999999 111.142 -180.0 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . 0.879 HG23 ' HG2' ' A' ' 45' ' ' GLN . 0.2 OUTLIER -36.5 144.54 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.205 -0.452 . . . . 65.329999999999998 111.171 179.849 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 48' ' ' PHE . . . . . 0.759 ' HA ' HD22 ' A' ' 33' ' ' LEU . 0.9 OUTLIER -161.59 158.37 26.15 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.183 -0.462 . . . . 74.239999999999995 110.896 -179.994 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . 0.914 ' CG ' HD13 ' A' ' 33' ' ' LEU . 20.4 mt-10 -108.76 160.99 15.52 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.137 -0.483 . . . . 72.530000000000001 110.866 -179.922 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . 0.547 HD13 ' HA ' ' A' ' 30' ' ' PHE . 15.4 mm -141.66 135.55 30.44 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.151 -0.477 . . . . 64.420000000000002 111.131 179.975 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 90.2 m -83.73 137.08 33.92 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.136 -0.484 . . . . 72.519999999999996 111.195 179.946 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . 0.45 HD12 HD12 ' A' ' 66' ' ' LEU . 14.2 mt -136.69 160.23 39.46 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.216 -0.447 . . . . 74.230000000000004 110.92 179.943 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 7.4 ptt85 -176.14 161.6 2.38 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.18 -0.464 . . . . 72.120000000000005 110.829 179.965 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -53.63 -176.68 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.154 -0.475 . . . . 75.019999999999996 110.886 -179.823 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 15.9 m -94.41 -25.69 4.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.169 -0.469 . . . . 72.430000000000007 111.084 179.984 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -124.47 -165.99 1.45 Allowed 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.179 -0.464 . . . . 74.310000000000002 110.881 179.92 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -114.76 -14.58 11.97 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.191 -0.458 . . . . 62.25 110.854 -179.954 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . 0.554 ' HA ' ' C ' ' A' ' 59' ' ' PRO . 7.5 pt-20 -119.49 143.22 34.15 Favored Pre-proline 0 C--N 1.329 -0.294 0 CA-C-O 121.644 0.735 . . . . 44.229999999999997 110.859 -179.995 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 59' ' ' PRO . . . . . 0.554 ' C ' ' HA ' ' A' ' 58' ' ' GLU . 54.3 Cg_endo -69.81 -9.2 10.99 Favored 'Cis proline' 0 C--O 1.232 0.188 0 C-N-CA 122.632 -1.82 . . . . 71.439999999999998 112.364 0.025 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 60' ' ' VAL . . . . . 0.459 ' HB ' ' CG ' ' A' ' 88' ' ' ASN . 12.0 m -153.89 176.54 0.48 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.242 -0.436 . . . . 42.329999999999998 111.164 179.903 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . 0.461 ' O ' ' C ' ' A' ' 62' ' ' SER . 6.0 tt0 -107.93 -18.0 13.91 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.203 -0.453 . . . . 72.519999999999996 110.917 179.963 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 62' ' ' SER . . . . . 0.721 ' HB3' HD11 ' A' ' 125' ' ' LEU . 0.1 OUTLIER 33.7 90.05 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.191 -0.459 . . . . 73.519999999999996 110.845 -179.846 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -103.66 122.85 45.87 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.151 -0.477 . . . . 74.209999999999994 110.866 -179.801 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 64' ' ' ILE . . . . . 0.775 HD13 HD11 ' A' ' 94' ' ' LEU . 12.5 mt -141.37 150.42 19.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.156 -0.475 . . . . 71.219999999999999 111.113 179.972 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 84.0 m -118.96 117.34 28.55 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.153 -0.476 . . . . 64.340000000000003 111.135 179.972 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . 0.802 HD11 HG21 ' A' ' 121' ' ' THR . 11.4 mt -95.04 111.9 23.66 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.217 -0.447 . . . . 73.530000000000001 110.912 179.979 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 67' ' ' HIS . . . . . 0.552 ' CE1' HD11 ' A' ' 33' ' ' LEU . 0.9 OUTLIER -102.11 111.88 24.33 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.152 -0.476 . . . . 61.219999999999999 110.843 179.855 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 68' ' ' PHE . . . . . 0.536 ' CE1' HG23 ' A' ' 114' ' ' ILE . 0.0 OUTLIER -103.83 139.95 38.33 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.195 -0.457 . . . . 72.040000000000006 110.889 -179.959 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -119.67 118.4 30.83 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.123 -0.49 . . . . 63.229999999999997 111.096 179.897 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 70' ' ' MET . . . . . 0.445 ' CE ' HD11 ' A' ' 114' ' ' ILE . 2.3 mmt -84.08 99.13 10.27 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.238 -0.437 . . . . 70.209999999999994 110.883 179.942 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -53.25 159.86 1.94 Allowed Pre-proline 0 C--N 1.33 -0.275 0 CA-C-O 121.553 0.692 . . . . 71.040000000000006 111.14 -179.912 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.73 -2.22 9.79 Favored 'Trans proline' 0 C--N 1.341 0.167 0 C-N-CA 122.69 2.26 . . . . 71.219999999999999 112.376 179.887 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 73' ' ' MET . . . . . 0.496 ' O ' ' CB ' ' A' ' 76' ' ' TYR . 0.1 OUTLIER -115.83 -23.33 8.67 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.234 -0.439 . . . . 73.439999999999998 110.914 179.902 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 74' ' ' TYR . . . . . 0.665 ' CD1' ' C ' ' A' ' 74' ' ' TYR . 0.0 OUTLIER -48.49 151.53 1.93 Allowed Pre-proline 0 C--N 1.328 -0.353 0 CA-C-O 121.69 0.757 . . . . 73.129999999999995 110.924 -179.907 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 75' ' ' PRO . . . . . 0.544 ' HA ' ' CD2' ' A' ' 74' ' ' TYR . 53.7 Cg_endo -69.73 -9.99 11.23 Favored 'Cis proline' 0 C--N 1.341 0.184 0 C-N-CA 122.633 -1.819 . . . . 75.510000000000005 112.386 -0.109 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 76' ' ' TYR . . . . . 0.496 ' CB ' ' O ' ' A' ' 73' ' ' MET . 16.3 t80 -34.41 -52.3 0.48 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.172 -0.467 . . . . 70.420000000000002 110.916 -179.911 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 62.1 p -101.41 -171.56 2.01 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.094 -0.503 . . . . 71.439999999999998 111.158 -179.956 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -108.65 131.31 21.85 Favored Pre-proline 0 C--N 1.328 -0.335 0 CA-C-O 121.57 0.7 . . . . 70.439999999999998 111.142 179.842 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 79' ' ' PRO . . . . . 0.685 ' HG3' HD11 ' A' ' 113' ' ' ILE . 53.5 Cg_endo -69.82 -170.14 0.38 Allowed 'Trans proline' 0 C--N 1.342 0.192 0 C-N-CA 122.688 2.259 . . . . 71.129999999999995 112.344 -179.964 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . 0.428 ' O ' HD13 ' A' ' 81' ' ' ILE . 0.3 OUTLIER -127.37 127.36 44.08 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.242 -0.436 . . . . 60.200000000000003 110.854 -179.963 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 81' ' ' ILE . . . . . 0.722 ' CG2' HD22 ' A' ' 66' ' ' LEU . 10.2 mm -120.4 139.13 48.65 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.156 -0.475 . . . . 73.219999999999999 111.102 179.956 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . 0.487 ' HG3' ' CD ' ' A' ' 84' ' ' LYS . 7.2 pt-20 -148.34 144.04 27.28 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.144 -0.48 . . . . 63.43 110.866 179.948 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 83' ' ' PHE . . . . . 0.57 ' CG ' HD12 ' A' ' 94' ' ' LEU . 22.5 m-85 -93.76 141.14 28.84 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.132 -0.486 . . . . 74.349999999999994 110.895 -179.963 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 84' ' ' LYS . . . . . 0.487 ' CD ' ' HG3' ' A' ' 82' ' ' GLU . 9.6 mmmt -124.89 171.05 10.49 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.124 -0.489 . . . . 65.25 110.903 179.968 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 85' ' ' ASN . . . . . 0.413 ' O ' ' CG2' ' A' ' 86' ' ' VAL . 1.9 m-80 62.81 -74.22 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.216 -0.447 . . . . 72.0 110.918 179.977 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 86' ' ' VAL . . . . . 0.465 ' N ' ' O ' ' A' ' 84' ' ' LYS . 3.2 m 41.5 92.08 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.144 -0.48 . . . . 73.239999999999995 111.144 179.901 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -102.54 -69.59 0.78 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.21 -0.45 . . . . 73.0 110.868 -179.945 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 88' ' ' ASN . . . . . 0.459 ' CG ' ' HB ' ' A' ' 60' ' ' VAL . 14.6 m-80 -83.31 53.11 2.38 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.191 -0.459 . . . . 73.329999999999998 110.851 -179.909 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 89' ' ' VAL . . . . . 0.687 HG21 HD22 ' A' ' 94' ' ' LEU . 2.1 p -165.27 133.85 0.63 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.173 -0.467 . . . . 75.129999999999995 111.1 179.904 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 90' ' ' MET . . . . . . . . . . . . . 1.4 mtm -78.36 -70.43 0.49 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.123 -0.49 . . . . 62.210000000000001 110.885 179.888 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 91' ' ' ASP . . . . . 0.5 ' HA ' HD23 ' A' ' 94' ' ' LEU . 5.1 p-10 -176.34 -30.95 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.195 -0.457 . . . . 55.409999999999997 110.857 179.981 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -53.65 -37.65 63.32 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.185 -0.461 . . . . 70.319999999999993 110.906 -179.792 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 93' ' ' GLN . . . . . 0.534 ' HG2' ' CZ ' ' A' ' 128' ' ' PHE . 1.4 mp0 -71.03 -38.37 72.58 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.108 -0.496 . . . . 73.200000000000003 110.917 -179.945 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . 0.775 HD11 HD13 ' A' ' 64' ' ' ILE . 1.1 mm? -64.78 -47.21 78.95 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.166 -0.47 . . . . 72.230000000000004 110.907 -179.964 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 44.6 mt-30 -65.17 -34.0 77.35 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.16 -0.473 . . . . 72.340000000000003 110.905 179.952 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 96' ' ' MET . . . . . . . . . . . . . 32.0 ttp -59.85 -37.88 80.52 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.184 -0.462 . . . . 73.209999999999994 110.913 179.951 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 97' ' ' LEU . . . . . 0.477 ' O ' ' CD1' ' A' ' 101' ' ' PHE . 17.1 mt -71.97 -38.9 69.66 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.188 -0.46 . . . . 70.239999999999995 110.902 179.961 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 98' ' ' LYS . . . . . 0.449 ' HZ1' ' HA ' ' A' ' 82' ' ' GLU . 7.0 mmtt -54.64 -37.11 65.28 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.206 -0.452 . . . . 62.539999999999999 110.903 179.847 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -64.45 -38.69 91.9 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.217 -0.447 . . . . 73.329999999999998 110.864 -179.861 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 100' ' ' GLU . . . . . 0.498 ' O ' HD12 ' A' ' 104' ' ' ILE . 1.4 mp0 -72.94 -24.1 60.77 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.145 -0.48 . . . . 70.549999999999997 110.905 179.995 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 101' ' ' PHE . . . . . 0.477 ' CD1' ' O ' ' A' ' 97' ' ' LEU . 8.9 m-30 -59.75 -35.19 74.1 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.117 -0.492 . . . . 74.099999999999994 110.935 -179.951 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.51 -38.29 84.07 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.143 -0.48 . . . . 53.530000000000001 110.881 179.959 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 21.8 mtmt -70.04 -43.19 71.76 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.264 -0.426 . . . . 73.109999999999999 110.927 179.846 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 104' ' ' ILE . . . . . 0.498 HD12 ' O ' ' A' ' 100' ' ' GLU . 3.0 mt -62.16 -47.45 93.06 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.185 -0.461 . . . . 71.319999999999993 111.102 179.901 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 105' ' ' HIS . . . . . 0.465 ' O ' ' N ' ' A' ' 109' ' ' ARG . 1.8 t60 -62.87 -41.09 99.26 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.163 -0.471 . . . . 75.140000000000001 110.832 179.932 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 1.3 m-80 -58.14 -39.25 78.3 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.246 -0.434 . . . . 63.520000000000003 110.834 -179.901 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 9.4 t -90.12 -13.18 36.28 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.195 -0.457 . . . . 75.099999999999994 111.091 -179.921 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 108' ' ' SER . . . . . 0.578 ' HB3' HG22 ' A' ' 113' ' ' ILE . 58.8 m -116.78 17.5 15.12 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.241 -0.436 . . . . 72.019999999999996 110.863 -179.845 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 109' ' ' ARG . . . . . 0.465 ' N ' ' O ' ' A' ' 105' ' ' HIS . 21.4 ttp180 -67.17 76.16 0.14 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.098 -0.501 . . . . 71.010000000000005 110.884 -179.98 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 149.05 -21.63 1.25 Allowed Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.77 -0.728 . . . . 72.310000000000002 112.505 -179.954 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 111' ' ' GLN . . . . . . . . . . . . . 10.6 pt20 -116.84 -165.48 1.07 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.765 0.317 . . . . 72.109999999999999 110.894 -179.891 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 23.4 mt-10 -67.05 134.29 51.6 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.189 -0.46 . . . . 63.020000000000003 110.871 -179.943 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 113' ' ' ILE . . . . . 0.685 HD11 ' HG3' ' A' ' 79' ' ' PRO . 22.4 pt -124.5 -14.66 5.07 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 116.131 -0.486 . . . . 75.109999999999999 111.117 179.984 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 114' ' ' ILE . . . . . 0.716 ' O ' HG23 ' A' ' 118' ' ' THR . 14.5 mm -63.03 -43.83 99.26 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.157 -0.474 . . . . 74.329999999999998 111.15 179.81 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 115' ' ' PHE . . . . . 0.854 ' CE1' HD13 ' A' ' 25' ' ' ILE . 16.2 t80 -72.52 -35.97 68.21 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.145 -0.48 . . . . 72.349999999999994 110.91 179.944 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 5.2 mm-40 -66.02 -46.77 76.69 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.189 -0.459 . . . . 62.539999999999999 110.922 -179.954 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 117' ' ' ILE . . . . . 0.49 ' CG2' ' N ' ' A' ' 118' ' ' THR . 0.7 OUTLIER -64.37 -43.06 97.03 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.159 -0.473 . . . . 74.510000000000005 111.137 179.93 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 118' ' ' THR . . . . . 0.716 HG23 ' O ' ' A' ' 114' ' ' ILE . 72.7 p -67.83 -43.03 80.49 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.192 -0.458 . . . . 52.219999999999999 111.127 179.972 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 4.0 m -63.86 -44.48 92.99 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.245 -0.434 . . . . 61.219999999999999 110.843 -179.835 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 120' ' ' PHE . . . . . 0.405 ' O ' ' HG2' ' A' ' 123' ' ' GLU . 0.2 OUTLIER -65.41 -48.74 71.77 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.176 -0.465 . . . . 74.430000000000007 110.906 -179.984 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 121' ' ' THR . . . . . 0.802 HG21 HD11 ' A' ' 66' ' ' LEU . 25.3 p -63.7 -38.62 91.8 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.154 -0.475 . . . . 72.519999999999996 111.137 -179.912 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 27.7 tt0 -63.23 -41.44 99.11 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.202 -0.453 . . . . 64.439999999999998 110.903 -179.963 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 123' ' ' GLU . . . . . 0.497 ' O ' ' CG ' ' A' ' 127' ' ' GLU . 4.2 pt-20 -75.95 -35.61 59.64 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.245 -0.434 . . . . 74.349999999999994 110.861 -179.946 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 124' ' ' LYS . . . . . 0.491 ' HA ' ' CG ' ' A' ' 127' ' ' GLU . 0.0 OUTLIER -68.61 -35.22 77.03 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.14 -0.482 . . . . 74.420000000000002 110.901 179.966 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 125' ' ' LEU . . . . . 0.811 HD23 ' O ' ' A' ' 125' ' ' LEU . 4.0 tt -72.93 -43.67 62.1 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.274 -0.421 . . . . 73.430000000000007 110.925 179.912 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 4.5 t70 -65.7 -46.93 77.14 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.219 -0.446 . . . . 75.109999999999999 110.836 179.843 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 127' ' ' GLU . . . . . 0.497 ' CG ' ' O ' ' A' ' 123' ' ' GLU . 0.0 OUTLIER -59.52 -50.35 74.23 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.248 -0.433 . . . . 72.040000000000006 110.868 -179.908 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 128' ' ' PHE . . . . . 0.667 ' C ' ' CD1' ' A' ' 128' ' ' PHE . 0.0 OUTLIER . . . . . 0 C--N 1.329 -0.284 0 CA-C-N 116.161 -0.472 . . . . 74.450000000000003 110.865 -179.906 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . 0.614 HD13 ' O ' ' A' ' 72' ' ' PRO . 17.4 mt . . . . . 0 C--O 1.231 0.112 0 CA-C-O 120.838 0.351 . . . . 72.209999999999994 110.948 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . 0.411 ' OD1' ' N ' ' A' ' 9' ' ' ASP . 1.2 m-20 -53.38 -32.58 50.03 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.179 -0.464 . . . . 64.319999999999993 110.852 179.863 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 33.0 mm-40 -66.99 -38.93 86.93 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.205 -0.452 . . . . 73.329999999999998 110.922 -179.969 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 11' ' ' TYR . . . . . 0.53 ' CD1' ' HD2' ' A' ' 75' ' ' PRO . 18.9 m-85 -61.65 -25.08 67.15 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.187 -0.46 . . . . 64.140000000000001 110.92 -179.89 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -59.05 -41.69 88.47 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.164 -0.471 . . . . 74.319999999999993 110.962 -179.917 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 1.5 mm-40 -62.43 -45.23 94.04 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.085 -0.507 . . . . 74.430000000000007 110.897 179.952 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' ILE . . . . . 0.402 HD12 ' H ' ' A' ' 14' ' ' ILE . 4.4 mp -67.21 -39.89 83.95 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.146 -0.479 . . . . 50.509999999999998 111.148 -179.999 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . 0.521 ' O ' HD13 ' A' ' 19' ' ' LEU . 55.9 mt-30 -62.62 -49.43 75.24 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.171 -0.468 . . . . 64.209999999999994 110.889 179.913 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -63.45 -40.67 97.75 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.206 -0.452 . . . . 74.120000000000005 110.878 -179.924 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' ASN . . . . . 0.419 ' O ' ' HG3' ' A' ' 20' ' ' GLU . 0.8 OUTLIER -57.71 -33.28 68.23 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.197 -0.456 . . . . 34.409999999999997 110.916 -179.91 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . 0.527 ' OE1' ' HE1' ' A' ' 70' ' ' MET . 1.4 tt0 -68.42 -37.82 80.65 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.143 -0.481 . . . . 72.409999999999997 110.895 -179.992 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.521 HD13 ' O ' ' A' ' 15' ' ' GLN . 10.9 mp -56.65 -52.26 65.56 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.189 -0.459 . . . . 63.130000000000003 110.926 -179.98 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . 0.419 ' HG3' ' O ' ' A' ' 17' ' ' ASN . 3.6 pt-20 -68.92 -31.97 71.25 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.204 -0.453 . . . . 73.209999999999994 110.901 179.952 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -63.59 -48.66 76.45 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.15 -0.477 . . . . 71.409999999999997 111.086 179.898 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . 0.721 HD11 ' HB2' ' A' ' 115' ' ' PHE . 0.5 OUTLIER -77.22 -34.29 21.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.161 -0.472 . . . . 61.409999999999997 111.122 -179.995 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 42.5 mtt180 -52.52 -35.44 53.22 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.208 -0.451 . . . . 72.030000000000001 110.874 179.971 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 24.8 p -62.66 -31.19 72.02 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.199 -0.455 . . . . 73.430000000000007 110.9 -179.8 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . 0.75 HD13 ' CE1' ' A' ' 115' ' ' PHE . 3.9 mt -84.76 -45.44 17.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.08 -0.509 . . . . 75.340000000000003 111.154 179.952 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 24.2 m-85 -105.82 44.63 1.03 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.142 -0.481 . . . . 74.409999999999997 110.948 179.991 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 2.2 mtm -43.53 -52.38 6.21 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.104 -0.498 . . . . 62.399999999999999 110.853 179.918 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 -93.68 -27.32 16.62 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.224 -0.443 . . . . 74.310000000000002 110.889 179.93 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 10.5 m-20 -87.62 27.66 1.09 Allowed 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.177 -0.465 . . . . 64.439999999999998 110.884 -179.982 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' PHE . . . . . 0.539 ' HA ' HD13 ' A' ' 50' ' ' ILE . 5.4 t80 -106.21 138.7 41.93 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.161 -0.472 . . . . 75.150000000000006 110.888 -179.904 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 55.3 m -122.91 133.07 54.42 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.128 -0.487 . . . . 53.039999999999999 111.132 -179.909 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 2.8 t70 -105.04 114.9 29.37 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.21 -0.45 . . . . 75.319999999999993 110.875 179.911 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.754 HD21 ' CE1' ' A' ' 67' ' ' HIS . 0.2 OUTLIER -115.51 -7.15 12.25 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.147 -0.479 . . . . 63.299999999999997 110.935 -179.953 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . 0.686 ' N ' HD12 ' A' ' 33' ' ' LEU . 0.2 OUTLIER . . . . . 0 C--N 1.329 -0.303 0 CA-C-N 116.231 -0.44 . . . . 64.439999999999998 111.164 179.933 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 45' ' ' GLN . . . . . 0.964 ' HG2' HG23 ' A' ' 47' ' ' ILE . 0.0 OUTLIER . . . . . 0 C--O 1.232 0.15 0 CA-C-O 120.716 0.294 . . . . 65.040000000000006 110.881 . . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 46' ' ' ILE . . . . . 0.68 HG22 ' O ' ' A' ' 45' ' ' GLN . 0.1 OUTLIER 86.87 -21.09 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.217 -0.447 . . . . 75.129999999999995 111.121 179.988 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . 0.964 HG23 ' HG2' ' A' ' 45' ' ' GLN . 0.1 OUTLIER -34.99 152.5 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 116.22 -0.445 . . . . 41.340000000000003 111.137 179.841 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 48' ' ' PHE . . . . . 0.713 ' HZ ' HG21 ' A' ' 114' ' ' ILE . 1.7 p90 -161.68 168.21 23.76 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.174 -0.466 . . . . 73.510000000000005 110.876 179.965 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . 0.457 ' CG ' ' HB2' ' A' ' 67' ' ' HIS . 7.6 mt-10 -121.19 160.98 22.68 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.114 -0.494 . . . . 61.109999999999999 110.809 -179.892 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . 0.539 HD13 ' HA ' ' A' ' 30' ' ' PHE . 11.5 mm -139.2 134.83 41.3 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.144 -0.48 . . . . 65.239999999999995 111.14 179.951 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 93.6 m -88.53 118.33 28.11 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.146 -0.479 . . . . 34.299999999999997 111.14 179.997 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . 0.927 HD12 HD12 ' A' ' 66' ' ' LEU . 21.2 mt -119.63 165.3 14.64 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.202 -0.453 . . . . 70.239999999999995 110.916 179.958 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -175.96 166.53 3.02 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.182 -0.463 . . . . 75.049999999999997 110.828 179.985 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -59.3 177.25 0.19 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.177 -0.465 . . . . 64.420000000000002 110.859 -179.801 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 16.2 m -90.89 -26.37 5.18 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.147 -0.479 . . . . 71.239999999999995 111.096 179.959 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -115.31 -169.79 1.64 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.205 -0.452 . . . . 71.439999999999998 110.894 179.924 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -116.27 -23.58 8.33 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.2 -0.455 . . . . 72.310000000000002 110.903 -179.996 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . 0.551 ' HA ' ' C ' ' A' ' 59' ' ' PRO . 7.9 pt-20 -114.51 146.32 35.67 Favored Pre-proline 0 C--N 1.329 -0.289 0 CA-C-O 121.574 0.702 . . . . 71.400000000000006 110.939 179.933 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 59' ' ' PRO . . . . . 0.551 ' C ' ' HA ' ' A' ' 58' ' ' GLU . 54.0 Cg_endo -69.75 -12.54 12.21 Favored 'Cis proline' 0 C--O 1.232 0.194 0 C-N-CA 122.69 -1.796 . . . . 64.319999999999993 112.334 -0.025 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 60' ' ' VAL . . . . . 0.427 ' HB ' ' CG ' ' A' ' 88' ' ' ASN . 12.2 m -147.44 167.61 5.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.25 -0.432 . . . . 63.399999999999999 111.138 179.902 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 5.9 tt0 -94.26 -22.64 18.26 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.138 -0.483 . . . . 73.040000000000006 110.873 -179.967 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 62' ' ' SER . . . . . 0.626 ' CB ' HD21 ' A' ' 125' ' ' LEU . 1.7 m 42.68 94.66 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.166 -0.47 . . . . 70.329999999999998 110.834 -179.819 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 25.5 t -118.97 123.1 43.75 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.141 -0.481 . . . . 75.530000000000001 110.878 -179.85 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 64' ' ' ILE . . . . . 0.728 HD11 HG21 ' A' ' 89' ' ' VAL . 52.9 mt -138.08 147.14 26.05 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.092 -0.503 . . . . 44.329999999999998 111.126 179.956 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 29.0 m -111.62 113.79 26.42 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.189 -0.46 . . . . 74.430000000000007 111.124 179.987 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . 1.017 HD21 ' CE1' ' A' ' 83' ' ' PHE . 15.9 mt -91.97 109.95 21.3 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.247 -0.433 . . . . 33.329999999999998 110.927 179.928 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 67' ' ' HIS . . . . . 0.754 ' CE1' HD21 ' A' ' 33' ' ' LEU . 1.2 t60 -95.64 109.89 22.08 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.19 -0.459 . . . . 75.219999999999999 110.839 179.884 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 68' ' ' PHE . . . . . 0.498 ' HA ' HD13 ' A' ' 81' ' ' ILE . 0.0 OUTLIER -104.02 139.93 38.45 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.219 -0.446 . . . . 53.299999999999997 110.874 -179.917 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 69' ' ' ALA . . . . . 0.563 ' HA ' HG22 ' A' ' 47' ' ' ILE . . . -124.44 120.07 30.99 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.165 -0.47 . . . . 34.130000000000003 111.087 179.93 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 70' ' ' MET . . . . . 0.527 ' HE1' ' OE1' ' A' ' 18' ' ' GLU . 9.2 mmt -79.63 95.51 5.93 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.199 -0.455 . . . . 75.319999999999993 110.864 179.98 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -49.78 160.16 0.65 Allowed Pre-proline 0 C--N 1.33 -0.263 0 CA-C-O 121.639 0.733 . . . . 74.349999999999994 111.135 -179.923 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 72' ' ' PRO . . . . . 0.614 ' O ' HD13 ' A' ' 8' ' ' LEU . 53.9 Cg_endo -69.78 3.1 2.98 Favored 'Trans proline' 0 C--N 1.342 0.189 0 C-N-CA 122.691 2.261 . . . . 61.329999999999998 112.349 179.963 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 73' ' ' MET . . . . . 0.694 ' HB3' HG23 ' A' ' 77' ' ' THR . 0.0 OUTLIER -120.36 -25.55 5.61 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.194 -0.457 . . . . 74.230000000000004 110.881 179.908 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 74' ' ' TYR . . . . . 0.653 ' CD1' ' C ' ' A' ' 74' ' ' TYR . 0.0 OUTLIER -50.52 150.75 4.51 Favored Pre-proline 0 C--N 1.328 -0.337 0 CA-C-O 121.648 0.737 . . . . 74.549999999999997 110.916 -179.854 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 75' ' ' PRO . . . . . 0.542 ' C ' ' HA ' ' A' ' 74' ' ' TYR . 53.7 Cg_endo -69.76 -14.12 12.45 Favored 'Cis proline' 0 C--N 1.341 0.183 0 C-N-CA 122.65 -1.813 . . . . 75.430000000000007 112.325 -0.089 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 76' ' ' TYR . . . . . 0.502 ' CB ' ' O ' ' A' ' 73' ' ' MET . 6.2 t80 -33.93 -52.64 0.44 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.236 -0.438 . . . . 74.010000000000005 110.883 -179.912 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 77' ' ' THR . . . . . 0.694 HG23 ' HB3' ' A' ' 73' ' ' MET . 39.0 p -105.86 -178.88 3.78 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.141 -0.481 . . . . 63.149999999999999 111.179 -179.989 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -98.62 129.36 30.32 Favored Pre-proline 0 C--N 1.329 -0.287 0 CA-C-O 121.595 0.712 . . . . 55.25 111.135 179.859 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 79' ' ' PRO . . . . . 0.778 ' HG3' HD11 ' A' ' 113' ' ' ILE . 53.9 Cg_endo -69.74 -170.89 0.42 Allowed 'Trans proline' 0 C--O 1.231 0.152 0 C-N-CA 122.717 2.278 . . . . 51.039999999999999 112.366 -179.992 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . 0.402 ' O ' HD13 ' A' ' 81' ' ' ILE . 2.1 tt0 -119.77 125.17 47.94 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.224 -0.443 . . . . 73.340000000000003 110.878 -179.982 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 81' ' ' ILE . . . . . 0.498 HD13 ' HA ' ' A' ' 68' ' ' PHE . 13.0 mm -121.37 142.38 37.83 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.107 -0.497 . . . . 71.329999999999998 111.109 -179.985 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . 0.485 ' HG3' ' CD ' ' A' ' 84' ' ' LYS . 11.8 pt-20 -148.61 147.2 28.7 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.162 -0.472 . . . . 64.140000000000001 110.886 179.903 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 83' ' ' PHE . . . . . 1.017 ' CE1' HD21 ' A' ' 66' ' ' LEU . 91.2 m-85 -95.79 139.97 31.25 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.12 -0.491 . . . . 73.109999999999999 110.893 -179.934 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 84' ' ' LYS . . . . . 0.485 ' CD ' ' HG3' ' A' ' 82' ' ' GLU . 6.0 mmmt -126.25 170.8 11.49 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.159 -0.473 . . . . 74.319999999999993 110.918 -179.998 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 85' ' ' ASN . . . . . 0.627 HD22 ' N ' ' A' ' 85' ' ' ASN . 0.8 OUTLIER 63.53 -73.35 0.05 OUTLIER 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.258 -0.428 . . . . 72.200000000000003 110.892 179.946 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 86' ' ' VAL . . . . . 0.503 HG11 HD11 ' A' ' 94' ' ' LEU . 4.2 m 36.12 91.0 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 116.162 -0.472 . . . . 63.520000000000003 111.182 179.952 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -94.93 -72.49 0.62 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.18 -0.464 . . . . 74.010000000000005 110.881 -179.94 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 88' ' ' ASN . . . . . 0.427 ' CG ' ' HB ' ' A' ' 60' ' ' VAL . 24.5 m120 -81.28 47.1 0.99 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.184 -0.462 . . . . 72.519999999999996 110.897 -179.954 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 89' ' ' VAL . . . . . 0.728 HG21 HD11 ' A' ' 64' ' ' ILE . 48.1 t -141.71 145.27 24.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.138 -0.483 . . . . 72.340000000000003 111.118 179.897 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 90' ' ' MET . . . . . . . . . . . . . 21.3 mtm -92.04 -71.11 0.66 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.15 -0.477 . . . . 73.549999999999997 110.871 179.941 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER 178.28 -37.21 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.249 -0.432 . . . . 73.519999999999996 110.901 179.951 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -55.97 -45.78 78.82 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.196 -0.456 . . . . 54.109999999999999 110.891 -179.805 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 93' ' ' GLN . . . . . 0.581 ' HG2' ' CD2' ' A' ' 128' ' ' PHE . 2.4 mp0 -61.19 -44.38 97.38 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.152 -0.476 . . . . 73.430000000000007 110.874 -179.969 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . 0.503 HD11 HG11 ' A' ' 86' ' ' VAL . 78.6 mt -59.08 -48.85 80.1 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.188 -0.46 . . . . 64.140000000000001 110.92 -179.974 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 2.2 mm-40 -65.1 -33.7 76.64 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.166 -0.47 . . . . 54.420000000000002 110.877 179.959 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 96' ' ' MET . . . . . . . . . . . . . 30.5 ttp -59.9 -38.64 82.86 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.212 -0.449 . . . . 75.109999999999999 110.852 179.997 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 97' ' ' LEU . . . . . 0.581 ' HB3' ' CZ ' ' A' ' 101' ' ' PHE . 24.9 mt -65.64 -41.09 93.02 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.199 -0.455 . . . . 75.409999999999997 110.922 -179.997 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 98' ' ' LYS . . . . . 0.515 ' HA ' ' CD2' ' A' ' 101' ' ' PHE . 13.2 mmtm -55.47 -43.62 75.67 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.17 -0.468 . . . . 73.510000000000005 110.867 179.871 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 4.2 t -57.28 -38.2 73.56 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.246 -0.433 . . . . 75.549999999999997 110.87 -179.936 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 6.8 mt-10 -74.69 -29.97 61.4 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.12 -0.491 . . . . 73.540000000000006 110.887 -179.965 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 101' ' ' PHE . . . . . 0.647 ' CZ ' HD11 ' A' ' 117' ' ' ILE . 14.0 m-30 -61.74 -27.77 68.95 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.164 -0.471 . . . . 74.519999999999996 110.896 -179.93 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -65.37 -44.92 86.1 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.106 -0.497 . . . . 75.430000000000007 110.927 179.953 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.53 -37.51 74.11 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.199 -0.455 . . . . 62.009999999999998 110.912 179.846 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 104' ' ' ILE . . . . . 0.569 HD11 ' CD2' ' A' ' 120' ' ' PHE . 5.0 mt -61.93 -47.54 92.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.257 -0.429 . . . . 71.319999999999993 111.104 179.886 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 105' ' ' HIS . . . . . . . . . . . . . 1.6 t60 -62.86 -42.15 99.64 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.19 -0.459 . . . . 74.299999999999997 110.844 179.886 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -56.94 -43.37 81.44 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.242 -0.435 . . . . 64.450000000000003 110.924 -179.945 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 6.9 t -77.84 -30.71 51.14 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.127 -0.488 . . . . 65.420000000000002 111.136 -179.986 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 21.0 m -102.96 24.23 11.04 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.229 -0.441 . . . . 60.020000000000003 110.835 -179.866 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 17.9 ttt180 -67.16 77.69 0.14 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.142 -0.481 . . . . 71.209999999999994 110.901 -179.993 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 110' ' ' GLY . . . . . 0.472 ' HA2' ' CG ' ' A' ' 75' ' ' PRO . . . 145.64 -18.46 1.83 Allowed Glycine 0 N--CA 1.452 -0.266 0 C-N-CA 120.71 -0.757 . . . . 44.32 112.477 -179.949 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 111' ' ' GLN . . . . . . . . . . . . . 10.0 pt20 -117.49 -165.1 1.05 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.735 0.302 . . . . 72.310000000000002 110.928 -179.88 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 53.3 mt-10 -69.08 135.6 51.02 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.215 -0.448 . . . . 74.549999999999997 110.88 -179.944 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 113' ' ' ILE . . . . . 0.778 HD11 ' HG3' ' A' ' 79' ' ' PRO . 28.0 pt -123.8 -16.32 4.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.122 -0.49 . . . . 65.230000000000004 111.125 179.993 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 114' ' ' ILE . . . . . 0.883 ' O ' HG23 ' A' ' 118' ' ' THR . 29.7 mm -61.19 -38.7 80.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.155 -0.475 . . . . 33.340000000000003 111.115 179.878 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 115' ' ' PHE . . . . . 0.75 ' CE1' HD13 ' A' ' 25' ' ' ILE . 43.0 t80 -72.82 -36.16 67.46 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.183 -0.462 . . . . 75.430000000000007 110.883 179.969 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 8.3 mm-40 -68.3 -46.66 69.72 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.14 -0.482 . . . . 73.409999999999997 110.897 -179.958 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 117' ' ' ILE . . . . . 0.647 HD11 ' CZ ' ' A' ' 101' ' ' PHE . 0.0 OUTLIER -65.79 -41.94 91.29 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 116.161 -0.472 . . . . 74.310000000000002 111.111 179.984 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 118' ' ' THR . . . . . 0.883 HG23 ' O ' ' A' ' 114' ' ' ILE . 57.4 p -68.8 -42.95 76.63 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.179 -0.464 . . . . 54.109999999999999 111.15 179.943 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 36.6 t -65.13 -44.34 89.0 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.198 -0.455 . . . . 74.420000000000002 110.87 -179.867 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 120' ' ' PHE . . . . . 0.569 ' CD2' HD11 ' A' ' 104' ' ' ILE . 0.7 OUTLIER -60.87 -48.08 83.45 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.161 -0.472 . . . . 73.129999999999995 110.878 -179.963 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 121' ' ' THR . . . . . 0.957 HG21 HD11 ' A' ' 66' ' ' LEU . 18.9 p -58.77 -38.98 79.68 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.13 -0.486 . . . . 72.120000000000005 111.182 -179.94 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 9.1 tt0 -61.46 -40.89 96.14 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.197 -0.456 . . . . 75.450000000000003 110.929 179.972 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 123' ' ' GLU . . . . . 0.453 ' HG2' ' N ' ' A' ' 124' ' ' LYS . 1.0 OUTLIER -75.46 -45.0 41.21 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.231 -0.441 . . . . 74.430000000000007 110.901 -179.965 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 124' ' ' LYS . . . . . 0.453 ' N ' ' HG2' ' A' ' 123' ' ' GLU . 8.4 mmmt -64.43 -37.83 88.91 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.167 -0.469 . . . . 71.530000000000001 110.907 179.957 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 125' ' ' LEU . . . . . 0.789 HD23 ' O ' ' A' ' 125' ' ' LEU . 3.6 tt -69.65 -44.59 70.23 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.18 -0.464 . . . . 73.409999999999997 110.919 179.909 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 126' ' ' ASP . . . . . 0.424 ' OD1' ' C ' ' A' ' 126' ' ' ASP . 0.0 OUTLIER -68.61 -39.89 80.65 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.183 -0.462 . . . . 73.519999999999996 110.833 179.858 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 127' ' ' GLU . . . . . 0.491 ' HG3' ' N ' ' A' ' 128' ' ' PHE . 3.2 pt-20 -65.62 -42.77 91.17 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.225 -0.443 . . . . 63.399999999999999 110.882 -179.889 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 128' ' ' PHE . . . . . 0.659 ' C ' ' CD1' ' A' ' 128' ' ' PHE . 0.0 OUTLIER . . . . . 0 C--N 1.329 -0.301 0 CA-C-N 116.165 -0.47 . . . . 74.299999999999997 110.911 -179.926 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . 0.71 HD13 ' O ' ' A' ' 72' ' ' PRO . 20.1 mt . . . . . 0 C--O 1.231 0.107 0 CA-C-O 120.816 0.341 . . . . 71.219999999999999 110.926 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -51.52 -31.67 24.87 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.211 -0.45 . . . . 74.129999999999995 110.85 179.856 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 3.9 mm-40 -67.85 -35.49 78.66 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.178 -0.464 . . . . 73.450000000000003 110.88 -179.87 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 11' ' ' TYR . . . . . 0.402 ' CD1' ' HD2' ' A' ' 75' ' ' PRO . 13.6 m-85 -67.61 -24.98 65.53 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.208 -0.451 . . . . 74.109999999999999 110.933 -179.893 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -59.26 -38.08 79.18 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.146 -0.479 . . . . 64.099999999999994 110.925 -179.917 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 2.7 mm-40 -58.86 -46.0 88.8 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.126 -0.488 . . . . 44.340000000000003 110.903 179.979 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 14' ' ' ILE . . . . . 0.541 HG22 ' OE1' ' A' ' 18' ' ' GLU . 4.2 mp -68.05 -46.64 81.27 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.179 -0.464 . . . . 74.230000000000004 111.115 179.961 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 84.5 mt-30 -57.21 -48.22 79.33 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.202 -0.453 . . . . 74.319999999999993 110.89 179.966 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -62.22 -42.27 99.15 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.263 -0.426 . . . . 74.049999999999997 110.886 -179.945 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 2.5 m-20 -58.1 -33.64 69.33 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.168 -0.469 . . . . 74.409999999999997 110.876 -179.879 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . 0.541 ' OE1' HG22 ' A' ' 14' ' ' ILE . 2.4 mp0 -65.44 -38.85 91.1 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.163 -0.471 . . . . 74.230000000000004 110.93 179.986 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 8.5 mp -63.7 -51.7 63.84 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.103 -0.499 . . . . 74.120000000000005 110.909 -179.972 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 1.9 pt-20 -68.9 -32.72 72.55 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.163 -0.472 . . . . 73.319999999999993 110.888 179.925 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -62.06 -50.56 71.51 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.175 -0.466 . . . . 75.540000000000006 111.07 179.95 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . 0.716 ' HA ' HD12 ' A' ' 25' ' ' ILE . 0.6 OUTLIER -77.23 -34.36 21.2 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 116.249 -0.432 . . . . 72.540000000000006 111.112 179.985 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 44.4 mtp180 -52.54 -35.02 52.6 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.187 -0.46 . . . . 53.420000000000002 110.89 179.973 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -66.98 -31.43 72.0 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.191 -0.459 . . . . 51.420000000000002 110.828 -179.812 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . 0.722 HG21 ' HE1' ' A' ' 115' ' ' PHE . 3.9 mt -82.89 -44.41 18.96 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.159 -0.473 . . . . 74.5 111.137 179.967 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 26.6 m-85 -106.6 41.16 1.49 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.193 -0.458 . . . . 73.340000000000003 110.964 -179.994 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER -40.4 -49.38 2.82 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.099 -0.501 . . . . 71.420000000000002 110.895 179.91 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -98.39 -9.02 25.88 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.196 -0.456 . . . . 43.420000000000002 110.872 179.981 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -104.67 32.65 3.98 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.218 -0.446 . . . . 72.239999999999995 110.819 -179.999 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 30' ' ' PHE . . . . . 0.627 ' HA ' HD13 ' A' ' 50' ' ' ILE . 1.7 t80 -116.55 138.39 51.45 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.234 -0.439 . . . . 73.109999999999999 110.89 -179.95 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 52.3 m -111.71 129.79 55.99 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.147 -0.479 . . . . 71.340000000000003 111.089 -179.857 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . 0.452 ' O ' ' CG ' ' A' ' 32' ' ' ASP . 0.0 OUTLIER -99.36 115.62 29.64 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.215 -0.448 . . . . 53.100000000000001 110.864 179.861 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.854 HD21 HG12 ' A' ' 47' ' ' ILE . 0.4 OUTLIER -123.48 -17.04 6.62 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.138 -0.483 . . . . 63.340000000000003 110.943 -179.976 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . 0.81 ' N ' HD23 ' A' ' 33' ' ' LEU . 1.2 m . . . . . 0 C--N 1.329 -0.295 0 CA-C-N 116.187 -0.46 . . . . 75.329999999999998 111.098 180.0 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 45' ' ' GLN . . . . . 0.559 ' O ' HG22 ' A' ' 46' ' ' ILE . 16.2 tt0 . . . . . 0 C--O 1.231 0.101 0 CA-C-O 120.778 0.323 . . . . 73.439999999999998 110.931 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 46' ' ' ILE . . . . . 0.559 HG22 ' O ' ' A' ' 45' ' ' GLN . 0.0 OUTLIER 82.02 -3.99 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.179 -0.464 . . . . 74.230000000000004 111.146 179.979 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . 0.854 HG12 HD21 ' A' ' 33' ' ' LEU . 0.2 OUTLIER -59.83 143.37 14.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.162 -0.472 . . . . 71.439999999999998 111.117 179.844 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 48' ' ' PHE . . . . . 0.767 ' HA ' HD22 ' A' ' 33' ' ' LEU . 4.2 p90 -155.54 154.73 32.19 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.218 -0.447 . . . . 73.510000000000005 110.884 179.955 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . 0.69 ' CG ' HD13 ' A' ' 33' ' ' LEU . 6.0 mt-10 -108.93 159.17 17.02 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.178 -0.465 . . . . 64.099999999999994 110.928 -179.971 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . 0.627 HD13 ' HA ' ' A' ' 30' ' ' PHE . 7.3 mm -133.95 140.6 46.0 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 116.174 -0.466 . . . . 71.430000000000007 111.179 179.962 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 88.9 m -85.21 118.58 24.84 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.208 -0.451 . . . . 73.109999999999999 111.153 179.99 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . 0.474 HD12 HD22 ' A' ' 66' ' ' LEU . 17.0 mt -123.3 163.23 21.13 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.286 -0.415 . . . . 74.120000000000005 110.925 179.962 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -178.43 175.54 1.14 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.211 -0.45 . . . . 73.219999999999999 110.905 179.979 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -70.12 -156.08 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.16 -0.473 . . . . 64.200000000000003 110.873 -179.811 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 18.0 m -117.72 -20.08 5.62 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.138 -0.483 . . . . 63.219999999999999 111.156 179.926 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -112.44 174.73 5.75 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.171 -0.468 . . . . 54.030000000000001 110.89 179.916 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -111.8 -22.38 11.16 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.173 -0.467 . . . . 73.120000000000005 110.895 179.989 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . 0.543 ' HA ' ' C ' ' A' ' 59' ' ' PRO . 3.4 pt-20 -126.32 148.91 65.6 Favored Pre-proline 0 C--N 1.33 -0.26 0 CA-C-O 121.692 0.758 . . . . 55.329999999999998 110.84 179.956 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 59' ' ' PRO . . . . . 0.543 ' C ' ' HA ' ' A' ' 58' ' ' GLU . 54.0 Cg_endo -69.72 -8.58 10.5 Favored 'Cis proline' 0 C--N 1.342 0.186 0 C-N-CA 122.737 -1.776 . . . . 74.340000000000003 112.33 0.012 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 60' ' ' VAL . . . . . 0.741 HG11 HD22 ' A' ' 88' ' ' ASN . 29.2 m -139.5 172.27 13.08 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.193 -0.458 . . . . 64.420000000000002 111.131 179.923 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 5.1 tt0 -108.35 -17.15 14.07 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.143 -0.48 . . . . 74.319999999999993 110.882 179.99 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 62' ' ' SER . . . . . 0.805 ' CB ' HD11 ' A' ' 125' ' ' LEU . 0.3 OUTLIER 41.4 93.43 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.193 -0.458 . . . . 41.549999999999997 110.86 -179.773 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 63' ' ' SER . . . . . 0.423 ' N ' HE21 ' A' ' 87' ' ' GLN . 16.1 t -124.5 124.02 41.38 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.112 -0.495 . . . . 73.140000000000001 110.835 -179.831 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 64' ' ' ILE . . . . . . . . . . . . . 14.5 mt -138.34 146.06 27.37 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 116.124 -0.489 . . . . 73.0 111.155 179.889 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 62.1 m -110.32 113.69 26.55 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.162 -0.472 . . . . 73.439999999999998 111.159 179.996 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . 0.636 HD21 HG21 ' A' ' 121' ' ' THR . 0.4 OUTLIER -91.75 112.24 24.08 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.267 -0.424 . . . . 63.030000000000001 110.92 179.955 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 5.1 t60 -105.27 109.87 22.02 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.203 -0.453 . . . . 74.530000000000001 110.872 179.841 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 68' ' ' PHE . . . . . 0.501 ' HA ' HD13 ' A' ' 81' ' ' ILE . 0.0 OUTLIER -103.75 140.12 38.05 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.208 -0.451 . . . . 71.430000000000007 110.871 -179.916 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -119.3 129.36 54.84 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.159 -0.473 . . . . 43.32 111.093 179.921 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 70' ' ' MET . . . . . 0.794 ' HE3' HD11 ' A' ' 114' ' ' ILE . 17.8 mmt -91.35 95.7 10.14 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.22 -0.445 . . . . 61.43 110.845 -179.993 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -51.61 159.96 1.14 Allowed Pre-proline 0 C--N 1.329 -0.295 0 CA-C-O 121.578 0.704 . . . . 63.030000000000001 111.129 -179.91 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 72' ' ' PRO . . . . . 0.71 ' O ' HD13 ' A' ' 8' ' ' LEU . 53.8 Cg_endo -69.8 3.29 2.88 Favored 'Trans proline' 0 C--N 1.341 0.163 0 C-N-CA 122.705 2.27 . . . . 75.319999999999993 112.362 179.944 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 73' ' ' MET . . . . . 0.514 ' HB3' HG23 ' A' ' 77' ' ' THR . 0.1 OUTLIER -119.73 -25.78 5.83 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.182 -0.463 . . . . 72.439999999999998 110.921 179.911 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 74' ' ' TYR . . . . . 0.651 ' CD1' ' C ' ' A' ' 74' ' ' TYR . 0.0 OUTLIER -48.37 149.59 2.69 Favored Pre-proline 0 C--N 1.329 -0.305 0 CA-C-O 121.692 0.758 . . . . 65.439999999999998 110.987 -179.909 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 75' ' ' PRO . . . . . 0.536 ' C ' ' HA ' ' A' ' 74' ' ' TYR . 53.6 Cg_endo -69.84 -13.0 12.51 Favored 'Cis proline' 0 C--O 1.232 0.184 0 C-N-CA 122.688 -1.797 . . . . 43.539999999999999 112.341 0.059 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 76' ' ' TYR . . . . . 0.489 ' CB ' ' O ' ' A' ' 73' ' ' MET . 1.5 t80 -34.89 -48.48 0.4 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.232 -0.44 . . . . 73.409999999999997 110.91 -179.917 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 77' ' ' THR . . . . . 0.514 HG23 ' HB3' ' A' ' 73' ' ' MET . 69.6 p -108.2 169.92 8.33 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.119 -0.491 . . . . 75.120000000000005 111.168 -179.985 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -89.59 129.81 45.64 Favored Pre-proline 0 C--N 1.33 -0.282 0 CA-C-O 121.57 0.7 . . . . 44.539999999999999 111.121 179.858 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 79' ' ' PRO . . . . . 0.778 ' HG3' HD11 ' A' ' 113' ' ' ILE . 53.6 Cg_endo -69.77 179.38 3.74 Favored 'Trans proline' 0 C--N 1.341 0.163 0 C-N-CA 122.643 2.229 . . . . 63.109999999999999 112.355 -179.989 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -117.1 137.13 52.49 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.219 -0.446 . . . . 73.040000000000006 110.846 -179.921 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 81' ' ' ILE . . . . . 0.501 HD13 ' HA ' ' A' ' 68' ' ' PHE . 5.2 mm -125.45 144.21 36.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.164 -0.471 . . . . 74.310000000000002 111.139 179.964 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . 0.473 ' HG3' ' CD ' ' A' ' 84' ' ' LYS . 3.0 pt-20 -145.48 141.25 28.16 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.175 -0.466 . . . . 75.040000000000006 110.901 179.985 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 83' ' ' PHE . . . . . 0.636 ' CG ' HD22 ' A' ' 94' ' ' LEU . 7.5 m-85 -96.97 141.02 30.64 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.196 -0.456 . . . . 65.099999999999994 110.886 -179.916 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 84' ' ' LYS . . . . . 0.473 ' CD ' ' HG3' ' A' ' 82' ' ' GLU . 5.1 mmmt -125.45 172.22 9.84 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.124 -0.489 . . . . 72.109999999999999 110.9 179.952 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 85' ' ' ASN . . . . . 0.4 ' C ' ' CG2' ' A' ' 86' ' ' VAL . 2.4 m-80 61.48 -75.24 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.222 -0.445 . . . . 65.319999999999993 110.865 179.939 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 86' ' ' VAL . . . . . 1.012 HG11 HD11 ' A' ' 94' ' ' LEU . 2.4 m 39.96 92.63 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.233 -0.44 . . . . 74.409999999999997 111.125 179.916 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 87' ' ' GLN . . . . . 0.423 HE21 ' N ' ' A' ' 63' ' ' SER . 0.6 OUTLIER -97.06 -87.43 0.31 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.147 -0.478 . . . . 63.039999999999999 110.938 -179.992 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 88' ' ' ASN . . . . . 0.741 HD22 HG11 ' A' ' 60' ' ' VAL . 0.3 OUTLIER -47.93 -51.25 24.15 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.199 -0.455 . . . . 74.430000000000007 110.897 -179.985 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 89' ' ' VAL . . . . . 0.694 HG21 ' HG ' ' A' ' 94' ' ' LEU . 1.2 p -59.53 135.2 24.34 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.187 -0.461 . . . . 75.109999999999999 111.123 179.903 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 90' ' ' MET . . . . . . . . . . . . . 4.7 mtm -86.87 -60.82 1.88 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.168 -0.469 . . . . 73.219999999999999 110.882 179.925 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 3.5 p-10 179.41 -32.1 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.198 -0.455 . . . . 74.140000000000001 110.858 179.961 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 99.8 p -54.6 -45.35 73.63 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.2 -0.455 . . . . 75.329999999999998 110.832 -179.773 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 93' ' ' GLN . . . . . 0.645 ' CD ' ' CD1' ' A' ' 128' ' ' PHE . 1.2 mt-30 -70.2 -38.09 75.25 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.14 -0.482 . . . . 70.340000000000003 110.894 -179.947 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . 1.012 HD11 HG11 ' A' ' 86' ' ' VAL . 29.2 mt -58.84 -47.77 83.68 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.217 -0.447 . . . . 72.510000000000005 110.91 -179.986 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 28.4 mt-30 -62.78 -34.1 76.56 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.168 -0.469 . . . . 74.310000000000002 110.952 179.919 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 96' ' ' MET . . . . . . . . . . . . . 43.5 ttp -60.47 -37.27 80.48 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.199 -0.455 . . . . 63.43 110.86 179.941 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 97' ' ' LEU . . . . . 0.984 HD22 HG22 ' A' ' 121' ' ' THR . 80.4 mt -61.41 -46.57 89.57 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.223 -0.444 . . . . 73.230000000000004 110.891 -179.97 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 98' ' ' LYS . . . . . 0.528 ' HD3' ' CZ ' ' A' ' 83' ' ' PHE . 3.9 mmtp -58.12 -34.16 69.92 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.204 -0.453 . . . . 70.239999999999995 110.87 179.896 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 1.4 t -69.68 -46.29 66.4 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.207 -0.452 . . . . 71.0 110.822 -179.887 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 100' ' ' GLU . . . . . 0.67 ' O ' HD12 ' A' ' 104' ' ' ILE . 7.7 pt-20 -72.38 -23.88 61.18 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.145 -0.48 . . . . 71.319999999999993 110.926 -179.973 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 101' ' ' PHE . . . . . 0.611 ' CD1' ' O ' ' A' ' 97' ' ' LEU . 10.1 m-30 -59.42 -22.9 62.14 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.121 -0.49 . . . . 63.299999999999997 110.886 -179.93 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.46 -45.38 59.78 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.155 -0.475 . . . . 74.030000000000001 110.858 -179.999 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 24.6 mtmm -63.24 -38.8 92.57 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.189 -0.46 . . . . 55.130000000000003 110.869 179.922 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 104' ' ' ILE . . . . . 0.716 HD11 ' CD2' ' A' ' 120' ' ' PHE . 1.6 mp -63.08 -47.63 91.66 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.218 -0.446 . . . . 73.540000000000006 111.108 179.876 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 105' ' ' HIS . . . . . . . . . . . . . 9.3 t-80 -63.12 -41.88 99.43 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.201 -0.454 . . . . 73.439999999999998 110.866 179.867 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -56.73 -43.39 80.6 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.21 -0.45 . . . . 72.209999999999994 110.9 -179.929 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 107' ' ' THR . . . . . 0.411 HG22 ' O ' ' A' ' 104' ' ' ILE . 7.6 t -77.73 -22.39 50.44 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.185 -0.461 . . . . 71.010000000000005 111.162 -179.983 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 108' ' ' SER . . . . . 0.584 ' HB3' HG22 ' A' ' 113' ' ' ILE . 1.7 m -118.3 35.46 4.75 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.197 -0.456 . . . . 73.430000000000007 110.862 -179.851 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 14.4 ttt180 -75.87 88.41 2.88 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.163 -0.471 . . . . 70.099999999999994 110.85 -179.919 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 123.33 32.85 0.87 Allowed Glycine 0 N--CA 1.45 -0.369 0 C-N-CA 120.754 -0.736 . . . . 51.409999999999997 112.49 179.987 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 111' ' ' GLN . . . . . . . . . . . . . 3.4 pt20 -169.28 -162.98 0.38 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.794 0.331 . . . . 71.420000000000002 110.878 -179.888 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 35.3 mt-10 -65.9 127.1 30.7 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.162 -0.472 . . . . 74.129999999999995 110.833 -179.896 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 113' ' ' ILE . . . . . 0.778 HD11 ' HG3' ' A' ' 79' ' ' PRO . 7.4 pt -126.35 -8.35 5.1 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 116.122 -0.49 . . . . 61.240000000000002 111.13 179.947 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 114' ' ' ILE . . . . . 0.883 ' H ' HD12 ' A' ' 114' ' ' ILE . 3.6 mp -67.73 -46.77 81.92 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.174 -0.466 . . . . 73.230000000000004 111.114 179.873 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 115' ' ' PHE . . . . . 0.722 ' HE1' HG21 ' A' ' 25' ' ' ILE . 28.1 t80 -68.28 -36.42 79.37 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.157 -0.474 . . . . 72.420000000000002 110.852 -179.979 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 53.4 mm-40 -67.54 -45.79 74.68 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.139 -0.482 . . . . 71.540000000000006 110.911 -179.945 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 117' ' ' ILE . . . . . 0.532 HD11 ' CG ' ' A' ' 101' ' ' PHE . 0.4 OUTLIER -67.15 -40.41 85.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.111 -0.495 . . . . 74.200000000000003 111.141 179.983 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 118' ' ' THR . . . . . 0.802 HG23 ' O ' ' A' ' 114' ' ' ILE . 62.1 p -68.35 -43.43 77.49 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.156 -0.475 . . . . 44.140000000000001 111.114 179.956 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -64.9 -43.89 91.39 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.26 -0.427 . . . . 51.009999999999998 110.829 -179.824 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 120' ' ' PHE . . . . . 0.716 ' CD2' HD11 ' A' ' 104' ' ' ILE . 0.1 OUTLIER -60.86 -48.58 81.15 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.13 -0.486 . . . . 74.239999999999995 110.904 -179.961 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 121' ' ' THR . . . . . 0.984 HG22 HD22 ' A' ' 97' ' ' LEU . 29.5 p -64.52 -40.31 95.39 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.128 -0.487 . . . . 63.229999999999997 111.145 -179.949 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 16.1 tt0 -60.17 -38.14 82.28 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.211 -0.449 . . . . 71.230000000000004 110.955 179.985 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 123' ' ' GLU . . . . . 0.515 ' C ' ' CD ' ' A' ' 123' ' ' GLU . 0.1 OUTLIER -77.87 -46.38 21.55 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.156 -0.475 . . . . 74.319999999999993 110.947 179.986 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.4 -34.1 77.39 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.127 -0.488 . . . . 74.319999999999993 110.889 179.96 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 125' ' ' LEU . . . . . 0.805 HD11 ' CB ' ' A' ' 62' ' ' SER . 1.8 tp -68.96 -43.37 75.14 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.236 -0.438 . . . . 63.43 110.925 179.926 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -68.12 -36.95 80.55 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.139 -0.482 . . . . 74.530000000000001 110.885 179.863 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 127' ' ' GLU . . . . . 0.42 ' HG3' ' N ' ' A' ' 128' ' ' PHE . 0.0 OUTLIER -62.39 -28.76 70.0 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.155 -0.475 . . . . 70.140000000000001 110.906 -179.947 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 128' ' ' PHE . . . . . 0.645 ' CD1' ' CD ' ' A' ' 93' ' ' GLN . 0.2 OUTLIER . . . . . 0 C--N 1.329 -0.324 0 CA-C-N 116.143 -0.48 . . . . 65.540000000000006 110.907 -179.918 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . 0.416 HD13 ' O ' ' A' ' 72' ' ' PRO . 16.6 mt . . . . . 0 C--O 1.231 0.08 0 CA-C-O 120.874 0.369 . . . . 74.530000000000001 110.926 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -51.4 -32.02 24.8 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.181 -0.463 . . . . 73.540000000000006 110.885 179.802 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 11.4 mm-40 -68.4 -40.32 81.35 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.185 -0.462 . . . . 72.450000000000003 110.896 -179.906 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 10.4 m-85 -49.37 -23.32 1.42 Allowed 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.229 -0.441 . . . . 74.25 110.896 -179.85 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 9.1 m-85 -57.72 -36.34 71.88 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.158 -0.474 . . . . 73.120000000000005 110.958 -179.919 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . 0.601 ' CG ' HD12 ' A' ' 14' ' ' ILE . 11.9 pt-20 -60.97 -43.55 98.6 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.068 -0.514 . . . . 74.230000000000004 110.868 -179.965 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 14' ' ' ILE . . . . . 0.601 HD12 ' CG ' ' A' ' 13' ' ' GLU . 2.8 mp -68.15 -43.32 85.11 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.179 -0.464 . . . . 74.049999999999997 111.19 179.932 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . 0.473 ' HG2' ' CB ' ' A' ' 70' ' ' MET . 20.4 mt-30 -63.16 -45.74 90.44 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.118 -0.492 . . . . 54.340000000000003 110.931 179.928 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 16.1 t -58.86 -41.59 87.38 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.224 -0.444 . . . . 64.219999999999999 110.869 -179.934 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 4.8 m-20 -63.15 -34.02 76.71 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.191 -0.459 . . . . 73.040000000000006 110.87 -179.917 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . 0.415 ' N ' ' OE1' ' A' ' 18' ' ' GLU . 0.0 OUTLIER -66.22 -38.99 89.25 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.193 -0.458 . . . . 61.100000000000001 110.89 -179.994 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.726 HD11 HG13 ' A' ' 46' ' ' ILE . 6.0 mt -60.79 -51.64 68.48 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.18 -0.463 . . . . 61.130000000000003 110.883 -179.968 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 4.8 pt-20 -68.74 -38.15 79.93 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.227 -0.442 . . . . 52.420000000000002 110.863 179.943 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -58.63 -50.54 73.47 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.154 -0.475 . . . . 62.130000000000003 111.084 179.977 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . 0.577 ' HA ' HD12 ' A' ' 25' ' ' ILE . 0.7 OUTLIER -75.49 -35.83 33.45 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.218 -0.446 . . . . 74.209999999999994 111.115 179.984 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 7.2 mtp180 -52.55 -34.25 49.28 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.178 -0.464 . . . . 72.450000000000003 110.873 179.981 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -66.39 -34.55 78.21 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.183 -0.462 . . . . 74.049999999999997 110.831 -179.816 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . 0.9 HD13 ' CE1' ' A' ' 115' ' ' PHE . 3.7 mt -79.92 -45.34 22.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.178 -0.465 . . . . 61.109999999999999 111.117 179.977 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 34.9 m-85 -109.78 45.38 1.1 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.177 -0.465 . . . . 63.409999999999997 110.974 -179.989 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 27' ' ' MET . . . . . 0.417 ' HE2' ' H ' ' A' ' 27' ' ' MET . 0.4 OUTLIER -39.68 -55.6 1.86 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.103 -0.499 . . . . 72.319999999999993 110.882 179.921 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -95.28 -14.69 23.76 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.252 -0.431 . . . . 72.319999999999993 110.88 179.945 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 4.4 m-20 -92.75 31.01 1.44 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.185 -0.461 . . . . 72.409999999999997 110.897 179.997 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 30' ' ' PHE . . . . . 0.519 ' C ' ' CD1' ' A' ' 30' ' ' PHE . 2.0 t80 -120.39 142.26 49.35 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.163 -0.471 . . . . 74.510000000000005 110.846 -179.881 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 31' ' ' THR . . . . . 0.45 ' N ' ' CD1' ' A' ' 30' ' ' PHE . 18.2 m -119.01 129.38 55.1 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.16 -0.473 . . . . 74.439999999999998 111.148 -179.925 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 10.2 t0 -89.27 113.6 24.87 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.206 -0.452 . . . . 70.120000000000005 110.883 179.902 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.991 HD21 HG12 ' A' ' 47' ' ' ILE . 0.4 OUTLIER -120.19 -28.92 4.98 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.159 -0.473 . . . . 63.340000000000003 110.891 -179.962 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . 0.934 ' N ' HD23 ' A' ' 33' ' ' LEU . 5.2 m . . . . . 0 C--N 1.329 -0.306 0 CA-C-N 116.231 -0.441 . . . . 72.530000000000001 111.166 179.957 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 45' ' ' GLN . . . . . 0.519 ' O ' ' CG ' ' A' ' 45' ' ' GLN . 7.3 tt0 . . . . . 0 C--O 1.232 0.163 0 CA-C-O 120.775 0.321 . . . . 62.149999999999999 110.921 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 46' ' ' ILE . . . . . 0.726 HG13 HD11 ' A' ' 19' ' ' LEU . 0.0 OUTLIER 82.81 -28.1 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.215 -0.448 . . . . 72.049999999999997 111.118 179.952 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . 0.991 HG12 HD21 ' A' ' 33' ' ' LEU . 0.2 OUTLIER -37.97 150.42 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.147 -0.479 . . . . 54.210000000000001 111.129 179.877 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 48' ' ' PHE . . . . . 0.733 ' HA ' HD22 ' A' ' 33' ' ' LEU . 1.6 p90 -152.35 157.93 41.99 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.187 -0.46 . . . . 64.420000000000002 110.902 179.967 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . 0.678 ' HG3' HD13 ' A' ' 33' ' ' LEU . 7.1 mt-10 -108.76 147.43 32.03 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.164 -0.471 . . . . 55.439999999999998 110.886 -179.939 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . 0.417 HD13 ' HA ' ' A' ' 30' ' ' PHE . 10.8 mm -129.32 135.23 62.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.172 -0.467 . . . . 71.519999999999996 111.132 179.955 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 98.4 m -84.27 132.16 34.66 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.174 -0.466 . . . . 62.210000000000001 111.134 179.945 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . 0.717 HD12 HD12 ' A' ' 66' ' ' LEU . 19.8 mt -132.83 157.04 46.01 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.18 -0.464 . . . . 63.409999999999997 110.88 179.983 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 53' ' ' ARG . . . . . 0.741 ' C ' HD21 ' A' ' 125' ' ' LEU . 0.0 OUTLIER -178.64 166.02 1.71 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.219 -0.446 . . . . 74.510000000000005 110.921 179.952 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . 0.853 ' CA ' HD11 ' A' ' 125' ' ' LEU . 0.4 OUTLIER -62.63 -176.53 0.11 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.223 -0.444 . . . . 53.439999999999998 110.859 -179.765 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 18.5 m -99.08 -24.08 4.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.147 -0.479 . . . . 61.450000000000003 111.096 -179.991 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -112.92 -171.03 1.79 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.196 -0.456 . . . . 54.509999999999998 110.925 179.902 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 6.0 mmmm -119.33 -18.92 8.46 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.234 -0.439 . . . . 73.120000000000005 110.874 179.989 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . 0.56 ' HA ' ' C ' ' A' ' 59' ' ' PRO . 11.2 pt-20 -115.97 143.27 30.53 Favored Pre-proline 0 C--N 1.329 -0.315 0 CA-C-O 121.599 0.714 . . . . 73.409999999999997 110.898 179.939 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 59' ' ' PRO . . . . . 0.56 ' C ' ' HA ' ' A' ' 58' ' ' GLU . 54.0 Cg_endo -69.67 -9.23 10.74 Favored 'Cis proline' 0 C--O 1.232 0.205 0 C-N-CA 122.746 -1.772 . . . . 73.120000000000005 112.355 -0.051 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 60' ' ' VAL . . . . . 0.479 ' HB ' ' ND2' ' A' ' 88' ' ' ASN . 11.9 m -152.13 -176.29 0.25 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.215 -0.448 . . . . 51.030000000000001 111.129 179.945 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . 0.457 ' O ' ' C ' ' A' ' 62' ' ' SER . 11.7 tt0 -113.24 -11.95 13.16 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.166 -0.47 . . . . 74.439999999999998 110.898 -179.977 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 62' ' ' SER . . . . . 0.836 ' HB3' HD13 ' A' ' 125' ' ' LEU . 0.1 OUTLIER 33.16 90.56 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.122 -0.49 . . . . 70.400000000000006 110.846 -179.794 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 32.3 t -109.53 124.73 51.58 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.11 -0.495 . . . . 63.25 110.876 -179.849 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 64' ' ' ILE . . . . . 0.513 HD11 HG21 ' A' ' 89' ' ' VAL . 14.5 mt -139.71 150.72 22.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.144 -0.48 . . . . 73.510000000000005 111.115 179.998 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 90.7 m -120.9 114.47 21.62 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.182 -0.463 . . . . 53.240000000000002 111.123 179.957 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . 0.992 HD11 HG21 ' A' ' 121' ' ' THR . 17.5 mt -93.81 116.49 28.96 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.224 -0.444 . . . . 72.349999999999994 110.923 179.914 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 7.2 t60 -103.98 115.44 30.45 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.223 -0.444 . . . . 73.540000000000006 110.817 179.883 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 68' ' ' PHE . . . . . 0.614 ' HA ' HD13 ' A' ' 81' ' ' ILE . 0.0 OUTLIER -103.86 139.75 38.62 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.183 -0.462 . . . . 74.439999999999998 110.889 -179.923 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 69' ' ' ALA . . . . . 0.597 ' HA ' HG22 ' A' ' 47' ' ' ILE . . . -120.44 114.93 22.53 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.125 -0.489 . . . . 62.439999999999998 111.108 179.906 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 70' ' ' MET . . . . . 0.473 ' CB ' ' HG2' ' A' ' 15' ' ' GLN . 1.0 OUTLIER -81.59 95.38 7.14 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.203 -0.453 . . . . 72.340000000000003 110.929 179.929 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -51.36 161.49 0.78 Allowed Pre-proline 0 C--N 1.329 -0.295 0 CA-C-O 121.602 0.715 . . . . 61.509999999999998 111.134 -179.89 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 72' ' ' PRO . . . . . 0.416 ' O ' HD13 ' A' ' 8' ' ' LEU . 53.0 Cg_endo -69.75 -15.09 36.97 Favored 'Trans proline' 0 C--N 1.341 0.158 0 C-N-CA 122.694 2.263 . . . . 63.350000000000001 112.316 179.991 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 73' ' ' MET . . . . . 0.57 ' HB3' HG23 ' A' ' 77' ' ' THR . 0.0 OUTLIER -101.38 -20.68 15.07 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.211 -0.45 . . . . 71.219999999999999 110.889 179.876 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 74' ' ' TYR . . . . . 0.668 ' CD1' ' C ' ' A' ' 74' ' ' TYR . 0.0 OUTLIER -50.72 152.42 3.5 Favored Pre-proline 0 C--N 1.328 -0.356 0 CA-C-O 121.654 0.74 . . . . 62.509999999999998 110.913 -179.899 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 75' ' ' PRO . . . . . 0.548 ' C ' ' HA ' ' A' ' 74' ' ' TYR . 54.1 Cg_endo -69.75 -11.37 11.87 Favored 'Cis proline' 0 C--O 1.231 0.169 0 C-N-CA 122.684 -1.798 . . . . 62.229999999999997 112.334 -0.033 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 76' ' ' TYR . . . . . 0.501 ' CB ' ' O ' ' A' ' 73' ' ' MET . 2.3 t80 -34.06 -56.77 0.48 Allowed 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.175 -0.466 . . . . 61.5 110.927 -179.895 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 77' ' ' THR . . . . . 0.57 HG23 ' HB3' ' A' ' 73' ' ' MET . 37.6 p -99.46 167.48 10.59 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.117 -0.492 . . . . 75.5 111.14 -179.969 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -89.03 129.93 46.36 Favored Pre-proline 0 C--N 1.329 -0.288 0 CA-C-O 121.576 0.703 . . . . 71.019999999999996 111.096 179.864 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 79' ' ' PRO . . . . . 0.765 ' HG3' HD11 ' A' ' 113' ' ' ILE . 53.4 Cg_endo -69.75 -176.59 1.53 Allowed 'Trans proline' 0 C--N 1.341 0.172 0 C-N-CA 122.695 2.263 . . . . 73.219999999999999 112.365 179.984 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . 0.585 ' O ' HD13 ' A' ' 81' ' ' ILE . 2.8 tt0 -114.55 141.16 48.1 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.223 -0.444 . . . . 51.409999999999997 110.912 -179.974 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 81' ' ' ILE . . . . . 0.614 HD13 ' HA ' ' A' ' 68' ' ' PHE . 17.4 mm -133.44 140.88 45.86 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.17 -0.468 . . . . 73.5 111.111 -179.979 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . 0.478 ' HG3' ' CD ' ' A' ' 84' ' ' LYS . 5.9 pt-20 -149.08 145.76 27.39 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.185 -0.461 . . . . 72.420000000000002 110.883 179.95 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 83' ' ' PHE . . . . . 0.917 ' CE1' HD21 ' A' ' 66' ' ' LEU . 26.5 m-85 -97.65 142.14 29.82 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.196 -0.457 . . . . 60.530000000000001 110.896 -179.946 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 84' ' ' LYS . . . . . 0.478 ' CD ' ' HG3' ' A' ' 82' ' ' GLU . 5.1 mmmt -126.92 173.65 9.44 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.167 -0.469 . . . . 75.510000000000005 110.872 179.975 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 85' ' ' ASN . . . . . 0.464 ' O ' ' C ' ' A' ' 86' ' ' VAL . 1.7 m-80 63.29 -72.67 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.175 -0.466 . . . . 72.200000000000003 110.857 179.942 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 86' ' ' VAL . . . . . 0.568 HG23 ' O ' ' A' ' 86' ' ' VAL . 16.6 m 32.13 90.99 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.192 -0.458 . . . . 71.109999999999999 111.125 179.924 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -95.51 -74.14 0.56 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.167 -0.469 . . . . 50.219999999999999 110.91 -179.988 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 88' ' ' ASN . . . . . 0.479 ' ND2' ' HB ' ' A' ' 60' ' ' VAL . 62.4 m-80 -78.61 45.48 0.59 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.204 -0.453 . . . . 53.149999999999999 110.881 -179.974 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 89' ' ' VAL . . . . . 0.716 HG11 ' HG ' ' A' ' 94' ' ' LEU . 42.2 t -135.28 140.12 45.55 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.17 -0.468 . . . . 74.140000000000001 111.134 179.914 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 90' ' ' MET . . . . . 0.457 ' O ' ' CB ' ' A' ' 91' ' ' ASP . 22.0 mtm -92.1 -62.0 1.5 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.167 -0.469 . . . . 41.119999999999997 110.839 179.968 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 91' ' ' ASP . . . . . 0.457 ' CB ' ' O ' ' A' ' 90' ' ' MET . 0.4 OUTLIER 163.0 -22.15 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.226 -0.443 . . . . 75.140000000000001 110.857 179.968 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -62.9 -47.18 84.42 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.199 -0.455 . . . . 74.230000000000004 110.887 -179.789 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 93' ' ' GLN . . . . . 0.516 ' CG ' HG13 ' A' ' 89' ' ' VAL . 3.8 pm0 -71.26 -36.41 71.75 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.132 -0.485 . . . . 65.129999999999995 110.896 -179.945 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . 0.716 ' HG ' HG11 ' A' ' 89' ' ' VAL . 31.7 mt -58.0 -48.96 78.47 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.191 -0.458 . . . . 74.219999999999999 110.887 -179.97 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 2.4 mm-40 -65.79 -33.57 76.16 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.204 -0.453 . . . . 74.049999999999997 110.871 179.972 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 96' ' ' MET . . . . . . . . . . . . . 6.1 ttp -59.61 -36.65 76.74 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.222 -0.444 . . . . 73.25 110.898 179.954 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 97' ' ' LEU . . . . . 0.997 HD13 HG22 ' A' ' 121' ' ' THR . 61.2 mt -66.5 -43.63 84.82 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.201 -0.454 . . . . 73.109999999999999 110.899 -179.99 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 98' ' ' LYS . . . . . 0.431 ' HA ' ' CD2' ' A' ' 101' ' ' PHE . 8.5 mmtp -55.44 -37.1 67.26 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.239 -0.437 . . . . 72.409999999999997 110.897 179.823 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 8.9 m -62.4 -43.61 98.41 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.198 -0.455 . . . . 75.109999999999999 110.872 -179.873 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 100' ' ' GLU . . . . . 0.559 ' O ' HD12 ' A' ' 104' ' ' ILE . 5.7 mm-40 -71.01 -24.95 62.47 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.11 -0.496 . . . . 63.119999999999997 110.863 -179.96 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 101' ' ' PHE . . . . . 0.593 ' CD1' ' O ' ' A' ' 97' ' ' LEU . 9.0 m-30 -59.62 -40.84 88.92 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.167 -0.469 . . . . 74.439999999999998 110.912 -179.909 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -63.11 -40.26 97.1 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.122 -0.49 . . . . 63.329999999999998 110.882 179.992 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 14.7 ttpt -67.94 -36.5 80.22 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.25 -0.432 . . . . 55.109999999999999 110.901 179.847 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 104' ' ' ILE . . . . . 0.559 HD12 ' O ' ' A' ' 100' ' ' GLU . 3.8 mt -67.35 -47.6 80.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.208 -0.451 . . . . 74.340000000000003 111.115 179.895 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 105' ' ' HIS . . . . . . . . . . . . . 14.8 t60 -62.92 -42.19 99.71 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.161 -0.472 . . . . 73.349999999999994 110.881 179.868 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -57.96 -38.28 75.71 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.206 -0.452 . . . . 72.129999999999995 110.94 -179.966 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 8.9 t -88.15 -23.25 23.69 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.161 -0.472 . . . . 70.420000000000002 111.166 -179.992 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 108' ' ' SER . . . . . 0.638 ' HB3' HG22 ' A' ' 113' ' ' ILE . 13.4 m -114.59 41.01 2.43 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.174 -0.466 . . . . 55.240000000000002 110.898 -179.897 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 13.7 ttt180 -88.8 90.73 8.54 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.124 -0.489 . . . . 72.319999999999993 110.856 -179.914 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 140.09 -6.16 2.8 Favored Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.754 -0.736 . . . . 74.230000000000004 112.495 -179.966 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 111' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -136.11 -152.59 0.46 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.757 0.313 . . . . 74.129999999999995 110.919 -179.944 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 112' ' ' GLU . . . . . 0.405 ' HG2' ' CD ' ' A' ' 18' ' ' GLU . 11.9 mt-10 -79.8 132.3 36.1 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.197 -0.456 . . . . 65.129999999999995 110.921 -179.956 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 113' ' ' ILE . . . . . 0.765 HD11 ' HG3' ' A' ' 79' ' ' PRO . 9.8 pt -126.27 -12.33 4.54 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 116.157 -0.474 . . . . 53.109999999999999 111.127 179.99 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 114' ' ' ILE . . . . . 0.778 ' O ' HG23 ' A' ' 118' ' ' THR . 1.3 mp -63.05 -39.66 86.06 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.195 -0.457 . . . . 74.140000000000001 111.14 179.85 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 115' ' ' PHE . . . . . 0.9 ' CE1' HD13 ' A' ' 25' ' ' ILE . 40.9 t80 -70.96 -38.72 72.81 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.179 -0.464 . . . . 75.310000000000002 110.848 179.976 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 54.9 mm-40 -65.41 -44.04 88.65 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.128 -0.487 . . . . 63.140000000000001 110.849 -179.867 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 117' ' ' ILE . . . . . 0.467 HD11 ' CG ' ' A' ' 101' ' ' PHE . 0.4 OUTLIER -65.14 -40.15 87.89 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.172 -0.467 . . . . 65.140000000000001 111.142 179.965 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 118' ' ' THR . . . . . 0.778 HG23 ' O ' ' A' ' 114' ' ' ILE . 58.7 p -67.62 -42.9 81.62 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.176 -0.465 . . . . 74.540000000000006 111.157 179.974 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 119' ' ' SER . . . . . 0.417 ' HA ' ' CG ' ' A' ' 122' ' ' GLN . 0.7 OUTLIER -67.44 -31.41 71.57 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.238 -0.437 . . . . 72.329999999999998 110.864 -179.891 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 120' ' ' PHE . . . . . 0.447 ' O ' ' HG2' ' A' ' 123' ' ' GLU . 0.3 OUTLIER -77.65 -38.74 47.12 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.128 -0.487 . . . . 64.510000000000005 110.888 -179.941 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 121' ' ' THR . . . . . 0.997 HG22 HD13 ' A' ' 97' ' ' LEU . 9.7 p -71.64 -42.21 67.86 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.154 -0.476 . . . . 72.150000000000006 111.173 -179.948 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 122' ' ' GLN . . . . . 0.417 ' CG ' ' HA ' ' A' ' 119' ' ' SER . 1.1 pp0? -66.21 -41.08 90.62 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.229 -0.441 . . . . 72.540000000000006 110.93 179.953 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 123' ' ' GLU . . . . . 0.447 ' HG2' ' O ' ' A' ' 120' ' ' PHE . 11.9 pt-20 -68.37 -35.33 77.55 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.214 -0.448 . . . . 74.120000000000005 110.895 -179.915 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 124' ' ' LYS . . . . . 0.44 ' CE ' ' HA ' ' A' ' 124' ' ' LYS . 0.0 OUTLIER -72.16 -44.35 63.2 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.141 -0.481 . . . . 61.439999999999998 110.908 179.958 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 125' ' ' LEU . . . . . 0.853 HD11 ' CA ' ' A' ' 54' ' ' SER . 0.2 OUTLIER -65.18 -40.41 94.24 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.248 -0.433 . . . . 62.340000000000003 110.886 179.918 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -63.63 -45.43 90.28 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.223 -0.444 . . . . 65.25 110.893 179.835 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 127' ' ' GLU . . . . . 0.442 ' HG3' ' N ' ' A' ' 128' ' ' PHE . 0.0 OUTLIER -66.17 -29.3 69.56 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.158 -0.474 . . . . 72.219999999999999 110.896 -179.905 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 128' ' ' PHE . . . . . 0.49 ' CE1' ' HB3' ' A' ' 93' ' ' GLN . 1.8 t80 . . . . . 0 C--N 1.329 -0.319 0 CA-C-N 116.131 -0.486 . . . . 75.25 110.889 -179.901 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . 0.411 HD13 ' O ' ' A' ' 72' ' ' PRO . 20.2 mt . . . . . 0 C--O 1.231 0.121 0 CA-C-O 120.781 0.324 . . . . 71.209999999999994 110.888 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -51.25 -25.58 5.88 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.215 -0.448 . . . . 74.299999999999997 110.881 179.847 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . 0.417 ' O ' ' HG2' ' A' ' 13' ' ' GLU . 10.3 mm-40 -67.77 -38.99 84.16 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.221 -0.445 . . . . 75.409999999999997 110.913 -179.941 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 23.9 m-85 -64.51 -22.2 66.9 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.205 -0.452 . . . . 74.040000000000006 110.889 -179.834 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -57.43 -36.25 71.13 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.143 -0.48 . . . . 72.530000000000001 110.871 -179.842 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . 0.481 ' HG3' ' N ' ' A' ' 14' ' ' ILE . 5.6 pt-20 -59.82 -39.91 86.67 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.112 -0.494 . . . . 63.420000000000002 110.888 -179.981 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 14' ' ' ILE . . . . . 0.481 ' N ' ' HG3' ' A' ' 13' ' ' GLU . 3.7 mp -67.62 -47.47 80.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.178 -0.465 . . . . 73.450000000000003 111.109 179.967 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 46.4 mt-30 -64.56 -44.53 90.44 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.211 -0.45 . . . . 73.530000000000001 110.888 179.988 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 6.3 t -63.61 -41.47 98.3 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.218 -0.446 . . . . 73.310000000000002 110.865 -179.93 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 1.2 m-20 -57.98 -34.7 70.24 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.214 -0.448 . . . . 62.149999999999999 110.918 -179.936 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -67.23 -38.6 85.51 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.188 -0.46 . . . . 60.5 110.898 179.973 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.903 HD11 ' CG1' ' A' ' 46' ' ' ILE . 6.1 mt -60.91 -51.52 68.93 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.148 -0.478 . . . . 54.43 110.936 -179.994 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 4.7 pt-20 -68.62 -37.9 80.11 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.198 -0.455 . . . . 73.209999999999994 110.905 179.917 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -63.83 -50.64 68.09 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.126 -0.488 . . . . 54.039999999999999 111.089 179.924 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . 0.423 ' HA ' HD12 ' A' ' 25' ' ' ILE . 0.8 OUTLIER -71.4 -36.58 61.61 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 116.226 -0.443 . . . . 74.109999999999999 111.137 179.983 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -52.48 -34.45 49.32 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.177 -0.465 . . . . 71.120000000000005 110.889 179.963 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -67.23 -36.25 81.27 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.174 -0.466 . . . . 71.150000000000006 110.85 -179.77 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . 0.644 HD13 ' CE1' ' A' ' 115' ' ' PHE . 3.3 mt -79.33 -45.23 23.88 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.153 -0.476 . . . . 64.219999999999999 111.138 179.915 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 29.0 m-85 -109.04 46.35 0.98 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.155 -0.475 . . . . 74.219999999999999 110.936 -179.977 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 1.2 mtm -42.67 -57.4 2.74 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.081 -0.509 . . . . 72.129999999999995 110.9 179.903 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 6.2 p-10 -106.08 32.98 4.04 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.229 -0.441 . . . . 62.539999999999999 110.874 179.937 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -135.01 13.15 3.61 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.187 -0.46 . . . . 70.140000000000001 110.891 179.976 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 30' ' ' PHE . . . . . 0.611 ' C ' ' CD1' ' A' ' 30' ' ' PHE . 0.2 OUTLIER -111.89 139.92 46.98 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.195 -0.457 . . . . 71.230000000000004 110.854 -179.899 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 20.2 m -110.85 128.11 55.66 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.097 -0.501 . . . . 72.409999999999997 111.143 -179.928 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -87.61 113.71 23.55 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.218 -0.446 . . . . 63.119999999999997 110.891 179.918 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 1.065 HD23 ' N ' ' A' ' 34' ' ' THR . 0.1 OUTLIER -121.73 -16.68 7.63 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.193 -0.458 . . . . 71.040000000000006 110.899 -179.946 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . 1.065 ' N ' HD23 ' A' ' 33' ' ' LEU . 15.8 m . . . . . 0 C--N 1.329 -0.293 0 CA-C-N 116.204 -0.453 . . . . 73.230000000000004 111.146 179.933 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 45' ' ' GLN . . . . . 0.469 ' O ' ' CG ' ' A' ' 45' ' ' GLN . 15.2 tt0 . . . . . 0 C--O 1.232 0.15 0 CA-C-O 120.775 0.322 . . . . 62.310000000000002 110.912 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 46' ' ' ILE . . . . . 0.903 ' CG1' HD11 ' A' ' 19' ' ' LEU . 0.0 OUTLIER 81.86 -34.74 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.229 -0.441 . . . . 73.439999999999998 111.112 -179.995 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . 0.92 HG12 HD21 ' A' ' 33' ' ' LEU . 0.1 OUTLIER -32.97 141.02 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.209 -0.45 . . . . 72.510000000000005 111.12 179.878 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 48' ' ' PHE . . . . . 0.872 ' HA ' HD22 ' A' ' 33' ' ' LEU . 1.4 p90 -153.06 164.59 37.73 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.172 -0.467 . . . . 74.25 110.927 179.961 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . 0.801 ' CG ' HD13 ' A' ' 33' ' ' LEU . 12.5 mt-10 -108.86 152.31 25.08 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.183 -0.462 . . . . 71.519999999999996 110.893 -179.953 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . 0.479 HD13 ' HA ' ' A' ' 30' ' ' PHE . 3.8 mm -133.89 141.54 43.73 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.142 -0.481 . . . . 73.010000000000005 111.144 179.951 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 85.8 m -86.28 126.7 34.49 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.168 -0.469 . . . . 41.009999999999998 111.144 179.957 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . 0.729 HD12 HD12 ' A' ' 66' ' ' LEU . 16.2 mt -132.59 159.55 39.19 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.194 -0.457 . . . . 72.409999999999997 110.908 179.953 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -178.31 174.56 1.28 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.178 -0.465 . . . . 75.030000000000001 110.918 179.979 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . 0.462 ' HA ' ' CD1' ' A' ' 125' ' ' LEU . 7.3 p -63.16 -177.61 0.19 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.241 -0.436 . . . . 61.140000000000001 110.844 -179.792 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 30.2 m -91.18 -22.36 6.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.095 -0.502 . . . . 74.120000000000005 111.12 179.943 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -122.74 -170.13 2.04 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.208 -0.451 . . . . 52.549999999999997 110.862 179.95 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 1.7 mmmp? -118.11 -16.56 9.76 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.185 -0.462 . . . . 64.310000000000002 110.888 -179.97 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . 0.562 ' HA ' ' C ' ' A' ' 59' ' ' PRO . 56.8 mt-10 -120.22 146.69 43.14 Favored Pre-proline 0 C--N 1.329 -0.298 0 CA-C-O 121.675 0.75 . . . . 74.310000000000002 110.894 179.97 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 59' ' ' PRO . . . . . 0.562 ' C ' ' HA ' ' A' ' 58' ' ' GLU . 54.0 Cg_endo -69.75 -9.56 11.05 Favored 'Cis proline' 0 C--N 1.342 0.188 0 C-N-CA 122.695 -1.794 . . . . 52.299999999999997 112.334 0.034 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 60' ' ' VAL . . . . . 0.433 ' HB ' ' CG ' ' A' ' 88' ' ' ASN . 22.1 m -141.98 176.16 4.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.247 -0.433 . . . . 75.109999999999999 111.122 179.96 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . 0.447 ' O ' ' C ' ' A' ' 62' ' ' SER . 13.4 tt0 -106.97 -16.73 14.37 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.199 -0.455 . . . . 74.430000000000007 110.879 -180.0 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 62' ' ' SER . . . . . 0.887 ' HB3' HD21 ' A' ' 125' ' ' LEU . 26.7 m 34.12 87.19 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.161 -0.472 . . . . 50.509999999999998 110.87 -179.776 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 7.9 t -112.29 127.56 56.02 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.136 -0.483 . . . . 73.420000000000002 110.842 -179.777 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 64' ' ' ILE . . . . . . . . . . . . . 22.5 mt -140.61 140.34 33.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.144 -0.48 . . . . 53.109999999999999 111.127 179.948 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 29.8 m -103.28 117.3 34.19 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.15 -0.477 . . . . 54.439999999999998 111.159 179.968 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . 0.828 HD11 HG21 ' A' ' 121' ' ' THR . 8.9 mt -98.05 115.17 27.68 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.216 -0.447 . . . . 60.039999999999999 110.95 179.942 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 67' ' ' HIS . . . . . 0.571 ' CE1' HD11 ' A' ' 33' ' ' LEU . 10.5 t60 -111.67 110.08 20.29 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.193 -0.458 . . . . 75.109999999999999 110.885 179.893 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 68' ' ' PHE . . . . . 0.549 ' HB3' HD11 ' A' ' 81' ' ' ILE . 0.0 OUTLIER -102.81 140.21 37.38 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.239 -0.437 . . . . 73.030000000000001 110.897 -179.893 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 69' ' ' ALA . . . . . 0.537 ' HA ' HG22 ' A' ' 47' ' ' ILE . . . -120.73 116.41 25.21 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.144 -0.48 . . . . 32.299999999999997 111.073 179.961 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 70' ' ' MET . . . . . 0.575 ' CE ' HD11 ' A' ' 114' ' ' ILE . 1.1 mtt -87.06 108.96 19.1 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.241 -0.436 . . . . 55.530000000000001 110.908 179.934 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -61.68 160.38 27.26 Favored Pre-proline 0 C--N 1.33 -0.277 0 CA-C-O 121.516 0.674 . . . . 74.129999999999995 111.174 -179.924 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 72' ' ' PRO . . . . . 0.411 ' O ' HD13 ' A' ' 8' ' ' LEU . 53.7 Cg_endo -69.83 -4.17 13.53 Favored 'Trans proline' 0 C--N 1.341 0.173 0 C-N-CA 122.636 2.224 . . . . 63.530000000000001 112.373 179.937 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 73' ' ' MET . . . . . 0.505 ' O ' ' CB ' ' A' ' 76' ' ' TYR . 0.0 OUTLIER -111.92 -24.58 9.88 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.183 -0.462 . . . . 74.420000000000002 110.868 179.909 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 74' ' ' TYR . . . . . 0.655 ' CD1' ' C ' ' A' ' 74' ' ' TYR . 0.0 OUTLIER -48.94 152.7 1.73 Allowed Pre-proline 0 C--N 1.329 -0.309 0 CA-C-O 121.666 0.746 . . . . 72.239999999999995 110.941 -179.861 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 75' ' ' PRO . . . . . 0.549 ' HA ' ' CD2' ' A' ' 74' ' ' TYR . 53.4 Cg_endo -69.75 -8.55 10.53 Favored 'Cis proline' 0 C--O 1.232 0.196 0 C-N-CA 122.714 -1.786 . . . . 65.540000000000006 112.319 -0.056 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 76' ' ' TYR . . . . . 0.505 ' CB ' ' O ' ' A' ' 73' ' ' MET . 31.1 t80 -33.0 -46.79 0.16 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.255 -0.43 . . . . 74.329999999999998 110.912 -179.902 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 13.8 p -106.83 -171.44 1.89 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.135 -0.484 . . . . 65.409999999999997 111.125 -179.961 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -104.8 130.41 23.22 Favored Pre-proline 0 C--N 1.329 -0.3 0 CA-C-O 121.577 0.703 . . . . 72.209999999999994 111.123 179.843 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 79' ' ' PRO . . . . . 0.531 ' HG3' HD11 ' A' ' 113' ' ' ILE . 53.3 Cg_endo -69.8 167.54 24.19 Favored 'Trans proline' 0 C--O 1.231 0.153 0 C-N-CA 122.648 2.232 . . . . 75.319999999999993 112.336 -179.975 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 1.7 tt0 -118.85 134.82 54.9 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.213 -0.449 . . . . 74.129999999999995 110.876 -179.962 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 81' ' ' ILE . . . . . 0.569 HG21 HD22 ' A' ' 66' ' ' LEU . 12.1 mt -142.8 150.83 17.8 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.152 -0.476 . . . . 63.399999999999999 111.129 179.973 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . 0.504 ' HG3' ' CD ' ' A' ' 84' ' ' LYS . 9.2 pt-20 -149.43 147.64 28.5 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.167 -0.47 . . . . 63.100000000000001 110.906 179.923 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 83' ' ' PHE . . . . . 0.512 ' CZ ' ' HD3' ' A' ' 98' ' ' LYS . 6.3 m-85 -89.03 140.58 29.29 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.161 -0.472 . . . . 72.329999999999998 110.861 -179.891 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 84' ' ' LYS . . . . . 0.51 ' O ' ' N ' ' A' ' 86' ' ' VAL . 8.7 mmmt -124.26 174.69 7.54 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.133 -0.485 . . . . 54.130000000000003 110.913 179.971 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 85' ' ' ASN . . . . . 0.413 ' C ' HG22 ' A' ' 86' ' ' VAL . 2.0 m-80 59.66 -76.06 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.265 -0.425 . . . . 63.310000000000002 110.852 179.937 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 86' ' ' VAL . . . . . 0.9 HG11 HD21 ' A' ' 94' ' ' LEU . 3.6 m 41.28 87.52 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.162 -0.472 . . . . 54.450000000000003 111.146 179.914 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -94.61 -78.39 0.44 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.187 -0.46 . . . . 61.310000000000002 110.934 -179.989 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 88' ' ' ASN . . . . . 0.433 ' CG ' ' HB ' ' A' ' 60' ' ' VAL . 33.6 m120 -83.96 55.02 3.11 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.173 -0.467 . . . . 71.219999999999999 110.871 -179.954 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 89' ' ' VAL . . . . . 0.579 HG21 HD13 ' A' ' 94' ' ' LEU . 1.3 p -152.75 145.79 15.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.192 -0.458 . . . . 73.439999999999998 111.145 179.921 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 90' ' ' MET . . . . . 0.633 ' O ' HD22 ' A' ' 94' ' ' LEU . 0.5 OUTLIER -95.18 -155.65 0.48 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.176 -0.465 . . . . 65.329999999999998 110.88 179.904 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 91' ' ' ASP . . . . . 0.477 ' O ' ' CG ' ' A' ' 95' ' ' GLN . 0.1 OUTLIER -98.61 -17.76 18.46 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.227 -0.442 . . . . 75.209999999999994 110.883 179.955 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 78.8 p -66.64 -47.11 73.61 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.192 -0.458 . . . . 60.420000000000002 110.911 -179.783 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 93' ' ' GLN . . . . . 0.549 ' CG ' ' CD2' ' A' ' 128' ' ' PHE . 5.0 mt-30 -68.69 -42.97 77.07 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.114 -0.494 . . . . 74.120000000000005 110.918 -179.987 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . 0.9 HD21 HG11 ' A' ' 86' ' ' VAL . 0.1 OUTLIER -59.04 -49.11 79.14 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.156 -0.475 . . . . 64.530000000000001 110.91 -179.998 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 95' ' ' GLN . . . . . 0.477 ' CG ' ' O ' ' A' ' 91' ' ' ASP . 7.3 mm-40 -66.06 -35.25 80.03 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.149 -0.478 . . . . 74.140000000000001 110.941 179.911 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 96' ' ' MET . . . . . 0.512 ' SD ' ' CE1' ' A' ' 128' ' ' PHE . 29.5 ttp -60.3 -44.85 95.04 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.187 -0.461 . . . . 63.140000000000001 110.873 179.961 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 97' ' ' LEU . . . . . 0.635 HD22 HG22 ' A' ' 121' ' ' THR . 33.7 mt -58.13 -39.8 79.67 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.227 -0.442 . . . . 64.409999999999997 110.906 -179.968 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 98' ' ' LYS . . . . . 0.512 ' HD3' ' CZ ' ' A' ' 83' ' ' PHE . 5.6 mmtp -57.39 -43.78 83.94 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.186 -0.461 . . . . 73.299999999999997 110.881 179.82 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -61.3 -39.0 88.83 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.229 -0.442 . . . . 51.340000000000003 110.853 -179.879 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 100' ' ' GLU . . . . . 0.507 ' HG2' ' CE1' ' A' ' 120' ' ' PHE . 0.3 OUTLIER -69.86 -28.6 65.79 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.168 -0.469 . . . . 65.129999999999995 110.916 -179.97 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 101' ' ' PHE . . . . . 0.657 ' CG ' HD11 ' A' ' 117' ' ' ILE . 9.2 m-30 -59.42 -39.17 82.62 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.143 -0.481 . . . . 72.450000000000003 110.843 -179.906 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.81 -39.5 94.38 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.143 -0.48 . . . . 64.040000000000006 110.904 -179.999 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 37.7 mtmt -68.77 -40.98 79.45 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.209 -0.451 . . . . 61.340000000000003 110.891 179.865 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 4.3 mt -65.09 -47.57 87.26 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 116.278 -0.419 . . . . 72.409999999999997 111.166 179.842 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 105' ' ' HIS . . . . . 0.495 ' O ' ' N ' ' A' ' 109' ' ' ARG . 4.6 t60 -62.76 -41.35 99.18 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.191 -0.459 . . . . 63.539999999999999 110.853 179.873 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -59.17 -42.35 90.56 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.224 -0.444 . . . . 74.25 110.89 -179.944 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 10.7 t -82.67 -28.12 30.85 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.191 -0.459 . . . . 74.019999999999996 111.126 -179.955 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 108' ' ' SER . . . . . 0.762 ' HB3' HG22 ' A' ' 113' ' ' ILE . 23.5 m -101.74 13.38 35.05 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.195 -0.457 . . . . 63.210000000000001 110.904 -179.874 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 109' ' ' ARG . . . . . 0.495 ' N ' ' O ' ' A' ' 105' ' ' HIS . 2.6 ttt-85 -61.57 77.88 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.114 -0.494 . . . . 72.230000000000004 110.882 -179.949 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 110' ' ' GLY . . . . . 0.448 ' N ' ' O ' ' A' ' 108' ' ' SER . . . 137.12 31.76 0.25 Allowed Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.739 -0.744 . . . . 61.43 112.52 -179.98 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 111' ' ' GLN . . . . . 0.407 ' NE2' ' HA ' ' A' ' 108' ' ' SER . 4.4 pt20 -173.2 -165.69 0.3 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.743 0.306 . . . . 52.340000000000003 110.958 -179.841 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 38.8 mt-10 -65.74 127.64 32.77 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.216 -0.447 . . . . 73.5 110.88 179.994 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 113' ' ' ILE . . . . . 0.762 HG22 ' HB3' ' A' ' 108' ' ' SER . 19.3 pt -126.5 -10.9 4.66 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.133 -0.485 . . . . 74.239999999999995 111.112 179.974 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 114' ' ' ILE . . . . . 0.744 ' O ' HG23 ' A' ' 118' ' ' THR . 13.6 mm -67.06 -44.9 87.92 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.221 -0.445 . . . . 75.200000000000003 111.079 179.887 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 115' ' ' PHE . . . . . 0.644 ' CE1' HD13 ' A' ' 25' ' ' ILE . 19.7 t80 -68.98 -34.5 75.41 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.19 -0.459 . . . . 60.530000000000001 110.894 179.962 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 4.9 mm-40 -67.47 -47.53 69.79 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.154 -0.475 . . . . 63.009999999999998 110.89 -179.909 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 117' ' ' ILE . . . . . 0.657 HD11 ' CG ' ' A' ' 101' ' ' PHE . 0.5 OUTLIER -64.31 -40.53 89.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.108 -0.496 . . . . 61.32 111.165 179.949 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 118' ' ' THR . . . . . 0.744 HG23 ' O ' ' A' ' 114' ' ' ILE . 58.3 p -67.03 -43.38 82.94 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.166 -0.47 . . . . 75.209999999999994 111.13 179.93 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -68.07 -39.24 83.01 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.24 -0.437 . . . . 72.439999999999998 110.876 -179.861 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 120' ' ' PHE . . . . . 0.507 ' CE1' ' HG2' ' A' ' 100' ' ' GLU . 0.4 OUTLIER -69.69 -45.21 68.81 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.12 -0.491 . . . . 73.0 110.92 -179.995 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 121' ' ' THR . . . . . 0.828 HG21 HD11 ' A' ' 66' ' ' LEU . 19.0 p -66.63 -42.17 87.18 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.142 -0.481 . . . . 55.32 111.144 -179.935 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 122' ' ' GLN . . . . . 0.442 ' NE2' ' O ' ' A' ' 122' ' ' GLN . 0.7 OUTLIER -65.06 -51.28 62.36 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.266 -0.425 . . . . 74.239999999999995 110.943 179.98 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 123' ' ' GLU . . . . . 0.474 ' CG ' ' N ' ' A' ' 124' ' ' LYS . 7.3 pt-20 -62.13 -46.2 90.08 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.188 -0.46 . . . . 74.540000000000006 110.869 -179.953 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 124' ' ' LYS . . . . . 0.474 ' N ' ' CG ' ' A' ' 123' ' ' GLU . 1.1 mmpt? -63.91 -40.07 95.64 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.189 -0.46 . . . . 70.349999999999994 110.874 179.986 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 125' ' ' LEU . . . . . 0.887 HD21 ' HB3' ' A' ' 62' ' ' SER . 0.1 OUTLIER -70.09 -38.97 75.83 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.231 -0.44 . . . . 73.510000000000005 110.9 179.92 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 126' ' ' ASP . . . . . 0.722 ' N ' HD13 ' A' ' 125' ' ' LEU . 1.6 t0 -66.72 -46.49 75.35 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.158 -0.474 . . . . 74.120000000000005 110.856 179.872 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -67.88 -28.63 67.69 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.215 -0.448 . . . . 73.109999999999999 110.914 -179.93 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 128' ' ' PHE . . . . . 0.549 ' CD2' ' CG ' ' A' ' 93' ' ' GLN . 0.5 OUTLIER . . . . . 0 C--N 1.329 -0.291 0 CA-C-N 116.17 -0.468 . . . . 61.119999999999997 110.906 -179.934 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 44.1 mt . . . . . 0 C--O 1.231 0.092 0 CA-C-O 120.813 0.339 . . . . 75.040000000000006 110.904 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 17.2 t0 -54.19 -31.67 53.55 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.198 -0.455 . . . . 72.209999999999994 110.866 179.828 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . 0.41 ' O ' ' HG2' ' A' ' 13' ' ' GLU . 97.0 mm-40 -66.72 -40.53 88.44 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.218 -0.447 . . . . 60.130000000000003 110.918 -179.901 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 20.1 m-85 -56.09 -22.94 30.9 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.194 -0.457 . . . . 73.299999999999997 110.925 -179.859 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 12' ' ' TYR . . . . . 0.585 ' CZ ' HD11 ' A' ' 46' ' ' ILE . 0.3 OUTLIER -57.69 -36.34 71.82 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.145 -0.48 . . . . 75.010000000000005 110.869 -179.885 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . 0.483 ' HG3' ' N ' ' A' ' 14' ' ' ILE . 5.0 pt-20 -61.63 -41.11 97.04 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.173 -0.467 . . . . 64.030000000000001 110.874 -179.997 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 14' ' ' ILE . . . . . 0.483 ' N ' ' HG3' ' A' ' 13' ' ' GLU . 3.8 mp -68.28 -44.33 83.94 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-N 116.153 -0.476 . . . . 60.130000000000003 111.125 -179.99 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . 0.819 ' HB3' HG21 ' A' ' 46' ' ' ILE . 10.2 mt-30 -65.99 -47.22 75.27 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.15 -0.477 . . . . 73.230000000000004 110.91 179.944 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 2.5 t -61.4 -40.69 95.29 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.177 -0.465 . . . . 72.200000000000003 110.871 -179.946 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -58.21 -33.72 69.6 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.208 -0.451 . . . . 75.540000000000006 110.887 -179.866 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . 0.401 ' OE1' ' SD ' ' A' ' 70' ' ' MET . 32.6 mt-10 -65.81 -39.08 90.54 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.197 -0.456 . . . . 74.5 110.876 -179.997 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.433 HD12 ' CE1' ' A' ' 48' ' ' PHE . 6.8 mp -63.18 -51.8 64.93 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.144 -0.48 . . . . 73.120000000000005 110.903 -179.943 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 1.7 pt-20 -68.8 -37.22 79.12 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.203 -0.453 . . . . 73.120000000000005 110.895 179.941 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -64.27 -50.51 67.63 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.148 -0.478 . . . . 65.510000000000005 111.066 179.97 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . 0.833 ' HA ' HD12 ' A' ' 25' ' ' ILE . 0.9 OUTLIER -71.85 -35.31 54.35 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.272 -0.422 . . . . 73.340000000000003 111.117 179.971 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . 0.458 ' HG3' ' CD2' ' A' ' 30' ' ' PHE . 7.6 mtp180 -54.36 -37.99 65.59 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.174 -0.466 . . . . 64.439999999999998 110.887 179.936 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -65.38 -31.41 72.5 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.18 -0.464 . . . . 42.530000000000001 110.859 -179.786 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . 0.833 HD12 ' HA ' ' A' ' 22' ' ' ILE . 5.1 mt -80.35 -45.43 22.1 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.135 -0.484 . . . . 73.120000000000005 111.099 179.972 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 26' ' ' TYR . . . . . 0.422 ' O ' ' N ' ' A' ' 30' ' ' PHE . 25.1 m-85 -107.97 41.28 1.57 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.175 -0.466 . . . . 70.109999999999999 110.909 -179.94 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 27' ' ' MET . . . . . 0.406 ' C ' ' O ' ' A' ' 26' ' ' TYR . 1.9 mtm -38.08 -52.94 1.42 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.137 -0.483 . . . . 74.420000000000002 110.869 179.907 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -88.83 -33.2 17.47 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.206 -0.452 . . . . 71.109999999999999 110.848 179.979 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -84.5 21.67 1.43 Allowed 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.237 -0.438 . . . . 62.5 110.875 179.997 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 30' ' ' PHE . . . . . 0.532 ' HA ' HD13 ' A' ' 50' ' ' ILE . 0.4 OUTLIER -111.0 128.67 55.92 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.189 -0.46 . . . . 53.119999999999997 110.89 -179.889 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 83.2 m -114.2 133.88 55.3 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.157 -0.474 . . . . 65.010000000000005 111.143 -179.923 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 41.8 t0 -98.11 120.5 38.62 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.213 -0.449 . . . . 71.510000000000005 110.891 179.918 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.941 HD21 HG12 ' A' ' 47' ' ' ILE . 0.2 OUTLIER -121.58 0.73 9.97 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.204 -0.453 . . . . 63.310000000000002 110.89 -179.904 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . 0.787 ' N ' HD23 ' A' ' 33' ' ' LEU . 0.2 OUTLIER . . . . . 0 C--N 1.33 -0.274 0 CA-C-N 116.186 -0.461 . . . . 75.019999999999996 111.184 179.999 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 45' ' ' GLN . . . . . 0.99 ' HG2' HD12 ' A' ' 47' ' ' ILE . 7.4 pt20 . . . . . 0 C--O 1.231 0.127 0 CA-C-O 120.787 0.327 . . . . 75.010000000000005 110.913 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 46' ' ' ILE . . . . . 0.819 HG21 ' HB3' ' A' ' 15' ' ' GLN . 15.4 mm 69.9 75.48 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.177 -0.465 . . . . 63.32 111.153 179.961 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . 0.99 HD12 ' HG2' ' A' ' 45' ' ' GLN . 0.2 OUTLIER -142.52 148.33 20.13 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.171 -0.468 . . . . 73.049999999999997 111.135 179.875 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 48' ' ' PHE . . . . . 0.841 ' HA ' HD22 ' A' ' 33' ' ' LEU . 22.3 p90 -162.14 155.4 20.58 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.146 -0.479 . . . . 63.350000000000001 110.903 179.919 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . 0.601 ' HG3' HD13 ' A' ' 33' ' ' LEU . 13.4 mt-10 -108.44 151.88 25.44 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.199 -0.455 . . . . 74.319999999999993 110.87 -179.901 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . 0.532 HD13 ' HA ' ' A' ' 30' ' ' PHE . 29.9 mm -130.38 135.71 60.06 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.132 -0.486 . . . . 73.010000000000005 111.155 179.958 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 84.8 m -87.19 116.97 25.63 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.208 -0.451 . . . . 60.210000000000001 111.163 179.954 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 18.3 mt -117.0 164.91 13.99 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.241 -0.436 . . . . 71.420000000000002 110.94 179.959 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -175.76 175.84 1.96 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.203 -0.453 . . . . 75.010000000000005 110.865 179.943 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 76.6 p -66.69 -154.3 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.156 -0.474 . . . . 73.340000000000003 110.843 -179.789 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 17.3 m -119.21 -19.64 5.42 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.135 -0.484 . . . . 63.210000000000001 111.123 179.976 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -114.23 178.66 4.2 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.186 -0.461 . . . . 73.430000000000007 110.866 179.911 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . 0.462 ' HD3' ' N ' ' A' ' 57' ' ' LYS . 0.0 OUTLIER -118.24 -5.63 10.88 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.168 -0.469 . . . . 73.310000000000002 110.917 179.974 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . 0.553 ' HA ' ' C ' ' A' ' 59' ' ' PRO . 2.9 pt-20 -135.57 145.65 54.24 Favored Pre-proline 0 C--N 1.329 -0.287 0 CA-C-O 121.654 0.74 . . . . 75.439999999999998 110.91 179.939 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 59' ' ' PRO . . . . . 0.553 ' C ' ' HA ' ' A' ' 58' ' ' GLU . 53.6 Cg_endo -69.78 -6.92 9.73 Favored 'Cis proline' 0 C--N 1.342 0.185 0 C-N-CA 122.654 -1.811 . . . . 33.43 112.332 0.011 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 60' ' ' VAL . . . . . 0.457 ' O ' ' C ' ' A' ' 57' ' ' LYS . 32.3 m -140.89 -174.25 0.75 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.205 -0.452 . . . . 61.219999999999999 111.115 179.954 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . 0.46 ' O ' ' C ' ' A' ' 62' ' ' SER . 7.2 tt0 -119.28 -12.2 9.45 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.182 -0.463 . . . . 73.219999999999999 110.879 -179.965 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 62' ' ' SER . . . . . 0.827 ' CB ' HD11 ' A' ' 125' ' ' LEU . 0.2 OUTLIER 33.8 89.21 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.158 -0.474 . . . . 41.210000000000001 110.888 -179.79 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 5.0 p -119.06 123.63 44.94 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.158 -0.474 . . . . 74.0 110.839 -179.802 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 64' ' ' ILE . . . . . 0.794 HD11 HG21 ' A' ' 89' ' ' VAL . 33.6 mt -135.69 134.96 51.46 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.126 -0.488 . . . . 75.219999999999999 111.131 179.921 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 36.6 m -98.81 113.98 26.34 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.157 -0.474 . . . . 53.439999999999998 111.133 179.969 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . 0.681 HD21 HG21 ' A' ' 121' ' ' THR . 0.4 OUTLIER -94.74 111.37 23.15 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.236 -0.438 . . . . 61.329999999999998 110.899 179.984 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 5.1 t60 -103.38 112.02 24.72 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.217 -0.447 . . . . 72.129999999999995 110.873 179.843 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 68' ' ' PHE . . . . . 0.543 ' CE1' HG23 ' A' ' 114' ' ' ILE . 0.0 OUTLIER -103.76 139.91 38.35 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.227 -0.442 . . . . 74.209999999999994 110.861 -179.897 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 69' ' ' ALA . . . . . 0.777 ' HA ' HG22 ' A' ' 47' ' ' ILE . . . -123.66 116.22 22.73 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.171 -0.468 . . . . 75.540000000000006 111.058 179.94 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 70' ' ' MET . . . . . 0.449 ' HE1' ' CG1' ' A' ' 114' ' ' ILE . 0.0 OUTLIER -79.39 160.58 26.62 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.222 -0.445 . . . . 71.099999999999994 110.852 179.974 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -116.92 161.13 34.01 Favored Pre-proline 0 C--N 1.329 -0.295 0 CA-C-O 121.551 0.691 . . . . 60.32 111.145 -179.904 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.77 3.07 2.99 Favored 'Trans proline' 0 C--N 1.341 0.152 0 C-N-CA 122.702 2.268 . . . . 64.310000000000002 112.335 179.942 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 73' ' ' MET . . . . . 0.495 ' O ' ' CB ' ' A' ' 76' ' ' TYR . 0.5 OUTLIER -122.19 -24.98 4.97 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.201 -0.454 . . . . 73.099999999999994 110.901 179.889 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 74' ' ' TYR . . . . . 0.647 ' CD1' ' C ' ' A' ' 74' ' ' TYR . 0.0 OUTLIER -46.74 149.92 1.38 Allowed Pre-proline 0 C--N 1.329 -0.323 0 CA-C-O 121.698 0.761 . . . . 73.140000000000001 110.929 -179.875 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 75' ' ' PRO . . . . . 0.551 ' C ' ' HA ' ' A' ' 74' ' ' TYR . 53.5 Cg_endo -69.8 -10.31 11.51 Favored 'Cis proline' 0 C--O 1.232 0.198 0 C-N-CA 122.713 -1.786 . . . . 41.530000000000001 112.307 0.007 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 76' ' ' TYR . . . . . 0.495 ' CB ' ' O ' ' A' ' 73' ' ' MET . 24.3 t80 -34.08 -45.84 0.22 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.264 -0.426 . . . . 71.420000000000002 110.914 -179.91 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 77' ' ' THR . . . . . 0.464 HG23 ' HB2' ' A' ' 73' ' ' MET . 28.3 p -108.65 175.39 5.48 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.129 -0.487 . . . . 73.319999999999993 111.162 -179.969 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -100.55 127.69 32.07 Favored Pre-proline 0 C--N 1.329 -0.312 0 CA-C-O 121.541 0.686 . . . . 63.450000000000003 111.131 179.875 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 79' ' ' PRO . . . . . 0.762 ' HG3' HD11 ' A' ' 113' ' ' ILE . 53.8 Cg_endo -69.85 -168.82 0.3 Allowed 'Trans proline' 0 C--N 1.341 0.158 0 C-N-CA 122.656 2.237 . . . . 62.329999999999998 112.304 -179.947 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . 0.475 ' HG3' ' N ' ' A' ' 81' ' ' ILE . 0.3 OUTLIER -129.24 140.92 51.28 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.19 -0.459 . . . . 75.430000000000007 110.91 -179.976 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 81' ' ' ILE . . . . . 0.475 ' N ' ' HG3' ' A' ' 80' ' ' GLU . 3.1 mm -129.03 148.34 33.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.131 -0.486 . . . . 71.140000000000001 111.117 179.985 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . 0.507 ' HG3' ' CD ' ' A' ' 84' ' ' LYS . 4.1 pt-20 -147.83 142.85 27.0 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.195 -0.457 . . . . 62.039999999999999 110.908 179.966 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 83' ' ' PHE . . . . . 0.576 ' CD1' HD11 ' A' ' 66' ' ' LEU . 8.9 m-85 -99.39 138.64 36.19 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.171 -0.468 . . . . 64.439999999999998 110.899 -179.937 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 84' ' ' LYS . . . . . 0.507 ' CD ' ' HG3' ' A' ' 82' ' ' GLU . 7.7 mmmt -125.95 170.48 11.64 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.198 -0.455 . . . . 72.299999999999997 110.893 179.925 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 85' ' ' ASN . . . . . 0.63 HD22 ' N ' ' A' ' 85' ' ' ASN . 0.8 OUTLIER 63.86 -72.97 0.05 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.232 -0.44 . . . . 63.020000000000003 110.889 179.97 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 86' ' ' VAL . . . . . 0.614 ' CG1' HD21 ' A' ' 94' ' ' LEU . 4.7 m 35.62 89.96 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.18 -0.464 . . . . 75.519999999999996 111.098 179.906 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -95.09 -68.14 0.82 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.173 -0.467 . . . . 61.149999999999999 110.862 -179.991 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 88' ' ' ASN . . . . . 0.438 ' ND2' HG11 ' A' ' 60' ' ' VAL . 19.9 t-20 -82.16 40.92 0.65 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.23 -0.441 . . . . 72.420000000000002 110.868 -179.943 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 89' ' ' VAL . . . . . 0.794 HG21 HD11 ' A' ' 64' ' ' ILE . 6.6 t -132.95 149.19 31.54 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.223 -0.444 . . . . 73.030000000000001 111.142 179.902 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 90' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -101.86 -69.52 0.78 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.175 -0.466 . . . . 74.230000000000004 110.843 179.936 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 2.7 p30 -177.31 -43.44 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.208 -0.451 . . . . 72.340000000000003 110.848 -179.975 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -54.22 -38.93 66.23 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.173 -0.467 . . . . 73.0 110.886 -179.794 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 93' ' ' GLN . . . . . 0.54 ' OE1' ' CG ' ' A' ' 128' ' ' PHE . 4.0 tt0 -65.94 -45.18 82.75 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.083 -0.508 . . . . 73.319999999999993 110.932 -179.954 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . 0.614 HD21 ' CG1' ' A' ' 86' ' ' VAL . 80.9 mt -60.51 -48.58 81.14 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.194 -0.457 . . . . 72.239999999999995 110.922 -179.994 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 2.7 mm-40 -63.66 -33.83 76.5 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.215 -0.448 . . . . 63.420000000000002 110.933 179.904 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 96' ' ' MET . . . . . 0.42 ' HE3' ' HG2' ' A' ' 124' ' ' LYS . 11.9 ttp -59.71 -39.49 84.8 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.191 -0.459 . . . . 54.420000000000002 110.901 179.946 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 97' ' ' LEU . . . . . 0.871 HD22 HG22 ' A' ' 121' ' ' THR . 29.1 mt -66.35 -39.13 88.98 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.193 -0.458 . . . . 63.32 110.934 -179.987 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 98' ' ' LYS . . . . . 0.434 ' HD3' ' CZ ' ' A' ' 83' ' ' PHE . 3.0 mmtp -61.62 -34.38 75.57 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.188 -0.46 . . . . 74.299999999999997 110.893 179.796 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 3.1 m -70.34 -45.88 65.28 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.233 -0.439 . . . . 62.240000000000002 110.872 -179.894 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 100' ' ' GLU . . . . . 0.719 ' O ' HD12 ' A' ' 104' ' ' ILE . 11.2 pt-20 -72.56 -23.79 61.03 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.159 -0.473 . . . . 62.520000000000003 110.906 -179.957 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 101' ' ' PHE . . . . . 0.616 ' CD1' ' O ' ' A' ' 97' ' ' LEU . 8.3 m-30 -59.87 -38.02 80.98 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.124 -0.489 . . . . 72.030000000000001 110.856 -179.918 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -62.33 -40.11 95.29 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.16 -0.473 . . . . 73.310000000000002 110.868 179.998 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 103' ' ' LYS . . . . . 0.415 ' O ' HG22 ' A' ' 107' ' ' THR . 4.1 tmmt? -67.57 -39.81 84.89 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.31 -0.405 . . . . 54.140000000000001 110.873 179.877 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 104' ' ' ILE . . . . . 0.719 HD12 ' O ' ' A' ' 100' ' ' GLU . 1.8 mt -62.9 -47.15 94.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.217 -0.447 . . . . 44.420000000000002 111.16 179.861 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 105' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -62.84 -43.07 99.78 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.126 -0.488 . . . . 74.099999999999994 110.868 179.862 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -59.98 -31.04 69.53 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.198 -0.455 . . . . 64.409999999999997 110.907 -179.944 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 107' ' ' THR . . . . . 0.415 HG22 ' O ' ' A' ' 103' ' ' LYS . 10.7 t -97.77 -9.66 26.18 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.15 -0.477 . . . . 73.420000000000002 111.152 -179.957 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 37.5 m -124.58 36.96 4.51 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.193 -0.458 . . . . 54.350000000000001 110.843 -179.827 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -97.18 93.83 6.77 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.155 -0.475 . . . . 75.140000000000001 110.878 -179.941 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 151.67 -13.88 0.79 Allowed Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.713 -0.756 . . . . 74.340000000000003 112.503 -179.954 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 111' ' ' GLN . . . . . . . . . . . . . 1.3 pt20 -132.09 -95.5 0.34 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.769 0.319 . . . . 75.230000000000004 110.884 -179.855 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 26.6 mt-10 -137.47 141.58 41.55 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.181 -0.463 . . . . 52.43 110.918 -179.942 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 113' ' ' ILE . . . . . 0.762 HD11 ' HG3' ' A' ' 79' ' ' PRO . 19.1 pt -124.17 -7.77 7.01 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.134 -0.484 . . . . 73.219999999999999 111.086 -179.977 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 114' ' ' ILE . . . . . 0.659 ' O ' HG23 ' A' ' 118' ' ' THR . 38.6 mm -67.07 -42.17 88.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.178 -0.464 . . . . 74.430000000000007 111.151 179.881 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 115' ' ' PHE . . . . . 0.811 ' HE1' HG21 ' A' ' 25' ' ' ILE . 29.2 t80 -72.53 -40.96 66.35 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.149 -0.478 . . . . 54.109999999999999 110.871 179.938 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 19.5 mm-40 -63.91 -42.57 97.37 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.16 -0.473 . . . . 64.420000000000002 110.923 -179.938 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 117' ' ' ILE . . . . . 0.596 HD11 ' CD2' ' A' ' 101' ' ' PHE . 0.4 OUTLIER -67.22 -41.97 87.37 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.116 -0.493 . . . . 73.329999999999998 111.179 179.952 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 118' ' ' THR . . . . . 0.659 HG23 ' O ' ' A' ' 114' ' ' ILE . 69.0 p -68.33 -43.12 78.26 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.158 -0.474 . . . . 61.539999999999999 111.141 179.903 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -64.51 -43.96 92.43 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.24 -0.436 . . . . 62.420000000000002 110.855 -179.809 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 120' ' ' PHE . . . . . 0.572 ' CD2' HD11 ' A' ' 104' ' ' ILE . 0.1 OUTLIER -63.1 -45.44 92.04 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.097 -0.501 . . . . 65.120000000000005 110.925 -179.986 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 121' ' ' THR . . . . . 0.871 HG22 HD22 ' A' ' 97' ' ' LEU . 25.0 p -69.17 -38.83 78.91 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.15 -0.477 . . . . 74.400000000000006 111.158 -179.982 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -64.21 -38.81 92.37 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.229 -0.441 . . . . 73.120000000000005 110.901 -179.999 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 123' ' ' GLU . . . . . 0.48 ' HG3' ' N ' ' A' ' 124' ' ' LYS . 6.4 pt-20 -77.65 -39.0 46.56 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.232 -0.44 . . . . 62.009999999999998 110.881 -179.925 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 124' ' ' LYS . . . . . 0.48 ' N ' ' HG3' ' A' ' 123' ' ' GLU . 0.1 OUTLIER -70.33 -39.64 74.63 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.214 -0.448 . . . . 73.340000000000003 110.865 179.982 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 125' ' ' LEU . . . . . 0.827 HD11 ' CB ' ' A' ' 62' ' ' SER . 1.3 tp -61.74 -50.43 72.45 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.253 -0.43 . . . . 65.409999999999997 110.928 179.929 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 3.1 t0 -57.84 -39.19 77.11 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.175 -0.466 . . . . 75.310000000000002 110.893 179.8 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 127' ' ' GLU . . . . . 0.463 ' HG3' ' N ' ' A' ' 128' ' ' PHE . 0.0 OUTLIER -63.96 -28.8 70.06 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.156 -0.474 . . . . 64.510000000000005 110.884 -179.879 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 128' ' ' PHE . . . . . 0.54 ' CG ' ' OE1' ' A' ' 93' ' ' GLN . 0.3 OUTLIER . . . . . 0 C--N 1.329 -0.316 0 CA-C-N 116.155 -0.475 . . . . 72.329999999999998 110.905 -179.949 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . 0.675 HD21 ' HE3' ' A' ' 73' ' ' MET . 63.3 mt . . . . . 0 C--O 1.231 0.11 0 CA-C-O 120.806 0.336 . . . . 73.109999999999999 110.88 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 1.2 t70 -50.5 -33.93 23.26 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.208 -0.451 . . . . 62.329999999999998 110.874 179.84 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 59.0 mm-40 -67.65 -36.8 81.42 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.195 -0.457 . . . . 71.430000000000007 110.904 -179.934 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 16.8 m-85 -62.82 -27.67 69.48 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.206 -0.452 . . . . 65.310000000000002 110.916 -179.841 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 1.5 t80 -60.07 -37.77 80.88 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.111 -0.495 . . . . 74.319999999999993 110.955 -179.924 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 2.1 mm-40 -61.47 -45.65 93.35 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.107 -0.497 . . . . 65.329999999999998 110.872 180.0 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 3.7 mp -65.76 -40.73 88.58 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.196 -0.456 . . . . 73.230000000000004 111.145 179.974 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . 0.553 ' HB3' HG21 ' A' ' 46' ' ' ILE . 80.5 mt-30 -59.2 -47.03 86.83 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.197 -0.456 . . . . 61.539999999999999 110.902 179.954 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 4.6 t -63.86 -42.34 97.58 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.21 -0.45 . . . . 62.520000000000003 110.844 -179.924 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -57.8 -33.51 68.66 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.199 -0.455 . . . . 71.450000000000003 110.842 -179.844 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . 0.487 ' OE1' ' CD1' ' A' ' 114' ' ' ILE . 1.4 mm-40 -67.25 -38.72 85.61 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.193 -0.458 . . . . 65.019999999999996 110.908 -179.996 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.456 ' CD2' HG13 ' A' ' 46' ' ' ILE . 8.6 mp -62.63 -51.53 66.9 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.142 -0.481 . . . . 73.25 110.916 179.993 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 1.8 pt-20 -68.72 -31.77 71.08 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.165 -0.47 . . . . 51.340000000000003 110.889 179.964 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -63.93 -48.39 76.75 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.177 -0.465 . . . . 75.319999999999993 111.082 179.928 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . 0.403 HG23 ' CD2' ' A' ' 26' ' ' TYR . 0.7 OUTLIER -76.93 -37.1 26.53 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.234 -0.439 . . . . 72.299999999999997 111.122 179.981 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 2.7 mtt180 -52.55 -34.22 49.14 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.198 -0.456 . . . . 72.239999999999995 110.844 -179.985 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -66.18 -37.81 86.5 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.194 -0.457 . . . . 71.310000000000002 110.874 -179.809 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . 0.742 HG21 ' HE1' ' A' ' 115' ' ' PHE . 3.2 mt -78.81 -45.16 25.11 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.127 -0.488 . . . . 72.219999999999999 111.171 179.922 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 26' ' ' TYR . . . . . 0.403 ' CD2' HG23 ' A' ' 22' ' ' ILE . 17.5 m-85 -106.94 45.11 1.0 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.168 -0.469 . . . . 62.329999999999998 110.916 179.998 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 1.5 mtm -45.15 -61.25 1.72 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.11 -0.496 . . . . 55.119999999999997 110.902 179.871 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 15.6 m-20 -75.5 -28.55 59.22 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.2 -0.454 . . . . 73.030000000000001 110.892 179.95 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -94.2 37.84 1.1 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.153 -0.476 . . . . 53.25 110.871 -179.99 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 30' ' ' PHE . . . . . 0.571 ' HA ' HD13 ' A' ' 50' ' ' ILE . 9.3 t80 -117.71 129.06 55.48 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.191 -0.459 . . . . 74.219999999999999 110.889 -179.908 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 82.7 m -118.13 131.13 56.44 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.167 -0.47 . . . . 72.430000000000007 111.174 -179.962 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 9.4 t0 -105.12 114.46 28.67 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.244 -0.434 . . . . 71.219999999999999 110.833 179.959 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 1.139 HD21 ' CE1' ' A' ' 67' ' ' HIS . 0.2 OUTLIER -111.05 -6.3 14.66 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.208 -0.451 . . . . 65.019999999999996 110.913 -179.965 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . 0.683 ' N ' HD12 ' A' ' 33' ' ' LEU . 0.2 OUTLIER . . . . . 0 C--N 1.329 -0.295 0 CA-C-N 116.198 -0.456 . . . . 72.450000000000003 111.148 179.968 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 45' ' ' GLN . . . . . 0.958 ' HG2' HG23 ' A' ' 47' ' ' ILE . 0.1 OUTLIER . . . . . 0 C--O 1.232 0.175 0 CA-C-O 120.765 0.317 . . . . 62.009999999999998 110.895 . . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 46' ' ' ILE . . . . . 0.674 HG22 ' O ' ' A' ' 45' ' ' GLN . 0.1 OUTLIER 86.82 -16.67 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.222 -0.444 . . . . 50.350000000000001 111.126 179.974 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . 0.958 HG23 ' HG2' ' A' ' 45' ' ' GLN . 0.1 OUTLIER -45.62 149.63 0.31 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-N 116.16 -0.473 . . . . 74.430000000000007 111.105 179.872 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 48' ' ' PHE . . . . . 0.465 ' HA ' ' CD1' ' A' ' 33' ' ' LEU . 27.8 p90 -158.46 171.09 20.79 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.122 -0.49 . . . . 75.230000000000004 110.885 179.936 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . 0.764 ' OE2' HD23 ' A' ' 33' ' ' LEU . 5.8 mt-10 -119.35 161.16 20.94 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.168 -0.469 . . . . 74.230000000000004 110.884 -179.924 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . 0.571 HD13 ' HA ' ' A' ' 30' ' ' PHE . 8.2 mm -142.96 137.43 26.86 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.147 -0.478 . . . . 62.420000000000002 111.087 179.994 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 85.5 m -83.9 131.58 34.85 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.17 -0.468 . . . . 60.130000000000003 111.105 179.971 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . 0.881 HD12 HD12 ' A' ' 66' ' ' LEU . 17.4 mt -134.79 159.5 41.15 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.187 -0.461 . . . . 72.030000000000001 110.873 179.989 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 53' ' ' ARG . . . . . 0.428 ' HD2' ' C ' ' A' ' 52' ' ' LEU . 0.0 OUTLIER 178.82 166.21 0.89 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.156 -0.474 . . . . 75.239999999999995 110.885 179.977 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -57.38 167.3 1.0 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.153 -0.476 . . . . 75.430000000000007 110.841 -179.789 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 19.2 m -78.91 -21.52 12.81 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.111 -0.495 . . . . 73.049999999999997 111.096 179.965 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 2.4 t70 -118.54 -172.05 2.2 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.201 -0.454 . . . . 73.439999999999998 110.837 179.97 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 3.3 mmmm -119.04 -17.51 8.98 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.218 -0.446 . . . . 73.340000000000003 110.919 179.962 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . 0.551 ' HA ' ' C ' ' A' ' 59' ' ' PRO . 4.7 pt-20 -120.08 145.77 40.74 Favored Pre-proline 0 C--N 1.33 -0.28 0 CA-C-O 121.664 0.745 . . . . 63.43 110.868 179.944 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 59' ' ' PRO . . . . . 0.551 ' C ' ' HA ' ' A' ' 58' ' ' GLU . 52.9 Cg_endo -69.81 -14.67 12.59 Favored 'Cis proline' 0 C--N 1.342 0.217 0 C-N-CA 122.697 -1.793 . . . . 74.329999999999998 112.303 0.073 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 60' ' ' VAL . . . . . 0.439 ' HB ' ' CG ' ' A' ' 88' ' ' ASN . 13.3 m -142.37 166.86 15.68 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.261 -0.427 . . . . 73.329999999999998 111.154 179.925 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 26.0 tt0 -102.88 -22.05 13.91 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.191 -0.459 . . . . 71.519999999999996 110.88 -179.952 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 62' ' ' SER . . . . . 0.545 ' HB3' HD11 ' A' ' 125' ' ' LEU . 2.5 m 40.77 92.31 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.205 -0.452 . . . . 73.349999999999994 110.821 -179.783 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 1.1 p -108.95 123.07 48.53 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.12 -0.491 . . . . 63.25 110.886 -179.863 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 64' ' ' ILE . . . . . 0.488 HD11 HG21 ' A' ' 89' ' ' VAL . 41.6 mt -136.98 137.4 46.94 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.115 -0.493 . . . . 70.010000000000005 111.155 179.958 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 16.3 m -101.24 115.69 31.09 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.206 -0.452 . . . . 74.230000000000004 111.17 179.951 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . 0.924 HD21 ' CE1' ' A' ' 83' ' ' PHE . 14.8 mt -95.93 109.24 21.64 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.202 -0.454 . . . . 63.149999999999999 110.909 179.989 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 67' ' ' HIS . . . . . 1.139 ' CE1' HD21 ' A' ' 33' ' ' LEU . 3.6 t60 -101.76 110.46 22.45 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.208 -0.451 . . . . 64.540000000000006 110.813 179.894 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 68' ' ' PHE . . . . . 0.469 ' HA ' ' CG1' ' A' ' 81' ' ' ILE . 0.0 OUTLIER -101.74 138.91 38.09 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.17 -0.468 . . . . 74.319999999999993 110.87 -179.938 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 69' ' ' ALA . . . . . 0.627 ' HA ' HG22 ' A' ' 47' ' ' ILE . . . -118.68 123.56 45.22 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.157 -0.474 . . . . 61.109999999999999 111.119 179.903 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 70' ' ' MET . . . . . 0.669 ' CE ' HD11 ' A' ' 114' ' ' ILE . 7.8 mmt -90.72 89.88 7.7 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.241 -0.436 . . . . 74.310000000000002 110.864 179.99 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -47.06 159.55 0.38 Allowed Pre-proline 0 C--N 1.33 -0.274 0 CA-C-O 121.589 0.709 . . . . 71.230000000000004 111.122 -179.957 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 72' ' ' PRO . . . . . 0.421 ' O ' HD22 ' A' ' 8' ' ' LEU . 53.7 Cg_endo -69.76 2.15 3.79 Favored 'Trans proline' 0 C--N 1.342 0.201 0 C-N-CA 122.66 2.24 . . . . 75.310000000000002 112.348 179.926 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 73' ' ' MET . . . . . 0.675 ' HE3' HD21 ' A' ' 8' ' ' LEU . 0.0 OUTLIER -116.86 -25.82 7.14 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.245 -0.434 . . . . 74.230000000000004 110.873 179.886 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 74' ' ' TYR . . . . . 0.662 ' CD1' ' C ' ' A' ' 74' ' ' TYR . 0.0 OUTLIER -52.24 153.75 4.73 Favored Pre-proline 0 C--N 1.328 -0.364 0 CA-C-O 121.693 0.759 . . . . 72.129999999999995 110.898 -179.846 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 75' ' ' PRO . . . . . 0.534 ' C ' ' HA ' ' A' ' 74' ' ' TYR . 53.6 Cg_endo -69.74 -11.11 11.77 Favored 'Cis proline' 0 C--N 1.341 0.182 0 C-N-CA 122.682 -1.799 . . . . 72.420000000000002 112.359 -0.114 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 76' ' ' TYR . . . . . 0.5 ' CB ' ' O ' ' A' ' 73' ' ' MET . 10.2 t80 -33.91 -57.01 0.47 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.241 -0.436 . . . . 72.150000000000006 110.947 -179.947 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 77' ' ' THR . . . . . 0.669 HG23 ' HB3' ' A' ' 73' ' ' MET . 30.4 p -97.72 -179.66 4.52 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.098 -0.501 . . . . 71.219999999999999 111.089 -179.955 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -94.88 129.25 36.45 Favored Pre-proline 0 C--N 1.329 -0.291 0 CA-C-O 121.623 0.725 . . . . 73.329999999999998 111.068 179.888 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 79' ' ' PRO . . . . . 0.596 ' HG3' HD11 ' A' ' 113' ' ' ILE . 53.4 Cg_endo -69.78 174.09 10.04 Favored 'Trans proline' 0 C--N 1.342 0.205 0 C-N-CA 122.666 2.244 . . . . 62.039999999999999 112.344 -179.988 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . 0.408 ' O ' HG13 ' A' ' 81' ' ' ILE . 3.1 tt0 -118.45 138.54 52.41 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.196 -0.456 . . . . 73.140000000000001 110.874 -179.975 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 81' ' ' ILE . . . . . 0.469 ' CG1' ' HA ' ' A' ' 68' ' ' PHE . 15.0 mt -144.56 148.93 17.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.131 -0.486 . . . . 71.530000000000001 111.118 179.983 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . 0.514 ' HG3' ' CD ' ' A' ' 84' ' ' LYS . 11.3 pt-20 -146.34 148.28 32.21 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.188 -0.46 . . . . 71.049999999999997 110.88 179.953 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 83' ' ' PHE . . . . . 0.924 ' CE1' HD21 ' A' ' 66' ' ' LEU . 49.6 m-85 -90.42 136.68 32.9 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.172 -0.467 . . . . 71.439999999999998 110.915 -179.975 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 84' ' ' LYS . . . . . 0.514 ' CD ' ' HG3' ' A' ' 82' ' ' GLU . 9.4 mmmt -125.82 169.95 12.1 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.12 -0.491 . . . . 74.030000000000001 110.893 -179.996 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 85' ' ' ASN . . . . . 0.469 ' O ' ' C ' ' A' ' 86' ' ' VAL . 5.7 m-80 62.63 -73.03 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.251 -0.431 . . . . 72.150000000000006 110.903 179.981 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 86' ' ' VAL . . . . . 0.654 HG23 ' O ' ' A' ' 86' ' ' VAL . 30.5 m 31.86 91.34 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.226 -0.443 . . . . 73.239999999999995 111.132 179.919 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -96.18 -72.99 0.61 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.172 -0.467 . . . . 64.510000000000005 110.932 -179.98 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 88' ' ' ASN . . . . . 0.439 ' CG ' ' HB ' ' A' ' 60' ' ' VAL . 70.2 m-80 -76.95 54.12 0.99 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.158 -0.473 . . . . 64.340000000000003 110.927 -179.995 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 89' ' ' VAL . . . . . 0.488 HG21 HD11 ' A' ' 64' ' ' ILE . 16.2 t -139.2 154.99 25.95 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.203 -0.453 . . . . 64.310000000000002 111.114 179.954 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 90' ' ' MET . . . . . . . . . . . . . 4.8 mtm -100.95 -69.59 0.77 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.177 -0.465 . . . . 64.120000000000005 110.866 179.938 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 4.3 p-10 173.62 -44.63 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.201 -0.454 . . . . 72.349999999999994 110.86 179.945 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -54.38 -38.69 66.43 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.222 -0.444 . . . . 53.509999999999998 110.857 -179.74 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 93' ' ' GLN . . . . . 0.596 ' OE1' ' CD2' ' A' ' 128' ' ' PHE . 0.0 OUTLIER -66.6 -42.69 86.52 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.169 -0.469 . . . . 43.549999999999997 110.91 -179.969 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 84.1 mt -62.26 -48.29 80.58 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.158 -0.474 . . . . 74.299999999999997 110.927 -179.983 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -65.45 -34.27 77.88 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.205 -0.452 . . . . 75.420000000000002 110.92 179.88 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 96' ' ' MET . . . . . . . . . . . . . 26.8 ttp -59.99 -39.36 85.45 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.194 -0.457 . . . . 44.109999999999999 110.878 179.939 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 97' ' ' LEU . . . . . 0.747 HD22 HG22 ' A' ' 121' ' ' THR . 17.3 mt -66.85 -39.65 87.65 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.243 -0.435 . . . . 55.210000000000001 110.908 -179.98 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 5.2 mmtm -56.29 -38.0 70.63 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.198 -0.455 . . . . 73.420000000000002 110.876 179.853 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 1.7 m -69.58 -39.64 77.2 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.237 -0.438 . . . . 74.329999999999998 110.85 -179.885 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 100' ' ' GLU . . . . . 0.68 ' O ' HD12 ' A' ' 104' ' ' ILE . 68.4 mm-40 -69.22 -24.53 64.03 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.137 -0.483 . . . . 75.209999999999994 110.876 -179.912 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 101' ' ' PHE . . . . . 0.649 ' CG ' HD11 ' A' ' 117' ' ' ILE . 6.9 m-30 -63.0 -32.39 73.74 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.155 -0.475 . . . . 72.010000000000005 110.886 -179.947 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 102' ' ' LYS . . . . . 0.437 ' HE2' ' C ' ' A' ' 102' ' ' LYS . 2.3 ttpt -70.5 -41.79 72.17 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.171 -0.468 . . . . 74.310000000000002 110.893 179.965 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 12.2 ttpt -66.87 -41.17 87.74 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.223 -0.444 . . . . 73.310000000000002 110.912 179.872 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 104' ' ' ILE . . . . . 0.68 HD12 ' O ' ' A' ' 100' ' ' GLU . 3.2 mt -64.84 -47.59 87.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.22 -0.445 . . . . 63.149999999999999 111.112 179.856 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 105' ' ' HIS . . . . . 0.429 ' O ' ' N ' ' A' ' 109' ' ' ARG . 10.1 t60 -62.91 -41.23 99.39 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.224 -0.444 . . . . 74.140000000000001 110.889 179.899 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 106' ' ' ASN . . . . . 0.403 ' ND2' ' HE3' ' A' ' 102' ' ' LYS . 0.4 OUTLIER -59.11 -42.59 90.9 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.217 -0.447 . . . . 65.219999999999999 110.904 -179.962 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 10.4 t -81.97 -27.14 33.38 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.184 -0.462 . . . . 75.420000000000002 111.152 -179.97 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 108' ' ' SER . . . . . 0.515 ' HB2' HG22 ' A' ' 113' ' ' ILE . 40.5 m -107.44 24.31 13.08 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.225 -0.443 . . . . 32.310000000000002 110.839 -179.869 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 109' ' ' ARG . . . . . 0.429 ' N ' ' O ' ' A' ' 105' ' ' HIS . 18.0 ttt180 -71.65 81.76 0.84 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.156 -0.475 . . . . 71.129999999999995 110.861 -179.924 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 155.51 -33.35 0.64 Allowed Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 120.774 -0.727 . . . . 25.420000000000002 112.54 -179.931 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 111' ' ' GLN . . . . . . . . . . . . . 10.5 pt20 -112.09 -158.72 0.66 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.746 0.308 . . . . 65.230000000000004 110.92 -179.862 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 4.0 mt-10 -69.85 136.65 50.97 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.242 -0.435 . . . . 61.549999999999997 110.871 -179.943 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 113' ' ' ILE . . . . . 0.596 HD11 ' HG3' ' A' ' 79' ' ' PRO . 2.3 pt -123.95 -6.73 7.21 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.108 -0.496 . . . . 74.230000000000004 111.095 179.998 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 114' ' ' ILE . . . . . 0.868 ' H ' HD12 ' A' ' 114' ' ' ILE . 3.5 mp -68.22 -46.66 80.74 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-N 116.194 -0.457 . . . . 65.439999999999998 111.155 179.834 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 115' ' ' PHE . . . . . 0.742 ' HE1' HG21 ' A' ' 25' ' ' ILE . 11.4 t80 -65.19 -37.46 87.42 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.142 -0.481 . . . . 72.219999999999999 110.916 179.91 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 6.6 mm-40 -67.87 -45.24 75.11 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.106 -0.497 . . . . 74.430000000000007 110.897 -179.947 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 117' ' ' ILE . . . . . 0.649 HD11 ' CG ' ' A' ' 101' ' ' PHE . 0.4 OUTLIER -67.55 -40.92 85.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.157 -0.474 . . . . 73.340000000000003 111.085 -179.981 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 118' ' ' THR . . . . . 0.69 HG23 ' O ' ' A' ' 114' ' ' ILE . 81.3 p -68.79 -43.49 75.59 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.204 -0.453 . . . . 73.340000000000003 111.134 179.978 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 3.3 t -68.1 -44.42 76.24 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.262 -0.427 . . . . 64.140000000000001 110.836 -179.832 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 4.6 t80 -62.9 -45.2 93.63 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.146 -0.479 . . . . 75.420000000000002 110.887 -179.939 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 121' ' ' THR . . . . . 0.747 HG22 HD22 ' A' ' 97' ' ' LEU . 17.1 p -66.23 -45.32 81.06 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.099 -0.5 . . . . 74.099999999999994 111.138 -179.892 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 40.8 tt0 -65.26 -43.81 90.08 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.266 -0.425 . . . . 73.510000000000005 110.902 -179.99 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 11.1 pt-20 -70.61 -28.8 65.12 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.178 -0.465 . . . . 62.310000000000002 110.895 -179.945 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 124' ' ' LYS . . . . . 0.463 ' CE ' ' HA ' ' A' ' 124' ' ' LYS . 0.2 OUTLIER -78.99 -40.86 30.46 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.173 -0.467 . . . . 74.120000000000005 110.894 179.921 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 125' ' ' LEU . . . . . 0.641 HD23 ' O ' ' A' ' 125' ' ' LEU . 0.7 OUTLIER -69.98 -38.1 75.93 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.236 -0.438 . . . . 61.350000000000001 110.949 179.906 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -66.7 -46.31 75.97 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.185 -0.461 . . . . 73.439999999999998 110.837 179.866 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 127' ' ' GLU . . . . . 0.443 ' OE1' ' C ' ' A' ' 127' ' ' GLU . 1.6 pp20? -65.88 -28.19 68.77 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.185 -0.461 . . . . 72.420000000000002 110.873 -179.885 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 128' ' ' PHE . . . . . 0.596 ' CD2' ' OE1' ' A' ' 93' ' ' GLN . 0.2 OUTLIER . . . . . 0 C--N 1.329 -0.311 0 CA-C-N 116.144 -0.48 . . . . 72.549999999999997 110.9 -179.913 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . 0.585 HD21 ' CE ' ' A' ' 73' ' ' MET . 60.4 mt . . . . . 0 C--O 1.231 0.109 0 CA-C-O 120.829 0.347 . . . . 74.230000000000004 110.903 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . 0.437 ' O ' ' HB2' ' A' ' 12' ' ' TYR . 16.3 t70 -50.51 -33.38 21.28 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.21 -0.45 . . . . 51.530000000000001 110.841 179.831 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 2.3 mm-40 -70.11 -40.76 74.69 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.19 -0.459 . . . . 74.409999999999997 110.914 -179.865 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 12.7 m-85 -50.99 -24.72 3.92 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.199 -0.455 . . . . 72.409999999999997 110.929 -179.872 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 12' ' ' TYR . . . . . 0.437 ' HB2' ' O ' ' A' ' 9' ' ' ASP . 0.1 OUTLIER -59.17 -36.23 74.94 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.127 -0.488 . . . . 74.340000000000003 110.919 -179.947 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . 0.505 ' HG3' ' N ' ' A' ' 14' ' ' ILE . 6.5 pt-20 -60.28 -42.87 96.36 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.12 -0.491 . . . . 63.140000000000001 110.901 -179.938 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 14' ' ' ILE . . . . . 0.505 ' N ' ' HG3' ' A' ' 13' ' ' GLU . 3.9 mp -68.46 -39.95 81.46 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.144 -0.48 . . . . 71.099999999999994 111.149 179.927 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . 0.481 ' HG2' ' CE1' ' A' ' 74' ' ' TYR . 79.8 mt-30 -63.63 -48.28 77.91 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.175 -0.466 . . . . 50.409999999999997 110.888 179.941 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -64.84 -39.18 93.15 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.211 -0.449 . . . . 55.030000000000001 110.95 -179.958 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -59.08 -33.82 71.26 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.183 -0.462 . . . . 75.109999999999999 110.902 -179.927 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 2.1 mm-40 -66.61 -41.01 89.04 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.152 -0.477 . . . . 71.519999999999996 110.892 179.972 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.866 HD11 HG13 ' A' ' 46' ' ' ILE . 6.0 mt -59.96 -51.39 69.88 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.164 -0.471 . . . . 64.310000000000002 110.898 -179.941 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 5.0 pt-20 -68.34 -34.95 77.02 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.191 -0.459 . . . . 75.329999999999998 110.891 179.916 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -62.76 -50.6 70.41 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.157 -0.474 . . . . 74.340000000000003 111.099 179.923 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . 0.737 ' HA ' HD12 ' A' ' 25' ' ' ILE . 0.6 OUTLIER -77.65 -34.27 20.03 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.155 -0.475 . . . . 64.109999999999999 111.151 179.991 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 1.6 mtt180 -52.25 -35.23 49.23 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.202 -0.454 . . . . 64.340000000000003 110.887 179.94 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -67.23 -29.14 68.71 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.167 -0.47 . . . . 63.32 110.857 -179.743 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . 0.93 HD13 ' CE1' ' A' ' 115' ' ' PHE . 4.5 mt -84.49 -45.21 17.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.092 -0.504 . . . . 61.130000000000003 111.163 179.896 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 16.1 m-85 -110.38 46.69 1.02 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.196 -0.456 . . . . 75.140000000000001 110.904 -179.975 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 5.1 mtm -43.95 -61.83 1.32 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.114 -0.494 . . . . 64.5 110.9 179.897 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -82.7 -19.28 38.36 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.235 -0.438 . . . . 64.219999999999999 110.894 179.924 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 45.2 m-20 -100.55 37.15 1.75 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.209 -0.45 . . . . 74.200000000000003 110.885 179.967 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 30' ' ' PHE . . . . . 0.409 ' HA ' HD13 ' A' ' 50' ' ' ILE . 3.9 t80 -125.5 126.28 44.61 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.186 -0.461 . . . . 74.230000000000004 110.869 -179.898 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 52.7 m -118.1 133.27 56.06 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.167 -0.47 . . . . 74.129999999999995 111.116 -179.958 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 5.7 t0 -103.74 114.32 28.49 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.236 -0.438 . . . . 74.540000000000006 110.892 179.863 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.727 HD12 ' N ' ' A' ' 34' ' ' THR . 0.2 OUTLIER -103.34 -5.44 22.99 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.182 -0.463 . . . . 74.109999999999999 110.885 -179.91 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . 0.727 ' N ' HD12 ' A' ' 33' ' ' LEU . 0.3 OUTLIER . . . . . 0 C--N 1.329 -0.302 0 CA-C-N 116.198 -0.456 . . . . 72.349999999999994 111.143 179.933 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 45' ' ' GLN . . . . . 0.839 ' HG2' HG23 ' A' ' 47' ' ' ILE . 18.0 pt20 . . . . . 0 C--O 1.232 0.145 0 CA-C-O 120.768 0.318 . . . . 51.340000000000003 110.906 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 46' ' ' ILE . . . . . 0.866 HG13 HD11 ' A' ' 19' ' ' LEU . 0.0 OUTLIER 84.83 -24.46 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.236 -0.438 . . . . 74.310000000000002 111.089 179.946 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . 0.839 HG23 ' HG2' ' A' ' 45' ' ' GLN . 0.2 OUTLIER -32.7 143.66 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.181 -0.463 . . . . 75.540000000000006 111.154 179.864 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 11.8 p90 -156.92 174.43 15.52 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.216 -0.447 . . . . 64.409999999999997 110.873 179.958 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . 0.466 ' CG ' ' HB2' ' A' ' 67' ' ' HIS . 6.3 mt-10 -123.54 161.03 25.73 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.146 -0.479 . . . . 74.230000000000004 110.888 -179.908 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . 0.411 HD13 ' HA ' ' A' ' 50' ' ' ILE . 13.6 mm -138.04 129.34 38.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.171 -0.468 . . . . 71.450000000000003 111.084 -179.988 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 89.3 m -84.01 121.91 28.04 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.142 -0.481 . . . . 72.129999999999995 111.141 179.932 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . 0.725 HD12 HD12 ' A' ' 66' ' ' LEU . 27.4 mt -121.56 166.06 14.77 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.23 -0.441 . . . . 54.350000000000001 110.941 179.935 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 53' ' ' ARG . . . . . 0.508 ' C ' HD21 ' A' ' 125' ' ' LEU . 18.8 ptt180 -179.31 164.79 1.39 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.206 -0.452 . . . . 63.109999999999999 110.85 179.97 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . 0.735 ' N ' HD21 ' A' ' 125' ' ' LEU . 1.7 m -60.65 167.8 2.52 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.164 -0.471 . . . . 54.539999999999999 110.867 -179.809 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 27.5 m -76.9 -24.72 15.42 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.119 -0.491 . . . . 61.32 111.155 179.93 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 3.2 t0 -120.5 -171.97 2.28 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.147 -0.479 . . . . 73.329999999999998 110.845 179.936 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 7.4 mmmt -116.11 -20.53 9.83 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.141 -0.481 . . . . 74.120000000000005 110.888 179.969 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . 0.558 ' HA ' ' C ' ' A' ' 59' ' ' PRO . 6.3 pt-20 -115.15 144.38 32.05 Favored Pre-proline 0 C--N 1.329 -0.298 0 CA-C-O 121.674 0.749 . . . . 73.430000000000007 110.831 179.959 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 59' ' ' PRO . . . . . 0.558 ' C ' ' HA ' ' A' ' 58' ' ' GLU . 53.5 Cg_endo -69.79 -13.88 12.5 Favored 'Cis proline' 0 C--N 1.342 0.192 0 C-N-CA 122.683 -1.799 . . . . 74.530000000000001 112.308 -0.017 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 60' ' ' VAL . . . . . 0.437 ' HB ' ' CG ' ' A' ' 88' ' ' ASN . 10.2 m -147.32 171.3 3.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-N 116.266 -0.424 . . . . 65.409999999999997 111.148 179.892 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . 0.462 ' O ' ' C ' ' A' ' 62' ' ' SER . 1.4 pt-20 -107.1 -18.41 13.9 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.165 -0.47 . . . . 72.420000000000002 110.914 179.967 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 62' ' ' SER . . . . . 0.738 ' HB2' HD11 ' A' ' 125' ' ' LEU . 71.1 m 32.72 90.55 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.143 -0.481 . . . . 52.119999999999997 110.915 -179.821 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 26.8 t -107.75 123.16 48.13 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.131 -0.486 . . . . 72.310000000000002 110.866 -179.802 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 64' ' ' ILE . . . . . 0.949 HD11 HG21 ' A' ' 89' ' ' VAL . 35.8 mt -134.77 135.39 53.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-N 116.125 -0.489 . . . . 74.540000000000006 111.161 179.921 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 53.1 m -104.98 114.58 28.88 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.171 -0.468 . . . . 63.549999999999997 111.078 -179.947 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . 0.725 HD12 HD12 ' A' ' 52' ' ' LEU . 19.9 mt -91.46 109.8 21.09 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.234 -0.439 . . . . 53.119999999999997 110.913 179.929 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 67' ' ' HIS . . . . . 0.617 ' CE1' HD21 ' A' ' 33' ' ' LEU . 0.8 OUTLIER -90.25 109.48 20.57 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.18 -0.464 . . . . 74.219999999999999 110.855 179.844 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 68' ' ' PHE . . . . . 0.672 ' HD2' HD12 ' A' ' 81' ' ' ILE . 0.0 OUTLIER -104.33 139.54 39.17 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.219 -0.446 . . . . 74.439999999999998 110.872 -179.904 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 69' ' ' ALA . . . . . 0.427 ' O ' ' CB ' ' A' ' 79' ' ' PRO . . . -121.84 129.33 52.52 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.149 -0.478 . . . . 62.439999999999998 111.085 179.942 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 70' ' ' MET . . . . . 0.521 ' CE ' HD11 ' A' ' 114' ' ' ILE . 1.0 OUTLIER -100.64 102.61 13.78 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.219 -0.446 . . . . 74.099999999999994 110.898 179.929 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -58.66 160.12 11.08 Favored Pre-proline 0 C--N 1.329 -0.283 0 CA-C-O 121.595 0.712 . . . . 71.230000000000004 111.137 -179.908 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.75 -2.2 9.76 Favored 'Trans proline' 0 C--N 1.341 0.162 0 C-N-CA 122.706 2.271 . . . . 73.430000000000007 112.333 179.992 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 73' ' ' MET . . . . . 0.954 ' HG2' HG23 ' A' ' 77' ' ' THR . 2.0 ttm -117.58 -18.28 9.77 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.232 -0.44 . . . . 71.540000000000006 110.889 179.886 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 74' ' ' TYR . . . . . 0.685 ' CD1' ' C ' ' A' ' 74' ' ' TYR . 0.0 OUTLIER -58.58 162.28 6.73 Favored Pre-proline 0 C--N 1.328 -0.354 0 CA-C-O 121.729 0.776 . . . . 71.129999999999995 110.875 -179.832 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 75' ' ' PRO . . . . . 0.552 ' HA ' ' CD2' ' A' ' 74' ' ' TYR . 53.3 Cg_endo -69.75 -4.83 8.52 Favored 'Cis proline' 0 C--N 1.341 0.156 0 C-N-CA 122.678 -1.801 . . . . 71.450000000000003 112.343 -0.087 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 76' ' ' TYR . . . . . 0.447 ' N ' ' HA ' ' A' ' 74' ' ' TYR . 0.3 OUTLIER -35.95 -60.49 0.54 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.199 -0.455 . . . . 74.430000000000007 110.877 -179.912 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 77' ' ' THR . . . . . 0.954 HG23 ' HG2' ' A' ' 73' ' ' MET . 33.6 p -88.08 -170.57 3.03 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.141 -0.481 . . . . 71.409999999999997 111.123 -179.973 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -105.01 123.1 40.93 Favored Pre-proline 0 C--N 1.33 -0.282 0 CA-C-O 121.593 0.711 . . . . 54.530000000000001 111.069 179.878 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 79' ' ' PRO . . . . . 0.634 ' HG3' HD11 ' A' ' 113' ' ' ILE . 53.8 Cg_endo -69.79 -165.46 0.16 Allowed 'Trans proline' 0 C--N 1.341 0.176 0 C-N-CA 122.696 2.264 . . . . 74.230000000000004 112.339 179.952 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . 0.463 ' HG3' ' N ' ' A' ' 81' ' ' ILE . 1.5 tt0 -128.0 141.7 51.44 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.19 -0.459 . . . . 73.150000000000006 110.846 -179.968 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 81' ' ' ILE . . . . . 0.672 HD12 ' HD2' ' A' ' 68' ' ' PHE . 9.1 mm -138.41 138.09 43.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.113 -0.494 . . . . 71.430000000000007 111.109 179.969 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . 0.492 ' HG3' ' CD ' ' A' ' 84' ' ' LYS . 4.4 pt-20 -147.7 144.69 28.5 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.144 -0.48 . . . . 63.240000000000002 110.885 179.958 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 83' ' ' PHE . . . . . 0.745 ' HD2' HG21 ' A' ' 64' ' ' ILE . 1.8 m-85 -95.16 139.82 30.95 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.156 -0.474 . . . . 71.25 110.922 -179.943 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 84' ' ' LYS . . . . . 0.492 ' CD ' ' HG3' ' A' ' 82' ' ' GLU . 10.6 mmmt -124.64 175.26 7.31 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.164 -0.471 . . . . 72.329999999999998 110.888 -179.998 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 3.9 m-80 61.63 -75.01 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.223 -0.444 . . . . 65.319999999999993 110.914 179.956 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 86' ' ' VAL . . . . . 0.472 ' N ' ' O ' ' A' ' 84' ' ' LYS . 4.2 m 37.4 87.04 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.178 -0.465 . . . . 64.310000000000002 111.141 179.878 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -98.74 -69.15 0.77 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.207 -0.452 . . . . 74.340000000000003 110.889 -179.98 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 88' ' ' ASN . . . . . 0.437 ' CG ' ' HB ' ' A' ' 60' ' ' VAL . 62.3 m-80 -83.28 42.24 0.81 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.248 -0.433 . . . . 54.409999999999997 110.889 -179.978 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 89' ' ' VAL . . . . . 0.949 HG21 HD11 ' A' ' 64' ' ' ILE . 38.7 t -134.48 146.75 30.51 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.191 -0.459 . . . . 75.349999999999994 111.143 179.923 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 90' ' ' MET . . . . . . . . . . . . . 16.5 mtm -96.51 -70.99 0.69 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.144 -0.48 . . . . 74.409999999999997 110.876 179.918 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER 171.29 -31.62 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.192 -0.458 . . . . 73.0 110.92 179.993 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -55.96 -46.66 78.53 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.157 -0.474 . . . . 63.340000000000003 110.879 -179.776 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 93' ' ' GLN . . . . . 0.657 ' CD ' HG13 ' A' ' 89' ' ' VAL . 3.4 pt20 -70.56 -40.75 73.16 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.155 -0.475 . . . . 74.540000000000006 110.935 179.991 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . 0.699 ' HG ' HG11 ' A' ' 89' ' ' VAL . 54.8 mt -57.81 -48.98 78.15 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.159 -0.473 . . . . 65.219999999999999 110.914 -179.963 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -65.86 -33.83 76.74 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.151 -0.477 . . . . 64.120000000000005 110.879 179.949 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 96' ' ' MET . . . . . 0.485 ' HG2' ' N ' ' A' ' 97' ' ' LEU . 0.0 OUTLIER -59.73 -36.49 76.68 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.213 -0.448 . . . . 75.230000000000004 110.867 179.98 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 97' ' ' LEU . . . . . 0.558 HD13 HG22 ' A' ' 121' ' ' THR . 17.0 mt -69.01 -41.68 77.42 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.194 -0.457 . . . . 73.140000000000001 110.925 -179.962 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -55.04 -36.65 65.76 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.159 -0.473 . . . . 73.439999999999998 110.895 179.864 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -67.46 -43.38 81.2 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.226 -0.443 . . . . 55.350000000000001 110.883 -179.948 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 100' ' ' GLU . . . . . 0.4 ' O ' HD12 ' A' ' 104' ' ' ILE . 1.9 mp0 -71.92 -25.22 61.82 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.119 -0.491 . . . . 72.140000000000001 110.87 -179.953 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 101' ' ' PHE . . . . . 0.645 ' CD2' HD11 ' A' ' 117' ' ' ILE . 10.8 m-30 -59.51 -26.84 65.64 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.188 -0.46 . . . . 71.049999999999997 110.897 -179.944 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 102' ' ' LYS . . . . . 0.428 ' HE2' ' C ' ' A' ' 102' ' ' LYS . 0.2 OUTLIER -72.18 -41.72 66.69 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.141 -0.482 . . . . 74.129999999999995 110.875 179.967 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.39 -40.48 73.92 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.244 -0.434 . . . . 72.25 110.869 179.895 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 104' ' ' ILE . . . . . 0.661 HD11 ' CD2' ' A' ' 120' ' ' PHE . 4.0 mt -62.46 -47.11 94.55 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-N 116.245 -0.434 . . . . 74.120000000000005 111.093 179.881 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 105' ' ' HIS . . . . . 0.48 ' CE1' ' HG3' ' A' ' 109' ' ' ARG . 16.8 t60 -62.97 -41.0 99.4 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.184 -0.462 . . . . 75.430000000000007 110.865 179.91 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 1.1 t-20 -59.51 -38.25 80.46 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.205 -0.452 . . . . 60.539999999999999 110.927 -179.945 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 107' ' ' THR . . . . . 0.405 HG22 ' O ' ' A' ' 104' ' ' ILE . 6.8 t -83.21 -27.95 29.62 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.155 -0.475 . . . . 75.430000000000007 111.096 179.995 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 1.6 m -112.89 46.7 1.18 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.278 -0.419 . . . . 72.109999999999999 110.85 -179.837 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 109' ' ' ARG . . . . . 0.48 ' HG3' ' CE1' ' A' ' 105' ' ' HIS . 2.7 ttp-105 -97.89 84.5 3.34 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.143 -0.481 . . . . 72.120000000000005 110.873 -179.976 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 110' ' ' GLY . . . . . 0.421 ' HA2' ' CG ' ' A' ' 75' ' ' PRO . . . 137.99 1.3 2.35 Favored Glycine 0 N--CA 1.452 -0.296 0 C-N-CA 120.768 -0.73 . . . . 71.530000000000001 112.488 -179.981 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 111' ' ' GLN . . . . . 0.505 ' O ' ' CG ' ' A' ' 112' ' ' GLU . 11.4 mm-40 -127.64 -75.11 0.57 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.732 0.301 . . . . 75.450000000000003 110.934 -179.923 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 112' ' ' GLU . . . . . 0.505 ' CG ' ' O ' ' A' ' 111' ' ' GLN . 31.0 mt-10 -163.6 141.74 7.68 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.223 -0.444 . . . . 63.420000000000002 110.875 -179.945 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 113' ' ' ILE . . . . . 0.634 HD11 ' HG3' ' A' ' 79' ' ' PRO . 21.7 pt -128.34 -10.93 3.4 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.118 -0.492 . . . . 71.150000000000006 111.16 179.963 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 114' ' ' ILE . . . . . 0.759 ' O ' HG23 ' A' ' 118' ' ' THR . 25.5 mm -66.87 -44.72 88.75 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.148 -0.478 . . . . 71.430000000000007 111.149 179.846 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 115' ' ' PHE . . . . . 0.93 ' CE1' HD13 ' A' ' 25' ' ' ILE . 11.3 t80 -72.55 -37.04 68.37 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.141 -0.481 . . . . 73.430000000000007 110.873 179.976 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 6.7 mm-40 -67.39 -45.51 76.0 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.141 -0.481 . . . . 73.549999999999997 110.901 -179.924 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 117' ' ' ILE . . . . . 0.645 HD11 ' CD2' ' A' ' 101' ' ' PHE . 1.0 OUTLIER -66.91 -42.12 88.48 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.101 -0.499 . . . . 73.340000000000003 111.137 179.97 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 118' ' ' THR . . . . . 0.759 HG23 ' O ' ' A' ' 114' ' ' ILE . 79.8 p -68.21 -40.16 82.19 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.172 -0.467 . . . . 70.510000000000005 111.132 179.953 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 4.5 t -68.03 -44.03 77.39 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.226 -0.443 . . . . 71.230000000000004 110.857 -179.82 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 120' ' ' PHE . . . . . 0.661 ' CD2' HD11 ' A' ' 104' ' ' ILE . 0.3 OUTLIER -60.5 -46.23 90.9 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.111 -0.495 . . . . 63.399999999999999 110.868 -179.928 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 121' ' ' THR . . . . . 0.713 HG21 HD11 ' A' ' 66' ' ' LEU . 44.4 p -69.34 -39.09 78.37 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.183 -0.462 . . . . 72.0 111.132 -179.921 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 2.4 tt0 -67.24 -39.68 86.21 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.251 -0.431 . . . . 75.299999999999997 110.946 179.958 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 123' ' ' GLU . . . . . 0.502 ' HG3' ' N ' ' A' ' 124' ' ' LYS . 10.1 pt-20 -73.83 -40.47 63.31 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.167 -0.47 . . . . 61.43 110.889 -179.946 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 124' ' ' LYS . . . . . 0.502 ' N ' ' HG3' ' A' ' 123' ' ' GLU . 2.0 mmpt? -78.73 -19.52 52.14 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.174 -0.466 . . . . 63.539999999999999 110.894 179.949 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 125' ' ' LEU . . . . . 0.738 HD11 ' HB2' ' A' ' 62' ' ' SER . 1.9 tp -69.49 -52.45 26.46 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.255 -0.429 . . . . 54.530000000000001 110.941 179.863 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 10.7 t70 -69.51 -36.86 76.84 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.199 -0.455 . . . . 63.210000000000001 110.826 179.854 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 127' ' ' GLU . . . . . 0.471 ' HG3' ' N ' ' A' ' 128' ' ' PHE . 0.4 OUTLIER -59.73 -36.22 76.14 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.221 -0.445 . . . . 71.140000000000001 110.858 -179.865 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 128' ' ' PHE . . . . . 0.601 ' CE2' ' OE1' ' A' ' 93' ' ' GLN . 0.0 OUTLIER . . . . . 0 C--N 1.328 -0.33 0 CA-C-N 116.15 -0.477 . . . . 62.130000000000003 110.894 -179.927 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . 0.618 HD13 ' O ' ' A' ' 72' ' ' PRO . 20.5 mt . . . . . 0 C--O 1.231 0.093 0 CA-C-O 120.767 0.318 . . . . 72.400000000000006 110.91 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 9.3 t0 -55.13 -34.97 64.2 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.202 -0.454 . . . . 74.299999999999997 110.862 179.856 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 94.2 mm-40 -63.59 -35.78 81.63 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.223 -0.444 . . . . 73.040000000000006 110.859 -179.891 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 21.6 m-85 -65.77 -24.97 67.05 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.236 -0.438 . . . . 74.439999999999998 110.897 -179.853 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -58.93 -41.05 86.43 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.167 -0.47 . . . . 74.010000000000005 110.893 -179.898 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 2.0 mm-40 -59.65 -45.94 90.51 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.142 -0.481 . . . . 72.400000000000006 110.904 -179.964 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 14' ' ' ILE . . . . . 0.528 HG22 ' OE2' ' A' ' 18' ' ' GLU . 4.2 mp -68.03 -41.08 84.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.138 -0.483 . . . . 70.329999999999998 111.145 179.955 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . 0.446 ' HB3' HG21 ' A' ' 46' ' ' ILE . 57.1 mt-30 -62.79 -48.06 80.77 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.192 -0.458 . . . . 72.340000000000003 110.944 179.922 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -61.84 -45.1 95.28 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.152 -0.477 . . . . 65.099999999999994 110.887 -179.981 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -57.84 -33.82 69.05 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.215 -0.448 . . . . 73.439999999999998 110.883 -179.907 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . 0.528 ' OE2' HG22 ' A' ' 14' ' ' ILE . 2.9 mt-10 -64.03 -38.62 91.72 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.197 -0.456 . . . . 64.340000000000003 110.887 -179.96 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 7.8 mp -66.06 -51.52 57.4 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.116 -0.493 . . . . 75.430000000000007 110.95 179.986 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 1.5 pt-20 -68.91 -33.77 74.3 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.145 -0.479 . . . . 70.109999999999999 110.869 179.948 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -65.98 -50.04 65.71 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.21 -0.45 . . . . 43.200000000000003 111.122 179.896 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . 0.781 ' HA ' HD12 ' A' ' 25' ' ' ILE . 0.7 OUTLIER -72.19 -34.16 48.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.22 -0.446 . . . . 60.100000000000001 111.166 179.975 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -52.39 -36.19 53.46 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.164 -0.471 . . . . 73.299999999999997 110.899 179.931 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -67.27 -30.23 70.06 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.165 -0.47 . . . . 52.340000000000003 110.799 -179.777 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . 0.919 HD13 ' CE1' ' A' ' 115' ' ' PHE . 4.3 mt -83.31 -45.21 18.8 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.141 -0.481 . . . . 61.420000000000002 111.112 179.976 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 25.7 m-85 -108.5 42.25 1.43 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.168 -0.469 . . . . 65.230000000000004 110.923 -179.96 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER -40.12 -59.07 1.32 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.128 -0.487 . . . . 75.200000000000003 110.887 179.884 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -86.14 -20.89 27.97 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.25 -0.432 . . . . 64.319999999999993 110.834 179.99 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 42.4 m-20 -96.29 34.79 1.54 Allowed 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.204 -0.453 . . . . 72.349999999999994 110.864 -179.996 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 16.1 t80 -118.67 138.48 52.59 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.215 -0.448 . . . . 74.310000000000002 110.899 -179.928 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 94.7 m -117.66 134.11 55.24 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.145 -0.48 . . . . 74.099999999999994 111.116 -179.894 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -101.23 118.51 37.13 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.249 -0.432 . . . . 74.219999999999999 110.901 179.923 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.981 HD21 HG12 ' A' ' 47' ' ' ILE . 0.4 OUTLIER -125.69 -5.68 6.95 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.235 -0.438 . . . . 74.310000000000002 110.916 -179.94 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . 0.609 ' N ' HD23 ' A' ' 33' ' ' LEU . 0.2 OUTLIER . . . . . 0 C--N 1.33 -0.27 0 CA-C-N 116.171 -0.468 . . . . 64.530000000000001 111.141 179.914 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 45' ' ' GLN . . . . . 0.733 ' HG2' HG23 ' A' ' 47' ' ' ILE . 26.3 pt20 . . . . . 0 C--O 1.232 0.162 0 CA-C-O 120.719 0.295 . . . . 70.200000000000003 110.905 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 46' ' ' ILE . . . . . 0.616 HG22 ' O ' ' A' ' 45' ' ' GLN . 0.1 OUTLIER 84.72 -1.27 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 116.235 -0.439 . . . . 62.109999999999999 111.144 179.963 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . 0.981 HG12 HD21 ' A' ' 33' ' ' LEU . 0.3 OUTLIER -62.61 146.83 12.27 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.167 -0.47 . . . . 73.209999999999994 111.137 179.846 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 48' ' ' PHE . . . . . 0.835 ' HA ' HD22 ' A' ' 33' ' ' LEU . 3.6 p90 -151.05 153.8 35.78 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.174 -0.466 . . . . 72.25 110.876 179.943 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . 0.705 ' HG3' HD13 ' A' ' 33' ' ' LEU . 10.7 mt-10 -108.52 143.85 36.98 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.117 -0.492 . . . . 73.140000000000001 110.864 -179.88 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 30.8 mm -125.94 131.74 71.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.176 -0.466 . . . . 73.200000000000003 111.155 179.95 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 85.2 m -85.1 125.6 32.91 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.187 -0.46 . . . . 72.400000000000006 111.137 179.975 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . 0.873 HD12 HD12 ' A' ' 66' ' ' LEU . 19.9 mt -122.52 164.89 17.29 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.184 -0.462 . . . . 62.009999999999998 110.889 179.988 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER 179.11 172.87 0.81 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.205 -0.452 . . . . 74.230000000000004 110.861 179.954 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -62.91 170.96 2.38 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.2 -0.454 . . . . 70.409999999999997 110.843 -179.799 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 55' ' ' VAL . . . . . 0.536 HG13 HE22 ' A' ' 122' ' ' GLN . 21.8 m -84.85 -24.2 7.21 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 116.14 -0.482 . . . . 55.109999999999999 111.143 179.964 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -117.83 -172.72 2.3 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.176 -0.466 . . . . 62.409999999999997 110.868 179.92 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -115.19 -12.58 11.85 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.222 -0.444 . . . . 74.340000000000003 110.914 -179.972 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . 0.545 ' HA ' ' C ' ' A' ' 59' ' ' PRO . 6.3 pm0 -126.79 149.45 68.67 Favored Pre-proline 0 C--N 1.33 -0.257 0 CA-C-O 121.674 0.75 . . . . 61.140000000000001 110.879 179.929 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 59' ' ' PRO . . . . . 0.545 ' C ' ' HA ' ' A' ' 58' ' ' GLU . 53.3 Cg_endo -69.8 -8.83 10.78 Favored 'Cis proline' 0 C--N 1.342 0.219 0 C-N-CA 122.674 -1.802 . . . . 72.230000000000004 112.303 0.076 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 60' ' ' VAL . . . . . 0.439 HG21 ' CG ' ' A' ' 88' ' ' ASN . 22.3 m -142.51 165.26 16.8 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.197 -0.456 . . . . 41.049999999999997 111.093 179.923 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . 0.405 ' O ' ' O ' ' A' ' 62' ' ' SER . 7.5 tt0 -93.58 -25.05 17.71 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.143 -0.481 . . . . 74.140000000000001 110.848 -179.918 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 62' ' ' SER . . . . . 0.405 ' O ' ' O ' ' A' ' 61' ' ' GLU . 0.5 OUTLIER 41.63 94.15 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.185 -0.461 . . . . 74.200000000000003 110.836 -179.79 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 9.2 p -116.57 122.74 45.52 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.145 -0.48 . . . . 72.540000000000006 110.874 -179.854 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 64' ' ' ILE . . . . . 1.069 HD11 HG21 ' A' ' 89' ' ' VAL . 21.1 mt -137.89 138.61 43.79 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.132 -0.485 . . . . 60.009999999999998 111.097 179.992 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 20.1 m -104.49 113.87 27.72 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.2 -0.455 . . . . 71.299999999999997 111.126 179.939 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . 0.873 HD12 HD12 ' A' ' 52' ' ' LEU . 6.5 mt -99.17 112.19 24.39 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.174 -0.466 . . . . 71.230000000000004 110.927 179.964 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -109.6 114.32 27.84 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.217 -0.447 . . . . 75.310000000000002 110.826 179.897 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 68' ' ' PHE . . . . . 0.583 ' CE1' HG23 ' A' ' 114' ' ' ILE . 0.0 OUTLIER -103.31 140.43 37.42 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.213 -0.448 . . . . 63.020000000000003 110.865 -179.928 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -117.28 131.33 56.84 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.128 -0.487 . . . . 74.25 111.114 179.944 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 70' ' ' MET . . . . . 0.503 ' SD ' ' CZ ' ' A' ' 74' ' ' TYR . 3.1 mmt -93.49 98.82 11.44 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.224 -0.443 . . . . 73.010000000000005 110.858 179.998 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -55.49 163.49 1.84 Allowed Pre-proline 0 C--N 1.33 -0.262 0 CA-C-O 121.57 0.7 . . . . 54.43 111.125 -179.923 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 72' ' ' PRO . . . . . 0.618 ' O ' HD13 ' A' ' 8' ' ' LEU . 53.9 Cg_endo -69.77 3.14 2.95 Favored 'Trans proline' 0 C--N 1.341 0.168 0 C-N-CA 122.668 2.245 . . . . 60.229999999999997 112.348 179.935 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 73' ' ' MET . . . . . 0.509 ' HB3' HG23 ' A' ' 77' ' ' THR . 0.1 OUTLIER -126.31 -22.99 3.91 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.21 -0.45 . . . . 55.399999999999999 110.868 179.927 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 74' ' ' TYR . . . . . 0.643 ' CD1' ' C ' ' A' ' 74' ' ' TYR . 0.0 OUTLIER -49.56 150.04 3.77 Favored Pre-proline 0 C--N 1.329 -0.32 0 CA-C-O 121.67 0.748 . . . . 61.32 110.959 -179.872 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 75' ' ' PRO . . . . . 0.551 ' C ' ' HA ' ' A' ' 74' ' ' TYR . 53.8 Cg_endo -69.74 -14.06 12.42 Favored 'Cis proline' 0 C--O 1.231 0.157 0 C-N-CA 122.706 -1.789 . . . . 75.310000000000002 112.32 -0.006 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 76' ' ' TYR . . . . . 0.507 ' CB ' ' O ' ' A' ' 73' ' ' MET . 9.0 t80 -33.6 -45.75 0.18 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.239 -0.437 . . . . 75.109999999999999 110.949 -179.855 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 77' ' ' THR . . . . . 0.509 HG23 ' HB3' ' A' ' 73' ' ' MET . 45.6 p -108.79 164.86 12.01 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.147 -0.479 . . . . 54.409999999999997 111.165 -179.997 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -79.84 125.96 81.07 Favored Pre-proline 0 C--N 1.329 -0.292 0 CA-C-O 121.579 0.704 . . . . 51.329999999999998 111.119 179.839 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 79' ' ' PRO . . . . . 0.767 ' HG3' HD11 ' A' ' 113' ' ' ILE . 53.8 Cg_endo -69.74 176.43 6.76 Favored 'Trans proline' 0 C--N 1.341 0.147 0 C-N-CA 122.673 2.248 . . . . 72.120000000000005 112.343 -179.961 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -119.04 135.13 54.79 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.248 -0.433 . . . . 75.120000000000005 110.877 -179.983 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 81' ' ' ILE . . . . . 0.61 HD13 HD13 ' A' ' 117' ' ' ILE . 13.7 mt -143.27 151.29 17.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.156 -0.475 . . . . 71.040000000000006 111.135 179.949 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . 0.501 ' HG3' ' CD ' ' A' ' 84' ' ' LYS . 11.2 pt-20 -148.99 147.94 29.17 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.144 -0.48 . . . . 74.439999999999998 110.868 179.996 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 83' ' ' PHE . . . . . 0.451 ' CE1' HD21 ' A' ' 66' ' ' LEU . 64.6 m-85 -90.63 140.27 29.92 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.16 -0.473 . . . . 72.219999999999999 110.897 -179.937 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 84' ' ' LYS . . . . . 0.501 ' CD ' ' HG3' ' A' ' 82' ' ' GLU . 8.0 mmmt -126.4 165.58 18.78 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.201 -0.454 . . . . 73.019999999999996 110.877 179.964 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 85' ' ' ASN . . . . . 0.465 ' O ' ' C ' ' A' ' 86' ' ' VAL . 4.1 m-80 63.55 -71.82 0.06 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.235 -0.439 . . . . 73.099999999999994 110.893 179.97 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 86' ' ' VAL . . . . . 0.687 HG23 ' O ' ' A' ' 86' ' ' VAL . 28.0 m 30.81 91.21 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.156 -0.475 . . . . 73.219999999999999 111.106 179.924 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -94.28 -85.25 0.3 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.117 -0.492 . . . . 64.239999999999995 110.881 -179.988 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 88' ' ' ASN . . . . . 0.439 ' CG ' HG21 ' A' ' 60' ' ' VAL . 1.0 OUTLIER -45.52 -38.14 6.04 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.207 -0.451 . . . . 74.230000000000004 110.923 -179.933 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 89' ' ' VAL . . . . . 1.069 HG21 HD11 ' A' ' 64' ' ' ILE . 3.4 t -61.91 142.92 15.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.134 -0.485 . . . . 74.230000000000004 111.103 179.905 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 90' ' ' MET . . . . . . . . . . . . . 7.2 mtm -95.15 -56.46 2.72 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.134 -0.485 . . . . 74.530000000000001 110.899 179.91 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER 170.21 -41.87 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.197 -0.456 . . . . 64.530000000000001 110.9 179.98 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -54.27 -38.66 66.09 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.188 -0.46 . . . . 55.329999999999998 110.87 -179.781 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 93' ' ' GLN . . . . . 0.646 ' CD ' ' CD1' ' A' ' 128' ' ' PHE . 0.0 OUTLIER -68.25 -43.22 78.36 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.151 -0.477 . . . . 70.340000000000003 110.906 -179.977 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 62.8 mt -60.52 -48.34 82.21 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.228 -0.442 . . . . 72.409999999999997 110.912 -179.957 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -63.38 -34.14 77.07 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.163 -0.471 . . . . 64.120000000000005 110.934 179.934 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 96' ' ' MET . . . . . . . . . . . . . 35.3 ttp -60.65 -40.36 91.72 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.175 -0.466 . . . . 73.549999999999997 110.832 179.982 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 97' ' ' LEU . . . . . 0.791 HD22 HG22 ' A' ' 121' ' ' THR . 81.2 mt -65.91 -39.88 90.98 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.247 -0.433 . . . . 72.109999999999999 110.896 -179.997 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 11.3 mmtm -54.69 -47.19 73.98 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.213 -0.449 . . . . 73.030000000000001 110.892 179.831 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 15.7 m -60.3 -36.75 78.59 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.235 -0.438 . . . . 45.32 110.87 -179.888 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 78.2 mm-40 -71.13 -30.21 66.21 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.16 -0.473 . . . . 71.219999999999999 110.885 -179.951 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 101' ' ' PHE . . . . . 0.864 ' CD2' HD11 ' A' ' 117' ' ' ILE . 9.0 m-30 -59.33 -37.52 78.01 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.173 -0.467 . . . . 72.439999999999998 110.877 -179.98 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -64.8 -40.36 95.09 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.201 -0.454 . . . . 41.200000000000003 110.93 179.986 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 25.8 ttpp -70.16 -43.39 70.94 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.197 -0.456 . . . . 75.549999999999997 110.88 179.859 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 104' ' ' ILE . . . . . 0.408 ' O ' ' N ' ' A' ' 108' ' ' SER . 4.5 mt -62.14 -47.53 92.68 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 116.232 -0.44 . . . . 62.450000000000003 111.128 179.903 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 105' ' ' HIS . . . . . . . . . . . . . 3.2 t60 -62.98 -43.47 98.71 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.187 -0.46 . . . . 73.209999999999994 110.839 179.889 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -57.38 -40.26 77.79 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.229 -0.441 . . . . 72.340000000000003 110.92 -179.997 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 14.3 t -89.14 -21.22 23.45 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.167 -0.469 . . . . 64.5 111.146 -179.968 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 108' ' ' SER . . . . . 0.594 ' CB ' HG22 ' A' ' 113' ' ' ILE . 60.0 m -109.54 31.16 6.0 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.229 -0.441 . . . . 71.540000000000006 110.838 -179.846 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 6.6 ttp180 -79.5 88.1 5.08 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.14 -0.482 . . . . 62.109999999999999 110.855 -179.92 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 113.31 44.82 0.77 Allowed Glycine 0 N--CA 1.451 -0.339 0 C-N-CA 120.747 -0.74 . . . . 50.030000000000001 112.473 -179.981 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 111' ' ' GLN . . . . . . . . . . . . . 21.5 pt20 -174.77 28.31 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.775 0.321 . . . . 74.420000000000002 110.924 -179.886 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER 70.97 140.45 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.198 -0.455 . . . . 71.540000000000006 110.935 -179.901 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 113' ' ' ILE . . . . . 0.767 HD11 ' HG3' ' A' ' 79' ' ' PRO . 34.1 pt -134.78 0.1 1.15 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.167 -0.469 . . . . 72.230000000000004 111.158 179.987 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 114' ' ' ILE . . . . . 0.737 ' O ' HG23 ' A' ' 118' ' ' THR . 18.8 mm -63.29 -45.88 97.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.148 -0.478 . . . . 74.219999999999999 111.158 179.872 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 115' ' ' PHE . . . . . 0.919 ' CE1' HD13 ' A' ' 25' ' ' ILE . 22.2 t80 -72.66 -32.03 65.53 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.114 -0.494 . . . . 75.430000000000007 110.835 179.964 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 20.5 mm-40 -67.91 -45.97 72.9 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.187 -0.46 . . . . 74.030000000000001 110.915 -179.967 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 117' ' ' ILE . . . . . 0.864 HD11 ' CD2' ' A' ' 101' ' ' PHE . 0.9 OUTLIER -66.39 -43.7 91.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.194 -0.457 . . . . 71.209999999999994 111.105 179.989 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 118' ' ' THR . . . . . 0.737 HG23 ' O ' ' A' ' 114' ' ' ILE . 43.9 p -67.95 -41.78 81.95 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.145 -0.48 . . . . 53.229999999999997 111.122 179.979 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 43.2 t -68.06 -43.18 79.24 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.242 -0.435 . . . . 73.049999999999997 110.833 -179.839 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 3.7 t80 -67.83 -48.63 65.66 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.179 -0.464 . . . . 63.450000000000003 110.894 -179.965 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 121' ' ' THR . . . . . 0.791 HG22 HD22 ' A' ' 97' ' ' LEU . 29.0 p -61.88 -39.56 92.38 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.18 -0.464 . . . . 71.219999999999999 111.128 -179.919 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 122' ' ' GLN . . . . . 0.536 HE22 HG13 ' A' ' 55' ' ' VAL . 7.7 tm0? -66.68 -50.81 61.67 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.216 -0.447 . . . . 54.25 110.883 -179.968 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 123' ' ' GLU . . . . . 0.417 ' HG3' ' N ' ' A' ' 124' ' ' LYS . 5.5 pt-20 -63.01 -38.17 90.12 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.221 -0.445 . . . . 72.230000000000004 110.88 -179.96 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 124' ' ' LYS . . . . . 0.434 ' CE ' ' HA ' ' A' ' 124' ' ' LYS . 0.0 OUTLIER -75.82 -35.08 60.13 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.182 -0.463 . . . . 63.020000000000003 110.895 179.996 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 125' ' ' LEU . . . . . 0.69 ' C ' HD23 ' A' ' 125' ' ' LEU . 4.2 tt -70.57 -50.85 33.02 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.201 -0.454 . . . . 74.530000000000001 110.927 179.88 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 126' ' ' ASP . . . . . 0.411 ' CG ' ' N ' ' A' ' 127' ' ' GLU . 0.0 OUTLIER -57.56 -46.58 83.78 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.147 -0.478 . . . . 74.329999999999998 110.827 179.888 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 127' ' ' GLU . . . . . 0.454 ' OE1' ' C ' ' A' ' 127' ' ' GLU . 0.9 OUTLIER -65.08 -28.15 69.26 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.221 -0.445 . . . . 74.409999999999997 110.872 -179.896 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 128' ' ' PHE . . . . . 0.646 ' CD1' ' CD ' ' A' ' 93' ' ' GLN . 0.2 OUTLIER . . . . . 0 C--N 1.329 -0.304 0 CA-C-N 116.155 -0.475 . . . . 75.409999999999997 110.878 -179.908 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 29.0 mt . . . . . 0 C--O 1.231 0.096 0 CA-C-O 120.8 0.333 . . . . 62.020000000000003 110.925 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -55.2 -30.18 59.42 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.201 -0.454 . . . . 73.099999999999994 110.835 179.867 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 77.5 mm-40 -67.2 -35.75 80.28 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.232 -0.44 . . . . 74.519999999999996 110.916 -179.852 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 11' ' ' TYR . . . . . 0.49 ' CD1' ' HD2' ' A' ' 75' ' ' PRO . 26.9 m-85 -66.6 -28.1 68.24 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.158 -0.474 . . . . 72.340000000000003 110.875 -179.876 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -59.3 -39.24 82.39 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.131 -0.486 . . . . 73.299999999999997 110.923 -179.865 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -59.04 -44.25 91.76 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.163 -0.471 . . . . 63.140000000000001 110.894 179.976 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 14' ' ' ILE . . . . . 0.618 HG22 ' OE1' ' A' ' 18' ' ' GLU . 3.8 mp -66.94 -48.01 80.77 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.156 -0.475 . . . . 63.009999999999998 111.108 179.976 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 57.6 mt-30 -57.85 -46.55 84.63 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.231 -0.44 . . . . 73.109999999999999 110.927 179.934 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 6.7 t -58.6 -44.93 90.03 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.226 -0.443 . . . . 71.120000000000005 110.91 -179.964 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 1.1 t30 -59.03 -33.88 71.27 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.152 -0.476 . . . . 74.310000000000002 110.918 -179.912 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . 0.618 ' OE1' HG22 ' A' ' 14' ' ' ILE . 2.2 mp0 -64.35 -39.09 93.2 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.174 -0.466 . . . . 73.400000000000006 110.91 179.961 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.846 HD11 HG13 ' A' ' 46' ' ' ILE . 5.7 mt -63.56 -51.27 66.12 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.165 -0.471 . . . . 71.329999999999998 110.92 -179.971 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 6.6 pt-20 -68.59 -35.02 76.78 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.163 -0.471 . . . . 73.5 110.894 179.914 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -62.7 -50.67 70.2 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.161 -0.472 . . . . 71.420000000000002 111.072 179.962 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . 0.796 ' HA ' HD12 ' A' ' 25' ' ' ILE . 0.6 OUTLIER -74.72 -34.98 35.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.234 -0.439 . . . . 64.239999999999995 111.163 179.96 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 16.4 mtt180 -52.6 -35.78 54.95 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.151 -0.477 . . . . 74.200000000000003 110.846 179.95 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -67.51 -31.2 71.16 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.212 -0.449 . . . . 60.240000000000002 110.88 -179.798 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . 0.796 HD12 ' HA ' ' A' ' 22' ' ' ILE . 4.8 mt -80.32 -45.22 22.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.114 -0.494 . . . . 71.549999999999997 111.102 -179.997 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 17.5 m-85 -109.84 44.02 1.26 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.17 -0.468 . . . . 74.230000000000004 110.925 -179.975 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 1.3 mtm -43.49 -40.81 4.04 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.124 -0.489 . . . . 73.409999999999997 110.843 179.929 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -104.72 -20.12 13.72 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.275 -0.42 . . . . 61.43 110.863 179.963 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 3.6 m-20 -95.17 22.9 6.21 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.238 -0.437 . . . . 75.129999999999995 110.852 179.996 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 30' ' ' PHE . . . . . 0.577 ' C ' ' CD1' ' A' ' 30' ' ' PHE . 0.1 OUTLIER -114.52 143.78 44.42 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.231 -0.441 . . . . 74.239999999999995 110.866 -179.912 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 23.7 m -123.99 130.94 53.4 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.11 -0.495 . . . . 73.5 111.147 -179.936 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 1.2 t70 -94.05 114.3 26.43 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.202 -0.454 . . . . 74.109999999999999 110.849 179.926 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.985 HD23 ' N ' ' A' ' 34' ' ' THR . 0.2 OUTLIER -117.89 -17.36 9.79 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.229 -0.441 . . . . 62.340000000000003 110.934 -179.967 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . 0.985 ' N ' HD23 ' A' ' 33' ' ' LEU . 4.7 m . . . . . 0 C--N 1.329 -0.293 0 CA-C-N 116.181 -0.463 . . . . 65.239999999999995 111.123 179.952 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 45' ' ' GLN . . . . . 0.819 ' HB3' HD12 ' A' ' 47' ' ' ILE . 27.4 tt0 . . . . . 0 C--O 1.232 0.154 0 CA-C-O 120.764 0.316 . . . . 72.420000000000002 110.917 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 46' ' ' ILE . . . . . 0.846 HG13 HD11 ' A' ' 19' ' ' LEU . 0.0 OUTLIER 79.72 -42.35 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.24 -0.436 . . . . 65.219999999999999 111.13 179.991 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . 0.897 HG12 HD21 ' A' ' 33' ' ' LEU . 0.2 OUTLIER -34.03 143.27 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.206 -0.452 . . . . 73.319999999999993 111.156 179.87 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 48' ' ' PHE . . . . . 0.855 ' HA ' HD22 ' A' ' 33' ' ' LEU . 1.1 p90 -150.05 164.7 34.85 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.16 -0.473 . . . . 74.319999999999993 110.833 -179.989 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . 0.912 ' HG3' HD13 ' A' ' 33' ' ' LEU . 34.3 mt-10 -108.84 147.56 31.92 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.123 -0.489 . . . . 75.120000000000005 110.879 -179.945 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . 0.48 HD13 ' HA ' ' A' ' 30' ' ' PHE . 14.4 mm -128.31 135.89 61.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.185 -0.461 . . . . 74.019999999999996 111.157 179.951 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 25.9 m -93.73 125.19 38.22 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.168 -0.469 . . . . 71.140000000000001 111.14 179.974 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . 0.418 HD23 ' HA ' ' A' ' 52' ' ' LEU . 13.9 mt -119.72 165.02 15.06 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.206 -0.452 . . . . 64.150000000000006 110.869 179.979 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -166.41 154.35 10.16 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.178 -0.464 . . . . 71.530000000000001 110.894 179.985 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 1.9 m -56.8 -172.95 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.162 -0.472 . . . . 73.439999999999998 110.868 -179.797 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 34.5 m -87.75 -33.04 6.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.145 -0.48 . . . . 51.310000000000002 111.096 179.978 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 5.1 t0 -119.42 -166.55 1.28 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.23 -0.441 . . . . 63.439999999999998 110.875 179.922 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . 0.446 ' O ' ' C ' ' A' ' 60' ' ' VAL . 1.6 mmmp? -119.31 -25.9 5.99 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.215 -0.448 . . . . 73.219999999999999 110.866 -179.995 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . 0.555 ' HA ' ' C ' ' A' ' 59' ' ' PRO . 7.0 pt-20 -112.14 144.46 30.82 Favored Pre-proline 0 C--N 1.329 -0.286 0 CA-C-O 121.613 0.721 . . . . 73.310000000000002 110.877 179.982 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 59' ' ' PRO . . . . . 0.555 ' C ' ' HA ' ' A' ' 58' ' ' GLU . 53.4 Cg_endo -69.81 -14.44 12.57 Favored 'Cis proline' 0 C--O 1.231 0.171 0 C-N-CA 122.684 -1.798 . . . . 72.099999999999994 112.348 0.051 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 60' ' ' VAL . . . . . 0.725 HG11 ' OD1' ' A' ' 88' ' ' ASN . 15.5 m -140.95 -177.88 1.37 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.211 -0.45 . . . . 73.549999999999997 111.128 179.938 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . 0.441 ' O ' ' C ' ' A' ' 62' ' ' SER . 2.3 pt-20 -119.6 -12.91 9.22 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.177 -0.465 . . . . 61.439999999999998 110.891 -179.98 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 62' ' ' SER . . . . . 0.757 ' CB ' HD11 ' A' ' 125' ' ' LEU . 3.6 m 34.26 90.02 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.162 -0.472 . . . . 73.030000000000001 110.869 -179.769 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 9.7 p -110.19 122.97 48.89 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.152 -0.476 . . . . 63.329999999999998 110.891 -179.865 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 64' ' ' ILE . . . . . 0.733 HD11 HG21 ' A' ' 89' ' ' VAL . 19.8 mt -135.69 142.0 40.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.127 -0.488 . . . . 53.119999999999997 111.124 179.944 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 99.6 m -109.71 116.2 31.26 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.194 -0.457 . . . . 74.329999999999998 111.115 179.94 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . 0.596 HD11 HG21 ' A' ' 121' ' ' THR . 53.0 mt -95.16 116.52 28.84 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.2 -0.454 . . . . 72.329999999999998 110.942 179.904 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 13.4 t60 -105.64 113.83 27.63 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.152 -0.477 . . . . 63.340000000000003 110.87 179.861 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 68' ' ' PHE . . . . . 0.551 ' CE1' HG23 ' A' ' 114' ' ' ILE . 0.0 OUTLIER -103.83 139.92 38.37 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.229 -0.441 . . . . 70.219999999999999 110.899 -179.927 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -115.47 107.25 14.94 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.188 -0.46 . . . . 61.109999999999999 111.122 179.921 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 70' ' ' MET . . . . . 0.425 ' H ' HG22 ' A' ' 47' ' ' ILE . 0.3 OUTLIER -74.7 81.98 2.07 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.248 -0.433 . . . . 73.329999999999998 110.911 179.949 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -40.61 158.75 0.16 Allowed Pre-proline 0 C--N 1.33 -0.273 0 CA-C-O 121.579 0.704 . . . . 43.350000000000001 111.143 -179.928 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.74 -1.12 7.92 Favored 'Trans proline' 0 C--N 1.341 0.179 0 C-N-CA 122.701 2.267 . . . . 62.420000000000002 112.39 179.886 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 73' ' ' MET . . . . . 0.634 ' HB3' HG23 ' A' ' 77' ' ' THR . 0.1 OUTLIER -112.75 -26.02 8.79 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.198 -0.455 . . . . 72.239999999999995 110.88 179.899 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 74' ' ' TYR . . . . . 0.635 ' CD1' ' C ' ' A' ' 74' ' ' TYR . 0.0 OUTLIER -48.87 149.93 2.92 Favored Pre-proline 0 C--N 1.328 -0.327 0 CA-C-O 121.681 0.753 . . . . 73.099999999999994 110.939 -179.893 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 75' ' ' PRO . . . . . 0.551 ' C ' ' HA ' ' A' ' 74' ' ' TYR . 53.9 Cg_endo -69.72 -12.88 12.24 Favored 'Cis proline' 0 C--O 1.232 0.187 0 C-N-CA 122.761 -1.766 . . . . 73.400000000000006 112.329 -0.056 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 76' ' ' TYR . . . . . 0.49 ' CB ' ' O ' ' A' ' 73' ' ' MET . 6.5 t80 -35.74 -51.29 0.67 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.251 -0.431 . . . . 74.129999999999995 110.93 -179.9 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 77' ' ' THR . . . . . 0.634 HG23 ' HB3' ' A' ' 73' ' ' MET . 48.2 p -107.1 167.51 9.85 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.12 -0.491 . . . . 74.420000000000002 111.122 -179.992 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -88.93 129.39 48.53 Favored Pre-proline 0 C--N 1.329 -0.314 0 CA-C-O 121.59 0.709 . . . . 61.43 111.122 179.858 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 79' ' ' PRO . . . . . 0.58 ' HG3' HD11 ' A' ' 113' ' ' ILE . 53.0 Cg_endo -69.77 -172.47 0.58 Allowed 'Trans proline' 0 C--N 1.341 0.171 0 C-N-CA 122.667 2.244 . . . . 72.340000000000003 112.321 -179.948 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -120.57 132.98 55.42 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.212 -0.449 . . . . 63.240000000000002 110.871 -179.957 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 81' ' ' ILE . . . . . 0.487 HD13 ' HA ' ' A' ' 68' ' ' PHE . 9.8 mm -122.96 142.31 40.04 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-N 116.161 -0.472 . . . . 43.299999999999997 111.159 179.97 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . 0.515 ' HG3' ' CD ' ' A' ' 84' ' ' LYS . 4.6 pt-20 -145.09 144.93 31.21 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.217 -0.447 . . . . 51.32 110.893 179.972 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 83' ' ' PHE . . . . . 0.496 ' CE2' ' HD3' ' A' ' 98' ' ' LYS . 33.7 m-85 -99.04 135.28 40.68 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.157 -0.474 . . . . 55.520000000000003 110.888 -179.94 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 84' ' ' LYS . . . . . 0.515 ' CD ' ' HG3' ' A' ' 82' ' ' GLU . 9.2 mmmt -125.4 171.84 10.13 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.165 -0.471 . . . . 73.450000000000003 110.847 -179.989 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 85' ' ' ASN . . . . . 0.486 ' O ' ' C ' ' A' ' 86' ' ' VAL . 2.8 m-80 62.41 -73.87 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.216 -0.447 . . . . 71.340000000000003 110.878 179.954 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 86' ' ' VAL . . . . . 0.704 HG23 ' O ' ' A' ' 86' ' ' VAL . 33.6 m 29.74 91.51 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.18 -0.464 . . . . 73.219999999999999 111.11 179.911 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -93.64 -63.57 1.19 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.138 -0.483 . . . . 74.049999999999997 110.909 -179.958 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 88' ' ' ASN . . . . . 0.725 ' OD1' HG11 ' A' ' 60' ' ' VAL . 17.1 t30 -81.82 39.22 0.54 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.202 -0.454 . . . . 75.109999999999999 110.925 -179.987 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 89' ' ' VAL . . . . . 0.733 HG21 HD11 ' A' ' 64' ' ' ILE . 15.6 t -141.2 149.49 20.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.171 -0.468 . . . . 73.409999999999997 111.135 179.905 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 90' ' ' MET . . . . . . . . . . . . . 6.2 mtm -107.72 -61.49 1.56 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.152 -0.476 . . . . 54.450000000000003 110.865 179.927 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 91' ' ' ASP . . . . . 0.417 ' OD1' ' N ' ' A' ' 92' ' ' SER . 0.0 OUTLIER -177.64 -30.84 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.233 -0.439 . . . . 75.340000000000003 110.908 179.988 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 92' ' ' SER . . . . . 0.417 ' N ' ' OD1' ' A' ' 91' ' ' ASP . 47.4 t -55.46 -45.7 76.89 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.175 -0.466 . . . . 63.329999999999998 110.89 -179.807 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 93' ' ' GLN . . . . . 0.514 ' HG3' ' CE2' ' A' ' 128' ' ' PHE . 3.9 mp0 -68.58 -41.71 79.28 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.125 -0.489 . . . . 73.239999999999995 110.903 -179.985 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . 0.668 ' CD1' HG11 ' A' ' 89' ' ' VAL . 7.5 mp -58.61 -48.98 79.16 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.211 -0.45 . . . . 71.239999999999995 110.916 -179.986 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 45.7 mt-30 -66.16 -34.45 78.06 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.226 -0.443 . . . . 72.109999999999999 110.93 179.928 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 96' ' ' MET . . . . . 0.424 ' SD ' ' CE1' ' A' ' 128' ' ' PHE . 5.7 ttp -59.74 -39.7 85.62 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.159 -0.473 . . . . 73.299999999999997 110.864 179.972 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 97' ' ' LEU . . . . . 0.862 HD22 HG22 ' A' ' 121' ' ' THR . 13.4 mt -67.24 -42.18 84.39 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.288 -0.415 . . . . 51.130000000000003 110.892 -179.972 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 98' ' ' LYS . . . . . 0.496 ' HD3' ' CE2' ' A' ' 83' ' ' PHE . 3.2 mmmp? -55.23 -42.35 73.28 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.22 -0.445 . . . . 70.349999999999994 110.893 179.876 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -59.81 -44.57 93.94 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.206 -0.452 . . . . 72.420000000000002 110.883 -179.887 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 100' ' ' GLU . . . . . 0.508 ' O ' HD12 ' A' ' 104' ' ' ILE . 19.3 mt-10 -69.88 -27.44 64.82 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.111 -0.495 . . . . 64.030000000000001 110.872 -179.97 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 101' ' ' PHE . . . . . 0.784 ' CD2' HD11 ' A' ' 117' ' ' ILE . 11.8 m-30 -59.37 -28.83 67.22 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.198 -0.455 . . . . 74.109999999999999 110.869 -179.945 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 6.5 ttmt -71.79 -43.38 65.77 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.136 -0.484 . . . . 72.510000000000005 110.903 179.983 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 16.8 ttpp -69.07 -42.97 75.5 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.235 -0.439 . . . . 72.549999999999997 110.882 179.857 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 104' ' ' ILE . . . . . 0.546 HD11 ' CD2' ' A' ' 120' ' ' PHE . 3.5 mt -62.59 -47.46 92.82 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.248 -0.433 . . . . 74.420000000000002 111.148 179.854 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 105' ' ' HIS . . . . . . . . . . . . . 35.6 t-80 -62.84 -41.94 99.54 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.185 -0.461 . . . . 63.399999999999999 110.872 179.884 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -57.33 -41.25 79.65 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.172 -0.467 . . . . 74.010000000000005 110.866 -179.952 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 9.4 t -83.57 -15.61 48.55 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.226 -0.443 . . . . 61.109999999999999 111.137 -179.954 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 108' ' ' SER . . . . . 0.578 ' HB2' HG22 ' A' ' 113' ' ' ILE . 1.8 m -124.54 43.55 2.99 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.203 -0.453 . . . . 73.25 110.857 -179.899 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 4.9 ttt180 -90.38 83.23 5.9 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.123 -0.49 . . . . 73.099999999999994 110.845 -179.955 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 110' ' ' GLY . . . . . 0.476 ' HA2' ' CG ' ' A' ' 75' ' ' PRO . . . 136.63 -4.43 3.65 Favored Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.712 -0.756 . . . . 53.210000000000001 112.486 -179.971 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 111' ' ' GLN . . . . . . . . . . . . . 13.2 mm-40 -116.46 -94.76 0.48 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.784 0.326 . . . . 62.130000000000003 110.892 -179.909 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 39.9 mt-10 -149.05 131.4 15.62 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.236 -0.438 . . . . 63.130000000000003 110.915 -179.935 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 113' ' ' ILE . . . . . 0.58 HD11 ' HG3' ' A' ' 79' ' ' PRO . 16.3 pt -121.29 -9.52 9.71 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.157 -0.474 . . . . 73.420000000000002 111.166 179.932 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 114' ' ' ILE . . . . . 0.924 ' O ' HG23 ' A' ' 118' ' ' THR . 30.2 mm -65.53 -45.85 91.42 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.187 -0.461 . . . . 73.420000000000002 111.18 179.819 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 115' ' ' PHE . . . . . 0.726 ' CE1' HD13 ' A' ' 25' ' ' ILE . 31.8 t80 -73.03 -34.49 66.38 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.173 -0.467 . . . . 64.540000000000006 110.901 179.917 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 9.0 mm-40 -68.06 -47.88 67.11 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.131 -0.486 . . . . 72.340000000000003 110.92 -179.934 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 117' ' ' ILE . . . . . 0.784 HD11 ' CD2' ' A' ' 101' ' ' PHE . 0.9 OUTLIER -63.53 -39.98 87.35 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.13 -0.487 . . . . 71.200000000000003 111.133 179.938 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 118' ' ' THR . . . . . 0.924 HG23 ' O ' ' A' ' 114' ' ' ILE . 46.9 p -68.0 -43.54 78.65 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.18 -0.464 . . . . 73.340000000000003 111.13 179.972 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -68.01 -44.15 77.21 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.206 -0.452 . . . . 75.239999999999995 110.876 -179.877 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 120' ' ' PHE . . . . . 0.546 ' CD2' HD11 ' A' ' 104' ' ' ILE . 1.2 t80 -60.79 -49.45 77.43 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.147 -0.479 . . . . 71.019999999999996 110.881 -179.948 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 121' ' ' THR . . . . . 0.862 HG22 HD22 ' A' ' 97' ' ' LEU . 75.5 p -60.04 -40.37 89.14 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.143 -0.481 . . . . 73.230000000000004 111.171 -179.891 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -68.07 -51.34 47.65 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.208 -0.451 . . . . 74.109999999999999 110.894 179.972 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 123' ' ' GLU . . . . . 0.47 ' CG ' ' N ' ' A' ' 124' ' ' LYS . 4.5 pt-20 -58.91 -46.21 88.43 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.267 -0.424 . . . . 72.109999999999999 110.876 -179.908 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 124' ' ' LYS . . . . . 0.47 ' N ' ' CG ' ' A' ' 123' ' ' GLU . 0.0 OUTLIER -73.77 -26.91 60.89 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.17 -0.468 . . . . 63.43 110.896 179.966 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 125' ' ' LEU . . . . . 0.757 HD11 ' CB ' ' A' ' 62' ' ' SER . 2.5 tp -67.9 -50.21 57.5 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.234 -0.439 . . . . 74.319999999999993 110.944 179.913 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -61.41 -38.44 87.09 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.175 -0.466 . . . . 60.310000000000002 110.872 179.803 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 127' ' ' GLU . . . . . 0.433 ' HG3' ' N ' ' A' ' 128' ' ' PHE . 0.0 OUTLIER -62.27 -28.97 70.09 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.218 -0.446 . . . . 74.129999999999995 110.868 -179.879 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 128' ' ' PHE . . . . . 0.514 ' CE2' ' HG3' ' A' ' 93' ' ' GLN . 0.6 OUTLIER . . . . . 0 C--N 1.329 -0.304 0 CA-C-N 116.148 -0.478 . . . . 62.020000000000003 110.882 -179.912 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 50.9 mt . . . . . 0 C--O 1.231 0.117 0 CA-C-O 120.825 0.345 . . . . 65.319999999999993 110.916 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 37.2 t70 -50.61 -31.13 15.11 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.187 -0.46 . . . . 74.450000000000003 110.894 179.819 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 82.6 mm-40 -67.51 -39.65 85.11 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.185 -0.461 . . . . 73.319999999999993 110.931 -179.938 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 19.2 m-85 -59.41 -25.4 64.29 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.176 -0.466 . . . . 74.319999999999993 110.945 -179.925 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 1.6 t80 -59.33 -38.98 81.7 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.155 -0.475 . . . . 70.299999999999997 110.901 -179.905 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -61.43 -42.52 98.88 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.166 -0.47 . . . . 61.109999999999999 110.879 -179.964 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 3.1 mp -67.54 -41.9 86.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.171 -0.468 . . . . 73.109999999999999 111.169 179.957 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . 0.42 ' NE2' ' O ' ' A' ' 71' ' ' THR . 73.0 mt-30 -60.88 -44.7 96.71 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.12 -0.491 . . . . 73.340000000000003 110.901 179.917 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 6.9 t -64.02 -39.6 94.47 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.217 -0.447 . . . . 64.219999999999999 110.911 -179.919 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 8.0 m-20 -58.02 -33.92 69.48 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.158 -0.474 . . . . 65.430000000000007 110.889 -179.9 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . 0.4 ' CD ' ' OH ' ' A' ' 74' ' ' TYR . 1.6 mm-40 -65.38 -37.67 87.71 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.173 -0.467 . . . . 73.439999999999998 110.886 -179.986 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.419 ' CD2' HG13 ' A' ' 46' ' ' ILE . 5.9 mp -66.14 -51.4 58.23 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.134 -0.485 . . . . 73.340000000000003 110.952 179.99 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -68.68 -34.18 75.24 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.196 -0.457 . . . . 74.019999999999996 110.881 179.915 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -64.54 -50.85 65.68 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.145 -0.479 . . . . 71.030000000000001 111.113 179.906 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . 0.748 ' HA ' HD12 ' A' ' 25' ' ' ILE . 0.6 OUTLIER -75.1 -34.46 31.82 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 116.252 -0.431 . . . . 70.329999999999998 111.161 179.943 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . 0.519 ' O ' ' CA ' ' A' ' 27' ' ' MET . 0.0 OUTLIER -52.43 -35.53 52.33 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.177 -0.465 . . . . 64.540000000000006 110.896 179.972 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -68.43 -28.53 67.15 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.132 -0.486 . . . . 74.209999999999994 110.908 -179.833 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . 0.785 HD13 ' CE1' ' A' ' 115' ' ' PHE . 4.7 mt -84.13 -45.15 18.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.134 -0.485 . . . . 72.519999999999996 111.137 179.939 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 26' ' ' TYR . . . . . 0.508 ' O ' ' N ' ' A' ' 29' ' ' ASP . 32.3 m-85 -106.32 21.01 18.1 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.146 -0.479 . . . . 73.310000000000002 110.915 -179.991 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 27' ' ' MET . . . . . 0.519 ' CA ' ' O ' ' A' ' 23' ' ' ARG . 0.0 OUTLIER -33.87 -45.56 0.19 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.112 -0.494 . . . . 73.25 110.873 179.951 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 31.1 t70 -86.19 -31.19 21.9 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.209 -0.45 . . . . 74.349999999999994 110.871 179.965 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . 0.508 ' N ' ' O ' ' A' ' 26' ' ' TYR . 1.3 m-20 -103.21 37.77 1.91 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.151 -0.477 . . . . 44.450000000000003 110.907 179.972 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 30' ' ' PHE . . . . . 0.607 ' HA ' HD13 ' A' ' 50' ' ' ILE . 0.6 OUTLIER -109.91 135.13 51.26 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.183 -0.462 . . . . 65.400000000000006 110.876 -179.881 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 45.4 m -115.24 130.9 57.04 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.132 -0.485 . . . . 72.5 111.182 -179.934 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -104.9 115.3 30.06 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.283 -0.417 . . . . 62.140000000000001 110.904 179.925 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.898 HD21 ' CE1' ' A' ' 67' ' ' HIS . 0.5 OUTLIER -119.18 4.01 11.34 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.223 -0.444 . . . . 54.509999999999998 110.882 -179.915 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . 0.539 ' N ' HD12 ' A' ' 33' ' ' LEU . 1.3 m . . . . . 0 C--N 1.329 -0.283 0 CA-C-N 116.213 -0.449 . . . . 64.519999999999996 111.125 179.945 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 45' ' ' GLN . . . . . 0.506 ' O ' HG22 ' A' ' 46' ' ' ILE . 17.6 tt0 . . . . . 0 C--O 1.232 0.137 0 CA-C-O 120.765 0.317 . . . . 71.319999999999993 110.899 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 46' ' ' ILE . . . . . 0.506 HG22 ' O ' ' A' ' 45' ' ' GLN . 0.0 OUTLIER 81.67 -11.56 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.178 -0.465 . . . . 54.350000000000001 111.108 179.936 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . 0.468 HG12 ' CD1' ' A' ' 33' ' ' LEU . 0.2 OUTLIER -51.5 150.57 0.91 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 116.157 -0.474 . . . . 73.200000000000003 111.114 179.879 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 6.8 p90 -161.95 161.19 28.57 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.118 -0.492 . . . . 73.030000000000001 110.875 179.968 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . 0.57 ' CD ' HD23 ' A' ' 33' ' ' LEU . 8.6 mt-10 -111.25 161.02 16.44 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.137 -0.483 . . . . 71.340000000000003 110.858 -179.942 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . 0.607 HD13 ' HA ' ' A' ' 30' ' ' PHE . 7.8 mm -140.27 132.38 32.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.114 -0.493 . . . . 73.519999999999996 111.173 179.941 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 24.2 m -84.44 123.29 30.07 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.205 -0.452 . . . . 75.209999999999994 111.164 179.995 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . 0.533 HD12 HD12 ' A' ' 66' ' ' LEU . 31.2 mt -121.72 164.98 16.48 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.229 -0.442 . . . . 61.229999999999997 110.928 179.979 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 53' ' ' ARG . . . . . 0.67 ' C ' HD21 ' A' ' 125' ' ' LEU . 7.6 ptt180 175.68 163.42 0.32 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.231 -0.44 . . . . 71.049999999999997 110.848 179.943 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . 0.882 ' CA ' HD11 ' A' ' 125' ' ' LEU . 1.4 t -60.59 -156.47 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.184 -0.462 . . . . 71.219999999999999 110.87 -179.842 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 55' ' ' VAL . . . . . 0.417 HG22 ' OD1' ' A' ' 126' ' ' ASP . 15.7 m -122.31 -22.84 2.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.114 -0.494 . . . . 73.299999999999997 111.144 179.896 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 56' ' ' ASP . . . . . 0.439 ' OD1' ' N ' ' A' ' 56' ' ' ASP . 0.2 OUTLIER -110.5 -175.39 2.71 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.181 -0.463 . . . . 61.399999999999999 110.889 179.906 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 3.9 mmmm -118.47 -10.87 10.04 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.173 -0.467 . . . . 61.140000000000001 110.884 179.999 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . 0.558 ' HA ' ' C ' ' A' ' 59' ' ' PRO . 44.3 mt-10 -126.34 141.89 41.24 Favored Pre-proline 0 C--N 1.329 -0.288 0 CA-C-O 121.659 0.742 . . . . 74.25 110.885 179.974 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 59' ' ' PRO . . . . . 0.558 ' C ' ' HA ' ' A' ' 58' ' ' GLU . 53.4 Cg_endo -69.79 -3.18 7.58 Favored 'Cis proline' 0 C--N 1.342 0.205 0 C-N-CA 122.653 -1.811 . . . . 63.240000000000002 112.36 0.035 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 60' ' ' VAL . . . . . 0.47 ' HB ' ' ND2' ' A' ' 88' ' ' ASN . 18.3 m -157.61 -173.29 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.232 -0.44 . . . . 74.530000000000001 111.144 179.918 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . 0.408 ' O ' ' O ' ' A' ' 62' ' ' SER . 8.3 tt0 -114.86 -22.1 9.8 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.184 -0.462 . . . . 72.129999999999995 110.873 -179.969 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 62' ' ' SER . . . . . 0.844 ' HB3' HD13 ' A' ' 125' ' ' LEU . 0.4 OUTLIER 49.4 101.63 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.137 -0.483 . . . . 61.149999999999999 110.864 -179.787 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 63' ' ' SER . . . . . 0.405 ' HB3' ' CD ' ' A' ' 87' ' ' GLN . 26.0 t -125.31 123.26 39.05 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.14 -0.482 . . . . 75.299999999999997 110.887 -179.83 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 64' ' ' ILE . . . . . 0.921 HD11 HG21 ' A' ' 89' ' ' VAL . 64.7 mt -145.16 142.56 22.59 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.178 -0.465 . . . . 55.549999999999997 111.163 179.938 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 23.5 m -107.52 119.07 38.4 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.198 -0.455 . . . . 40.020000000000003 111.123 -179.994 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . 0.565 HD11 HG21 ' A' ' 121' ' ' THR . 54.1 mt -99.01 109.97 22.64 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.242 -0.436 . . . . 72.420000000000002 110.915 179.913 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 67' ' ' HIS . . . . . 0.898 ' CE1' HD21 ' A' ' 33' ' ' LEU . 1.9 t60 -96.47 109.76 22.26 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.152 -0.476 . . . . 64.040000000000006 110.853 179.869 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 68' ' ' PHE . . . . . 0.493 ' HD2' HD12 ' A' ' 81' ' ' ILE . 0.0 OUTLIER -103.92 139.91 38.42 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.245 -0.434 . . . . 73.140000000000001 110.875 -179.911 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 69' ' ' ALA . . . . . 0.451 ' O ' ' CB ' ' A' ' 79' ' ' PRO . . . -126.64 129.04 47.71 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.145 -0.479 . . . . 63.140000000000001 111.119 179.908 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 70' ' ' MET . . . . . 0.473 ' CE ' HD11 ' A' ' 114' ' ' ILE . 0.0 OUTLIER -94.64 157.86 15.78 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.234 -0.439 . . . . 73.010000000000005 110.854 179.982 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 71' ' ' THR . . . . . 0.42 ' O ' ' NE2' ' A' ' 15' ' ' GLN . 0.1 OUTLIER -112.16 162.93 19.09 Favored Pre-proline 0 C--N 1.33 -0.241 0 CA-C-O 121.601 0.715 . . . . 51.240000000000002 111.096 -179.945 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.76 0.1 6.13 Favored 'Trans proline' 0 C--N 1.341 0.173 0 C-N-CA 122.71 2.273 . . . . 60.109999999999999 112.348 179.933 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 73' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -115.06 -26.71 7.6 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.241 -0.436 . . . . 63.240000000000002 110.911 179.895 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 74' ' ' TYR . . . . . 0.66 ' CD1' ' C ' ' A' ' 74' ' ' TYR . 0.0 OUTLIER -45.76 151.66 0.81 Allowed Pre-proline 0 C--N 1.329 -0.323 0 CA-C-O 121.675 0.75 . . . . 72.329999999999998 110.935 -179.873 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 75' ' ' PRO . . . . . 0.552 ' HA ' ' CD2' ' A' ' 74' ' ' TYR . 53.6 Cg_endo -69.8 2.15 5.02 Favored 'Cis proline' 0 C--O 1.232 0.205 0 C-N-CA 122.634 -1.819 . . . . 61.210000000000001 112.329 -0.036 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 76' ' ' TYR . . . . . 0.729 ' O ' HG23 ' A' ' 77' ' ' THR . 19.6 t80 -75.3 44.46 0.26 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.258 -0.428 . . . . 72.219999999999999 110.967 -179.968 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 77' ' ' THR . . . . . 0.729 HG23 ' O ' ' A' ' 76' ' ' TYR . 0.6 OUTLIER -172.61 -177.57 1.75 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.086 -0.506 . . . . 73.129999999999995 111.181 -179.971 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -118.73 116.59 34.58 Favored Pre-proline 0 C--N 1.329 -0.313 0 CA-C-O 121.587 0.708 . . . . 73.099999999999994 111.075 179.863 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 79' ' ' PRO . . . . . 0.474 ' HG3' ' CD1' ' A' ' 113' ' ' ILE . 53.7 Cg_endo -69.72 -164.66 0.13 Allowed 'Trans proline' 0 C--N 1.342 0.192 0 C-N-CA 122.674 2.249 . . . . 50.5 112.356 179.978 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . 0.578 ' O ' HD13 ' A' ' 81' ' ' ILE . 0.3 OUTLIER -135.32 136.03 41.24 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.19 -0.459 . . . . 71.439999999999998 110.907 179.985 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 81' ' ' ILE . . . . . 0.578 HD13 ' O ' ' A' ' 80' ' ' GLU . 10.0 mm -127.99 144.34 37.98 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.113 -0.494 . . . . 60.329999999999998 111.168 179.954 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . 0.453 ' HG3' ' CD ' ' A' ' 84' ' ' LYS . 1.2 pt-20 -148.51 145.93 28.12 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.162 -0.472 . . . . 72.230000000000004 110.888 179.973 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 83' ' ' PHE . . . . . 0.558 ' CE2' ' HD3' ' A' ' 98' ' ' LYS . 7.3 m-85 -99.33 139.95 34.22 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.171 -0.468 . . . . 74.420000000000002 110.895 -179.965 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 84' ' ' LYS . . . . . 0.478 ' O ' ' N ' ' A' ' 86' ' ' VAL . 5.3 mmmt -127.06 173.62 9.53 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.172 -0.467 . . . . 74.129999999999995 110.889 179.981 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 85' ' ' ASN . . . . . 0.549 HD22 ' N ' ' A' ' 85' ' ' ASN . 1.2 m-80 61.35 -75.51 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.191 -0.459 . . . . 55.43 110.907 179.946 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 86' ' ' VAL . . . . . 0.672 HG11 HD21 ' A' ' 94' ' ' LEU . 3.6 m 40.22 91.35 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.151 -0.477 . . . . 75.239999999999995 111.099 179.858 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 87' ' ' GLN . . . . . 0.405 ' CD ' ' HB3' ' A' ' 63' ' ' SER . 0.1 OUTLIER -96.79 -65.08 0.99 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.143 -0.48 . . . . 74.299999999999997 110.934 179.974 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 88' ' ' ASN . . . . . 0.47 ' ND2' ' HB ' ' A' ' 60' ' ' VAL . 8.5 m120 -84.95 34.23 0.54 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.218 -0.447 . . . . 74.140000000000001 110.907 -179.995 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 89' ' ' VAL . . . . . 0.921 HG21 HD11 ' A' ' 64' ' ' ILE . 17.1 t -138.06 146.57 26.86 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.205 -0.452 . . . . 61.229999999999997 111.148 179.925 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 90' ' ' MET . . . . . . . . . . . . . 13.7 mtm -101.75 -62.97 1.19 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.186 -0.461 . . . . 71.219999999999999 110.857 179.932 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -179.53 -32.73 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.215 -0.448 . . . . 74.450000000000003 110.848 179.973 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 39.0 t -53.97 -42.3 68.8 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.206 -0.452 . . . . 74.219999999999999 110.872 -179.789 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 93' ' ' GLN . . . . . 0.579 ' HG3' ' CZ ' ' A' ' 128' ' ' PHE . 0.2 OUTLIER -70.36 -39.69 74.46 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.132 -0.485 . . . . 74.129999999999995 110.945 -179.98 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . 0.672 HD21 HG11 ' A' ' 86' ' ' VAL . 7.4 mp -59.76 -48.16 82.77 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.174 -0.466 . . . . 64.400000000000006 110.927 179.992 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 73.7 mt-30 -65.52 -33.91 77.03 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.186 -0.461 . . . . 71.340000000000003 110.944 179.91 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 96' ' ' MET . . . . . . . . . . . . . 46.7 ttp -59.8 -38.01 80.73 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.193 -0.458 . . . . 75.540000000000006 110.891 179.947 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 97' ' ' LEU . . . . . 0.665 HD22 HG22 ' A' ' 121' ' ' THR . 30.4 mt -72.21 -38.97 68.89 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.226 -0.443 . . . . 74.140000000000001 110.954 179.992 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 98' ' ' LYS . . . . . 0.558 ' HD3' ' CE2' ' A' ' 83' ' ' PHE . 2.3 mmmp? -57.1 -38.36 73.28 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.169 -0.469 . . . . 60.130000000000003 110.945 179.797 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 5.1 m -63.26 -40.32 97.08 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.185 -0.462 . . . . 74.540000000000006 110.872 -179.897 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 100' ' ' GLU . . . . . 0.536 ' O ' HD12 ' A' ' 104' ' ' ILE . 4.2 mm-40 -74.24 -26.46 60.25 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.129 -0.487 . . . . 72.200000000000003 110.894 -179.961 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 101' ' ' PHE . . . . . 0.596 ' CD1' ' O ' ' A' ' 97' ' ' LEU . 12.7 m-30 -59.44 -29.95 68.14 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.171 -0.468 . . . . 72.319999999999993 110.887 -179.94 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 1.9 tmpt? -74.82 -42.43 58.05 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.158 -0.474 . . . . 73.239999999999995 110.86 179.978 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 103' ' ' LYS . . . . . 0.408 ' HG2' ' N ' ' A' ' 104' ' ' ILE . 0.0 OUTLIER -70.13 -37.82 75.4 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.242 -0.436 . . . . 71.219999999999999 110.905 179.885 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 104' ' ' ILE . . . . . 0.536 HD12 ' O ' ' A' ' 100' ' ' GLU . 4.2 mt -63.47 -47.52 91.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.217 -0.447 . . . . 71.319999999999993 111.088 179.888 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 105' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -61.49 -41.09 96.75 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.223 -0.444 . . . . 74.310000000000002 110.879 179.9 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -61.66 -41.05 97.01 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.157 -0.474 . . . . 64.349999999999994 110.877 -179.921 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 8.8 t -81.41 -28.27 34.38 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.15 -0.477 . . . . 54.130000000000003 111.18 -179.986 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 108' ' ' SER . . . . . 0.555 ' HB2' HG22 ' A' ' 113' ' ' ILE . 67.1 m -100.47 17.48 21.52 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.178 -0.464 . . . . 55.399999999999999 110.856 -179.897 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.23 90.86 0.15 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.135 -0.484 . . . . 75.239999999999995 110.875 -179.961 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 137.57 -23.39 3.11 Favored Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.737 -0.744 . . . . 63.340000000000003 112.447 -179.997 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 111' ' ' GLN . . . . . . . . . . . . . 4.7 pt20 -119.64 -156.8 0.68 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.721 0.296 . . . . 74.209999999999994 110.962 -179.903 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 46.8 mt-10 -72.62 139.54 47.45 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.208 -0.451 . . . . 74.120000000000005 110.866 -179.918 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 113' ' ' ILE . . . . . 0.555 HG22 ' HB2' ' A' ' 108' ' ' SER . 4.7 pt -123.22 -24.66 2.25 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.196 -0.457 . . . . 73.340000000000003 111.139 179.96 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 114' ' ' ILE . . . . . 0.481 ' O ' HG23 ' A' ' 118' ' ' THR . 36.9 mm -59.26 -45.13 93.27 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 116.189 -0.46 . . . . 71.239999999999995 111.136 179.856 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 115' ' ' PHE . . . . . 0.785 ' CE1' HD13 ' A' ' 25' ' ' ILE . 28.8 t80 -66.95 -35.29 79.65 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.116 -0.493 . . . . 75.510000000000005 110.865 179.967 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 5.2 mm-40 -66.81 -47.91 70.58 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.154 -0.475 . . . . 73.430000000000007 110.89 -179.888 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 117' ' ' ILE . . . . . 0.558 ' O ' HG23 ' A' ' 121' ' ' THR . 0.3 OUTLIER -64.42 -41.92 93.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.133 -0.485 . . . . 70.219999999999999 111.151 179.959 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 118' ' ' THR . . . . . 0.482 ' N ' ' CG2' ' A' ' 117' ' ' ILE . 66.1 p -67.84 -42.25 81.71 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.208 -0.451 . . . . 64.200000000000003 111.141 179.979 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 6.1 t -66.55 -44.25 82.87 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.229 -0.442 . . . . 60.109999999999999 110.869 -179.876 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 120' ' ' PHE . . . . . 0.407 ' CE2' ' NZ ' ' A' ' 124' ' ' LYS . 0.2 OUTLIER -64.95 -47.08 78.91 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.132 -0.485 . . . . 73.349999999999994 110.88 -179.948 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 121' ' ' THR . . . . . 0.665 HG22 HD22 ' A' ' 97' ' ' LEU . 76.3 p -67.68 -38.96 84.45 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.163 -0.472 . . . . 72.319999999999993 111.159 -179.933 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 9.9 tt0 -64.96 -47.99 75.66 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.238 -0.437 . . . . 71.230000000000004 110.884 179.986 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 3.0 pt-20 -63.73 -39.25 93.84 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.262 -0.426 . . . . 72.140000000000001 110.86 -179.897 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 124' ' ' LYS . . . . . 0.418 ' O ' ' CG ' ' A' ' 127' ' ' GLU . 0.0 OUTLIER -67.49 -40.95 85.25 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.189 -0.46 . . . . 72.420000000000002 110.896 179.948 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 125' ' ' LEU . . . . . 0.882 HD11 ' CA ' ' A' ' 54' ' ' SER . 0.2 OUTLIER -68.95 -36.89 78.46 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.17 -0.468 . . . . 72.219999999999999 110.94 179.944 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 126' ' ' ASP . . . . . 0.417 ' OD1' HG22 ' A' ' 55' ' ' VAL . 7.9 t0 -64.02 -41.96 97.27 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.166 -0.47 . . . . 74.409999999999997 110.889 179.775 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 127' ' ' GLU . . . . . 0.418 ' CG ' ' O ' ' A' ' 124' ' ' LYS . 8.2 pt-20 -69.91 -37.49 75.98 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.152 -0.476 . . . . 75.519999999999996 110.87 -179.882 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 128' ' ' PHE . . . . . 0.579 ' CZ ' ' HG3' ' A' ' 93' ' ' GLN . 1.1 m-85 . . . . . 0 C--N 1.329 -0.316 0 CA-C-N 116.154 -0.476 . . . . 74.129999999999995 110.9 -179.932 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . 0.656 HD13 ' O ' ' A' ' 72' ' ' PRO . 47.9 mt . . . . . 0 C--O 1.231 0.111 0 CA-C-O 120.805 0.336 . . . . 73.319999999999993 110.929 . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -51.5 -32.11 26.33 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.2 -0.455 . . . . 63.310000000000002 110.885 179.836 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 80.6 mm-40 -68.11 -37.75 81.51 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.149 -0.478 . . . . 74.430000000000007 110.903 -179.917 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 22.0 m-85 -59.74 -27.98 66.97 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.214 -0.448 . . . . 72.030000000000001 110.95 -179.857 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -59.54 -37.04 77.34 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.091 -0.504 . . . . 73.099999999999994 110.911 -179.94 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 1.4 mm-40 -64.13 -45.22 89.5 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.105 -0.498 . . . . 73.310000000000002 110.84 -179.944 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 4.2 mp -67.51 -42.64 87.2 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.178 -0.464 . . . . 74.219999999999999 111.184 179.95 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . 0.603 ' HB3' HG21 ' A' ' 46' ' ' ILE . 62.4 mt-30 -65.59 -48.4 72.47 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.168 -0.469 . . . . 75.129999999999995 110.925 179.921 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 4.2 t -58.57 -37.22 75.28 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.223 -0.444 . . . . 71.450000000000003 110.903 -179.942 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -57.79 -33.83 68.97 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.143 -0.481 . . . . 63.130000000000003 110.913 -179.91 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 14.8 mt-10 -66.97 -38.15 85.55 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.141 -0.481 . . . . 64.319999999999993 110.9 -179.992 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.408 ' CD2' HG13 ' A' ' 46' ' ' ILE . 8.9 mp -63.42 -51.34 66.16 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.117 -0.492 . . . . 75.109999999999999 110.911 -179.96 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 3.0 pt-20 -68.48 -34.83 76.6 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.147 -0.478 . . . . 75.209999999999994 110.877 179.949 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -66.49 -50.44 63.29 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.163 -0.471 . . . . 74.150000000000006 111.107 179.923 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . 0.592 HD11 ' HB2' ' A' ' 115' ' ' PHE . 0.8 OUTLIER -74.21 -34.46 37.71 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.261 -0.427 . . . . 74.299999999999997 111.165 179.968 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 38.1 mtp180 -52.9 -34.8 56.55 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.192 -0.458 . . . . 71.239999999999995 110.873 179.91 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -67.13 -35.26 79.35 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.221 -0.445 . . . . 74.5 110.831 -179.762 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . 0.651 HD13 ' CE1' ' A' ' 115' ' ' PHE . 3.2 mt -80.05 -45.09 22.74 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.155 -0.475 . . . . 75.129999999999995 111.126 179.978 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 25.2 m-85 -107.02 45.14 1.0 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.176 -0.465 . . . . 54.219999999999999 110.907 -179.97 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 2.2 mtm -43.08 -54.07 4.56 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.191 -0.459 . . . . 73.430000000000007 110.861 179.911 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -92.99 -24.42 18.37 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.236 -0.438 . . . . 73.230000000000004 110.865 179.987 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 9.1 m-20 -86.99 28.76 0.87 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.182 -0.463 . . . . 62.0 110.861 179.968 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 30' ' ' PHE . . . . . 0.611 ' C ' ' CD1' ' A' ' 30' ' ' PHE . 0.4 OUTLIER -113.5 144.34 43.01 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.222 -0.445 . . . . 72.129999999999995 110.892 -179.917 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 31' ' ' THR . . . . . 0.4 ' N ' ' CD1' ' A' ' 30' ' ' PHE . 52.6 m -123.9 130.07 52.0 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.126 -0.488 . . . . 75.400000000000006 111.092 -179.902 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -96.92 114.14 25.74 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.204 -0.453 . . . . 42.420000000000002 110.844 179.88 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 1.113 HD23 ' N ' ' A' ' 34' ' ' THR . 0.1 OUTLIER -117.17 -18.35 10.01 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.217 -0.447 . . . . 74.140000000000001 110.894 -179.961 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . 1.113 ' N ' HD23 ' A' ' 33' ' ' LEU . 4.9 m . . . . . 0 C--N 1.329 -0.298 0 CA-C-N 116.199 -0.455 . . . . 70.439999999999998 111.122 -179.981 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 45' ' ' GLN . . . . . 0.808 ' HG2' HG23 ' A' ' 47' ' ' ILE . 24.5 pt20 . . . . . 0 C--O 1.232 0.172 0 CA-C-O 120.746 0.307 . . . . 70.349999999999994 110.875 . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 46' ' ' ILE . . . . . 0.699 HG22 ' O ' ' A' ' 45' ' ' GLN . 0.1 OUTLIER 86.68 2.52 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.244 -0.435 . . . . 71.310000000000002 111.182 -179.992 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . 0.808 HG23 ' HG2' ' A' ' 45' ' ' GLN . 0.2 OUTLIER -66.39 147.68 12.48 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.167 -0.47 . . . . 62.240000000000002 111.113 179.864 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 48' ' ' PHE . . . . . 0.926 ' HA ' HD22 ' A' ' 33' ' ' LEU . 6.6 p90 -160.94 163.41 31.86 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.189 -0.46 . . . . 71.319999999999993 110.885 179.977 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . 0.782 ' HG3' HD13 ' A' ' 33' ' ' LEU . 19.1 mt-10 -110.73 157.39 19.8 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.128 -0.487 . . . . 73.5 110.878 -179.929 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . 0.568 HD13 ' HA ' ' A' ' 30' ' ' PHE . 9.5 mm -134.27 135.24 54.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.177 -0.465 . . . . 60.210000000000001 111.136 -179.986 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 99.7 m -85.08 135.08 34.15 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.156 -0.474 . . . . 54.409999999999997 111.131 -179.996 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . 0.574 HD12 HD22 ' A' ' 66' ' ' LEU . 9.1 mt -133.98 156.01 48.95 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.203 -0.453 . . . . 74.150000000000006 110.936 179.978 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 53' ' ' ARG . . . . . 0.619 ' C ' HD21 ' A' ' 125' ' ' LEU . 0.0 OUTLIER -155.92 163.43 39.77 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.174 -0.466 . . . . 74.329999999999998 110.858 179.956 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . 0.687 ' N ' HD21 ' A' ' 125' ' ' LEU . 0.3 OUTLIER -58.72 -169.0 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.174 -0.466 . . . . 33.140000000000001 110.85 -179.753 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -82.51 -37.65 14.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.128 -0.487 . . . . 72.540000000000006 111.131 179.973 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 5.4 t0 -130.43 -153.55 0.57 Allowed 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.157 -0.474 . . . . 50.039999999999999 110.873 179.91 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . 0.442 ' HD2' ' CD ' ' A' ' 61' ' ' GLU . 0.5 OUTLIER -116.94 -11.09 10.85 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.213 -0.449 . . . . 73.319999999999993 110.891 -179.983 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . 0.548 ' HA ' ' C ' ' A' ' 59' ' ' PRO . 1.8 pt-20 -126.6 147.07 59.15 Favored Pre-proline 0 C--N 1.329 -0.3 0 CA-C-O 121.664 0.745 . . . . 64.420000000000002 110.888 179.982 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 59' ' ' PRO . . . . . 0.548 ' C ' ' HA ' ' A' ' 58' ' ' GLU . 53.6 Cg_endo -69.75 -8.38 10.45 Favored 'Cis proline' 0 C--N 1.342 0.217 0 C-N-CA 122.679 -1.8 . . . . 75.530000000000001 112.353 0.011 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 60' ' ' VAL . . . . . 0.43 HG21 ' CG ' ' A' ' 88' ' ' ASN . 14.1 m -149.11 164.77 4.04 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.198 -0.455 . . . . 65.430000000000007 111.143 179.924 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . 0.442 ' CD ' ' HD2' ' A' ' 57' ' ' LYS . 1.9 tp10 -93.95 -28.2 15.93 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.226 -0.443 . . . . 74.209999999999994 110.872 -179.919 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 62' ' ' SER . . . . . 0.869 ' HB3' HD11 ' A' ' 125' ' ' LEU . 5.1 t 40.42 93.82 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.146 -0.479 . . . . 62.399999999999999 110.885 -179.796 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 63' ' ' SER . . . . . 0.429 ' HB2' ' CG ' ' A' ' 53' ' ' ARG . 1.3 t -115.17 123.76 49.73 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.142 -0.481 . . . . 43.140000000000001 110.845 -179.801 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 64' ' ' ILE . . . . . 0.666 HD13 HD11 ' A' ' 94' ' ' LEU . 38.0 mt -134.8 137.49 50.83 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 116.165 -0.471 . . . . 53.009999999999998 111.134 179.934 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 51.6 m -100.16 114.6 28.11 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.159 -0.473 . . . . 73.409999999999997 111.156 179.956 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . 0.945 HD21 HG21 ' A' ' 121' ' ' THR . 1.5 mp -94.04 111.46 23.18 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.22 -0.445 . . . . 72.129999999999995 110.887 179.966 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 1.5 t60 -102.77 111.4 23.7 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.184 -0.462 . . . . 53.109999999999999 110.844 179.831 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 68' ' ' PHE . . . . . 0.571 ' CE1' HG23 ' A' ' 114' ' ' ILE . 0.0 OUTLIER -103.83 142.38 34.48 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.199 -0.455 . . . . 70.019999999999996 110.904 -179.944 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -124.8 121.94 36.0 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.121 -0.491 . . . . 43.399999999999999 111.116 179.93 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 70' ' ' MET . . . . . 0.544 ' CE ' HD11 ' A' ' 114' ' ' ILE . 0.0 OUTLIER -86.61 91.41 8.57 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.205 -0.452 . . . . 75.439999999999998 110.869 179.987 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -43.87 157.24 0.28 Allowed Pre-proline 0 C--N 1.33 -0.256 0 CA-C-O 121.589 0.709 . . . . 72.530000000000001 111.118 -179.932 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 72' ' ' PRO . . . . . 0.656 ' O ' HD13 ' A' ' 8' ' ' LEU . 53.9 Cg_endo -69.7 2.21 3.71 Favored 'Trans proline' 0 C--N 1.341 0.169 0 C-N-CA 122.671 2.247 . . . . 54.32 112.364 179.93 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 73' ' ' MET . . . . . 0.492 ' O ' ' CB ' ' A' ' 76' ' ' TYR . 0.1 OUTLIER -118.57 -25.84 6.33 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.208 -0.451 . . . . 75.099999999999994 110.884 179.943 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 74' ' ' TYR . . . . . 0.658 ' CD1' ' C ' ' A' ' 74' ' ' TYR . 0.0 OUTLIER -47.66 150.45 1.8 Allowed Pre-proline 0 C--N 1.329 -0.316 0 CA-C-O 121.697 0.76 . . . . 73.400000000000006 110.915 -179.875 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 75' ' ' PRO . . . . . 0.552 ' C ' ' HA ' ' A' ' 74' ' ' TYR . 53.4 Cg_endo -69.76 -10.97 11.76 Favored 'Cis proline' 0 C--N 1.341 0.182 0 C-N-CA 122.68 -1.8 . . . . 72.420000000000002 112.348 -0.038 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 76' ' ' TYR . . . . . 0.492 ' CB ' ' O ' ' A' ' 73' ' ' MET . 25.0 t80 -34.03 -52.21 0.44 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.189 -0.459 . . . . 71.530000000000001 110.934 -179.879 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 31.0 p -106.46 -175.74 2.88 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.075 -0.511 . . . . 75.120000000000005 111.066 -179.938 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -100.96 132.37 22.13 Favored Pre-proline 0 C--N 1.329 -0.306 0 CA-C-O 121.552 0.691 . . . . 61.229999999999997 111.08 179.89 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 79' ' ' PRO . . . . . 0.711 ' HG3' HD11 ' A' ' 113' ' ' ILE . 53.7 Cg_endo -69.71 -167.52 0.23 Allowed 'Trans proline' 0 C--N 1.341 0.155 0 C-N-CA 122.672 2.248 . . . . 61.140000000000001 112.339 179.969 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . 0.576 ' O ' HD13 ' A' ' 81' ' ' ILE . 1.7 tt0 -130.0 142.63 50.61 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.164 -0.471 . . . . 61.229999999999997 110.905 -179.983 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 81' ' ' ILE . . . . . 0.576 HD13 ' O ' ' A' ' 80' ' ' GLU . 6.1 mm -133.94 141.68 43.31 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.18 -0.464 . . . . 71.129999999999995 111.135 -179.996 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . 0.473 ' HG3' ' CD ' ' A' ' 84' ' ' LYS . 3.5 pt-20 -147.44 140.3 24.94 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.211 -0.45 . . . . 71.329999999999998 110.878 179.995 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 83' ' ' PHE . . . . . 0.511 ' CD1' HD11 ' A' ' 66' ' ' LEU . 11.8 m-85 -95.71 140.98 29.74 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.114 -0.493 . . . . 64.310000000000002 110.847 -179.899 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 84' ' ' LYS . . . . . 0.473 ' CD ' ' HG3' ' A' ' 82' ' ' GLU . 9.8 mmmt -124.53 171.01 10.34 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.149 -0.478 . . . . 55.5 110.895 179.965 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 85' ' ' ASN . . . . . 0.558 HD22 ' N ' ' A' ' 85' ' ' ASN . 1.1 m-80 63.35 -73.17 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.241 -0.436 . . . . 65.129999999999995 110.891 179.899 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 86' ' ' VAL . . . . . 0.672 HG11 HD21 ' A' ' 94' ' ' LEU . 2.7 m 40.96 94.5 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.142 -0.481 . . . . 62.439999999999998 111.125 179.893 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -97.13 -83.29 0.39 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.136 -0.484 . . . . 62.149999999999999 110.946 179.98 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 88' ' ' ASN . . . . . 0.43 ' CG ' HG21 ' A' ' 60' ' ' VAL . 13.2 t30 -59.99 -40.46 89.26 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.209 -0.45 . . . . 73.430000000000007 110.879 -179.984 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 89' ' ' VAL . . . . . 1.084 HG21 HD13 ' A' ' 94' ' ' LEU . 0.9 OUTLIER -62.58 141.03 18.5 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.157 -0.474 . . . . 74.319999999999993 111.109 179.953 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 90' ' ' MET . . . . . . . . . . . . . 6.8 mtm -97.22 -67.25 0.86 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.149 -0.478 . . . . 71.329999999999998 110.848 179.935 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 6.8 p-10 178.77 -32.4 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.249 -0.432 . . . . 74.409999999999997 110.889 179.997 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -54.55 -46.45 73.64 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.175 -0.466 . . . . 43.310000000000002 110.882 -179.757 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 93' ' ' GLN . . . . . 0.601 ' OE1' ' CE2' ' A' ' 128' ' ' PHE . 1.5 pt20 -70.87 -36.84 72.97 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.136 -0.484 . . . . 72.310000000000002 110.943 -179.98 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . 1.084 HD13 HG21 ' A' ' 89' ' ' VAL . 0.6 OUTLIER -57.66 -47.42 82.31 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.185 -0.461 . . . . 72.510000000000005 110.967 179.991 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 3.5 mm-40 -62.93 -34.09 76.73 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.193 -0.458 . . . . 72.109999999999999 110.913 179.89 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 96' ' ' MET . . . . . . . . . . . . . 19.1 ttp -59.95 -40.04 87.61 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.173 -0.467 . . . . 65.129999999999995 110.912 179.943 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 97' ' ' LEU . . . . . 0.599 ' O ' ' CD1' ' A' ' 101' ' ' PHE . 27.0 mt -68.02 -40.78 82.87 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.204 -0.453 . . . . 71.329999999999998 110.914 179.98 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 98' ' ' LYS . . . . . 0.487 ' HD3' ' CE2' ' A' ' 83' ' ' PHE . 3.7 mmtp -57.26 -36.52 71.08 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.178 -0.465 . . . . 63.450000000000003 110.899 179.857 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -68.93 -43.73 74.51 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.209 -0.45 . . . . 74.209999999999994 110.847 -179.897 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 100' ' ' GLU . . . . . 0.406 ' O ' HD12 ' A' ' 104' ' ' ILE . 37.3 mm-40 -66.82 -24.0 66.11 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.173 -0.467 . . . . 75.049999999999997 110.905 -179.959 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 101' ' ' PHE . . . . . 0.627 ' CD2' HD11 ' A' ' 117' ' ' ILE . 11.1 m-30 -60.53 -37.08 80.03 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.148 -0.478 . . . . 74.340000000000003 110.917 -179.972 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 1.7 tmpt? -63.96 -40.22 95.93 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.112 -0.495 . . . . 75.319999999999993 110.878 -180.0 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 2.3 mppt? -69.48 -40.35 77.12 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.226 -0.443 . . . . 63.25 110.89 179.868 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 104' ' ' ILE . . . . . 0.455 ' O ' ' CG2' ' A' ' 107' ' ' THR . 4.3 mt -64.12 -47.62 89.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.218 -0.446 . . . . 64.420000000000002 111.08 179.913 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 105' ' ' HIS . . . . . 0.474 ' O ' ' N ' ' A' ' 109' ' ' ARG . 3.4 t60 -62.56 -41.28 98.81 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.207 -0.451 . . . . 72.109999999999999 110.854 179.898 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 1.3 t-20 -57.66 -36.95 72.58 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.244 -0.435 . . . . 72.219999999999999 110.905 -179.946 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 107' ' ' THR . . . . . 0.455 ' CG2' ' O ' ' A' ' 104' ' ' ILE . 5.1 t -84.93 -26.1 27.45 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.149 -0.478 . . . . 65.219999999999999 111.141 179.995 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 108' ' ' SER . . . . . 0.49 ' OG ' HG22 ' A' ' 113' ' ' ILE . 27.5 p -109.05 20.87 17.9 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.251 -0.431 . . . . 72.319999999999993 110.885 -179.893 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 109' ' ' ARG . . . . . 0.474 ' N ' ' O ' ' A' ' 105' ' ' HIS . 11.6 ttt180 -62.83 77.48 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.104 -0.498 . . . . 70.319999999999993 110.875 -179.926 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 110' ' ' GLY . . . . . 0.427 ' N ' ' O ' ' A' ' 108' ' ' SER . . . 136.67 33.55 0.23 Allowed Glycine 0 N--CA 1.451 -0.365 0 C-N-CA 120.745 -0.741 . . . . 73.439999999999998 112.488 -179.977 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 111' ' ' GLN . . . . . . . . . . . . . 3.9 pt20 -170.12 -166.27 0.53 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.735 0.302 . . . . 73.319999999999993 110.897 -179.898 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 15.2 mt-10 -68.98 129.98 41.46 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.218 -0.446 . . . . 74.030000000000001 110.914 -179.926 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 113' ' ' ILE . . . . . 0.711 HD11 ' HG3' ' A' ' 79' ' ' PRO . 22.4 pt -126.69 -8.15 4.83 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.202 -0.453 . . . . 71.319999999999993 111.139 179.947 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 114' ' ' ILE . . . . . 0.663 ' O ' HG23 ' A' ' 118' ' ' THR . 42.3 mm -64.88 -44.17 96.25 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-N 116.189 -0.46 . . . . 64.230000000000004 111.127 179.8 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 115' ' ' PHE . . . . . 0.651 ' CE1' HD13 ' A' ' 25' ' ' ILE . 19.2 t80 -68.85 -35.24 76.69 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.208 -0.451 . . . . 73.420000000000002 110.884 179.966 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 35.5 mm-40 -66.48 -46.03 77.69 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.127 -0.488 . . . . 61.530000000000001 110.877 -179.943 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 117' ' ' ILE . . . . . 0.627 HD11 ' CD2' ' A' ' 101' ' ' PHE . 0.4 OUTLIER -64.03 -40.81 90.38 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.149 -0.478 . . . . 73.25 111.168 179.983 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 118' ' ' THR . . . . . 0.663 HG23 ' O ' ' A' ' 114' ' ' ILE . 67.7 p -68.25 -41.56 80.98 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.129 -0.487 . . . . 54.329999999999998 111.136 179.974 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 1.2 t -67.98 -43.5 78.82 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.215 -0.448 . . . . 74.140000000000001 110.871 -179.852 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -66.64 -41.56 88.07 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.174 -0.466 . . . . 74.519999999999996 110.87 -179.971 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 121' ' ' THR . . . . . 0.945 HG21 HD21 ' A' ' 66' ' ' LEU . 11.9 p -67.66 -39.18 84.56 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.119 -0.491 . . . . 51.229999999999997 111.133 -179.926 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 59.1 tt0 -64.99 -50.64 65.53 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.245 -0.434 . . . . 74.349999999999994 110.899 -179.981 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 123' ' ' GLU . . . . . 0.453 ' HG3' ' N ' ' A' ' 124' ' ' LYS . 12.3 pt-20 -60.16 -36.38 77.43 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.173 -0.467 . . . . 62.299999999999997 110.882 -179.921 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 124' ' ' LYS . . . . . 0.49 ' HA ' ' CG ' ' A' ' 127' ' ' GLU . 0.0 OUTLIER -78.52 -32.36 47.99 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.144 -0.48 . . . . 60.310000000000002 110.91 179.942 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 125' ' ' LEU . . . . . 0.869 HD11 ' HB3' ' A' ' 62' ' ' SER . 0.5 OUTLIER -72.25 -41.48 66.74 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.217 -0.447 . . . . 61.509999999999998 110.952 179.903 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -70.37 -46.28 64.4 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.151 -0.477 . . . . 63.049999999999997 110.896 179.835 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 127' ' ' GLU . . . . . 0.571 ' CD ' ' N ' ' A' ' 128' ' ' PHE . 3.1 pp20? -59.15 -50.82 72.56 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.153 -0.476 . . . . 63.439999999999998 110.859 -179.91 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 128' ' ' PHE . . . . . 0.601 ' CE2' ' OE1' ' A' ' 93' ' ' GLN . 0.0 OUTLIER . . . . . 0 C--N 1.329 -0.317 0 CA-C-N 116.145 -0.479 . . . . 75.120000000000005 110.873 -179.881 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.23 0.07 0 CA-C-O 120.789 0.328 . . . . 65.400000000000006 110.883 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 40.5 m -136.96 94.01 2.91 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.23 -0.441 . . . . 70.310000000000002 110.897 -179.869 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -127.46 100.11 5.89 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.085 -0.507 . . . . 74.340000000000003 110.933 179.999 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 57.5 p -163.67 -55.95 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.219 -0.446 . . . . 74.230000000000004 110.806 -179.925 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' HIS . . . . . 0.483 ' HB3' HD12 ' A' ' 6' ' ' LEU . 0.2 OUTLIER -41.9 -65.4 0.46 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.145 -0.479 . . . . 63.0 110.835 179.992 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . 0.483 HD12 ' HB3' ' A' ' 5' ' ' HIS . 6.2 mp -104.74 114.23 28.32 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.205 -0.452 . . . . 74.239999999999995 110.913 -179.94 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . 0.501 HG23 ' HB2' ' A' ' 9' ' ' ASP . 3.0 t -81.86 169.72 16.52 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.181 -0.463 . . . . 74.140000000000001 111.17 179.933 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.687 HD13 ' O ' ' A' ' 72' ' ' PRO . 11.0 mt -55.06 -30.53 59.81 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.249 -0.432 . . . . 71.109999999999999 110.954 179.96 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . 0.501 ' HB2' HG23 ' A' ' 7' ' ' THR . 2.8 m-20 -53.02 -32.18 45.26 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.156 -0.475 . . . . 75.140000000000001 110.834 179.868 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 62.8 mm-40 -64.84 -38.42 90.92 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.193 -0.458 . . . . 60.5 110.893 -179.84 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' TYR . . . . . 0.421 ' CD1' ' HD2' ' A' ' 75' ' ' PRO . 20.7 m-85 -64.16 -25.18 67.97 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.183 -0.462 . . . . 74.120000000000005 110.946 -179.887 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -58.98 -37.4 76.72 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.142 -0.481 . . . . 74.230000000000004 110.926 -179.957 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 1.6 mm-40 -65.91 -43.35 88.44 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.125 -0.489 . . . . 73.439999999999998 110.909 179.978 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 4.3 mp -67.22 -43.24 88.44 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 116.135 -0.484 . . . . 61.100000000000001 111.152 179.968 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . 0.543 ' HB3' HG21 ' A' ' 46' ' ' ILE . 81.7 mt-30 -64.69 -46.28 83.03 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.152 -0.476 . . . . 73.209999999999994 110.911 179.965 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 38.9 t -60.96 -38.84 87.33 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.182 -0.463 . . . . 72.219999999999999 110.847 -179.931 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 1.5 m-20 -58.79 -33.87 70.83 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.172 -0.467 . . . . 74.030000000000001 110.899 -179.878 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 15.6 mt-10 -67.71 -38.59 83.81 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.16 -0.473 . . . . 63.219999999999999 110.865 -179.954 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.469 HD13 ' O ' ' A' ' 15' ' ' GLN . 9.8 mp -61.48 -51.68 67.67 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.176 -0.466 . . . . 75.030000000000001 110.932 179.989 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 2.5 pt-20 -68.86 -34.6 75.73 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.192 -0.458 . . . . 75.140000000000001 110.895 179.958 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -65.35 -45.79 82.77 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.142 -0.481 . . . . 72.530000000000001 111.114 179.948 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . 0.783 ' HA ' HD12 ' A' ' 25' ' ' ILE . 0.5 OUTLIER -77.2 -34.59 21.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.186 -0.461 . . . . 73.340000000000003 111.14 179.944 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -53.39 -35.59 60.53 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.177 -0.465 . . . . 75.400000000000006 110.841 179.98 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -66.79 -31.43 72.06 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.167 -0.47 . . . . 72.150000000000006 110.863 -179.77 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . 0.783 HD12 ' HA ' ' A' ' 22' ' ' ILE . 5.0 mt -79.72 -45.09 23.3 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.163 -0.472 . . . . 73.109999999999999 111.112 179.943 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 38.4 m-85 -111.51 45.73 1.18 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.187 -0.46 . . . . 74.310000000000002 110.928 -179.988 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' MET . . . . . 0.44 ' HE2' ' H ' ' A' ' 27' ' ' MET . 0.2 OUTLIER -40.85 -40.56 1.39 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.131 -0.486 . . . . 73.319999999999993 110.884 179.909 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 11.4 m-20 -106.07 -27.2 11.27 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.204 -0.453 . . . . 75.120000000000005 110.887 179.942 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 10.7 m-20 -85.05 29.57 0.64 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.196 -0.456 . . . . 73.040000000000006 110.853 179.998 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' PHE . . . . . 0.545 ' C ' ' CD1' ' A' ' 30' ' ' PHE . 0.3 OUTLIER -113.21 146.04 39.98 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.229 -0.442 . . . . 64.340000000000003 110.853 -179.929 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 42.5 m -122.89 132.9 54.38 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.117 -0.492 . . . . 64.010000000000005 111.17 -179.928 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -98.33 114.72 27.12 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.257 -0.428 . . . . 75.200000000000003 110.852 179.923 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.952 HD21 HG12 ' A' ' 47' ' ' ILE . 0.3 OUTLIER -120.53 -16.47 8.31 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.147 -0.479 . . . . 74.040000000000006 110.951 -179.982 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . 0.787 ' N ' HD23 ' A' ' 33' ' ' LEU . 0.9 OUTLIER -49.22 160.18 0.24 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.154 -0.476 . . . . 72.540000000000006 111.14 179.918 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -75.54 50.32 0.53 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.176 -0.465 . . . . 62.420000000000002 110.887 179.897 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . 0.442 ' O ' ' C ' ' A' ' 37' ' ' LYS . 22.3 mtp180 -114.84 -41.05 3.42 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.217 -0.447 . . . . 74.340000000000003 110.877 179.962 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . 0.442 ' C ' ' O ' ' A' ' 36' ' ' ARG . 1.0 OUTLIER -34.01 134.44 0.18 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.213 -0.448 . . . . 54.43 110.95 179.928 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER 71.03 -78.24 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.213 -0.449 . . . . 72.0 110.839 -179.85 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . 0.405 ' O ' ' O ' ' A' ' 36' ' ' ARG . 6.2 m -64.62 -175.68 0.2 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.156 -0.474 . . . . 51.240000000000002 110.884 -179.806 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' TRP . . . . . . . . . . . . . 34.7 t-105 -95.51 -44.9 7.31 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.167 -0.469 . . . . 75.209999999999994 110.956 179.979 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -179.34 131.81 0.11 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.21 -0.45 . . . . 74.239999999999995 110.859 179.919 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . 0.431 ' C ' ' CD ' ' A' ' 44' ' ' PRO . 0.1 OUTLIER -129.23 -89.6 0.5 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.21 -0.45 . . . . 70.540000000000006 110.876 -179.968 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . 0.487 ' N ' ' CD ' ' A' ' 44' ' ' PRO . 2.9 mt-30 -119.28 50.81 1.49 Allowed Pre-proline 0 C--N 1.329 -0.293 0 CA-C-O 121.616 0.722 . . . . 73.219999999999999 110.908 179.981 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' PRO . . . . . 0.487 ' CD ' ' N ' ' A' ' 43' ' ' GLN . 53.4 Cg_endo -69.74 144.96 55.82 Favored 'Trans proline' 0 C--N 1.342 0.22 0 C-N-CA 122.675 2.25 . . . . 53.200000000000003 112.319 -179.985 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' GLN . . . . . 0.614 ' HB3' HD12 ' A' ' 47' ' ' ILE . 32.0 tt0 -121.99 6.3 9.82 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.185 -0.461 . . . . 73.340000000000003 110.957 179.951 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . 0.576 HG22 ' O ' ' A' ' 45' ' ' GLN . 0.0 OUTLIER 84.1 -28.26 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.147 -0.479 . . . . 72.430000000000007 111.134 179.958 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . 0.952 HG12 HD21 ' A' ' 33' ' ' LEU . 0.2 OUTLIER -43.32 148.3 0.21 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.157 -0.474 . . . . 74.209999999999994 111.12 179.866 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' PHE . . . . . 0.768 ' HA ' HD22 ' A' ' 33' ' ' LEU . 5.8 p90 -156.53 158.05 36.48 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.197 -0.456 . . . . 70.019999999999996 110.909 179.933 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . 0.701 ' CG ' HD13 ' A' ' 33' ' ' LEU . 40.1 mt-10 -108.99 152.0 25.56 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.128 -0.487 . . . . 73.230000000000004 110.846 -179.891 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . 0.458 HD13 ' HA ' ' A' ' 30' ' ' PHE . 23.2 mm -131.46 137.03 56.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.157 -0.474 . . . . 71.420000000000002 111.101 179.963 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 75.9 m -84.67 124.3 31.33 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.164 -0.471 . . . . 73.349999999999994 111.104 179.974 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . 0.63 HD12 HD22 ' A' ' 66' ' ' LEU . 20.7 mt -126.8 159.55 33.49 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.222 -0.445 . . . . 61.340000000000003 110.886 179.95 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' ARG . . . . . 0.517 ' C ' HD21 ' A' ' 125' ' ' LEU . 0.1 OUTLIER -179.88 168.23 1.31 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.166 -0.47 . . . . 74.450000000000003 110.931 179.944 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . 0.659 ' N ' HD21 ' A' ' 125' ' ' LEU . 16.3 p -56.14 -173.26 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.22 -0.445 . . . . 44.420000000000002 110.869 -179.808 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 18.1 m -94.21 -28.1 4.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.135 -0.484 . . . . 74.200000000000003 111.105 179.94 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 1.6 t0 -121.55 -164.07 1.11 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.224 -0.444 . . . . 71.530000000000001 110.862 179.966 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 3.1 mmmm -118.39 -12.88 9.82 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.196 -0.456 . . . . 72.420000000000002 110.89 179.987 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . 0.563 ' HA ' ' C ' ' A' ' 59' ' ' PRO . 68.1 mt-10 -121.38 145.51 42.61 Favored Pre-proline 0 C--N 1.329 -0.287 0 CA-C-O 121.636 0.732 . . . . 73.040000000000006 110.895 179.972 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' PRO . . . . . 0.563 ' C ' ' HA ' ' A' ' 58' ' ' GLU . 53.7 Cg_endo -69.75 -9.42 10.98 Favored 'Cis proline' 0 C--O 1.231 0.172 0 C-N-CA 122.701 -1.791 . . . . 73.099999999999994 112.326 0.035 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 60' ' ' VAL . . . . . 0.641 HG22 ' CG ' ' A' ' 129' ' ' GLN . 21.7 m -146.31 178.96 1.06 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.241 -0.436 . . . . 75.329999999999998 111.134 179.91 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . 0.458 ' O ' ' C ' ' A' ' 62' ' ' SER . 15.2 tt0 -108.04 -18.43 13.79 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.169 -0.469 . . . . 65.0 110.886 -179.933 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . 0.458 ' C ' ' O ' ' A' ' 61' ' ' GLU . 0.9 OUTLIER 33.8 77.56 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.167 -0.47 . . . . 61.020000000000003 110.87 -179.794 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -102.87 126.76 50.15 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.143 -0.48 . . . . 63.43 110.849 -179.804 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 64' ' ' ILE . . . . . . . . . . . . . 21.1 mt -140.24 143.29 29.88 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 116.175 -0.466 . . . . 70.030000000000001 111.102 179.947 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 92.1 m -106.98 118.94 38.02 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.169 -0.469 . . . . 63.240000000000002 111.083 179.99 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . 0.71 HD21 HG21 ' A' ' 121' ' ' THR . 1.7 mp -100.09 114.0 27.03 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.198 -0.456 . . . . 70.200000000000003 110.924 179.913 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 67' ' ' HIS . . . . . 0.492 ' CE1' HD11 ' A' ' 33' ' ' LEU . 7.5 t60 -108.4 113.28 26.22 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.233 -0.44 . . . . 75.430000000000007 110.798 179.888 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 68' ' ' PHE . . . . . 0.56 ' CE1' HG23 ' A' ' 114' ' ' ILE . 0.0 OUTLIER -103.98 139.96 38.38 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.197 -0.456 . . . . 74.409999999999997 110.866 -179.937 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -119.66 119.46 33.79 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.135 -0.484 . . . . 73.030000000000001 111.108 179.94 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 70' ' ' MET . . . . . 0.491 ' CE ' HD11 ' A' ' 114' ' ' ILE . 2.5 mmt -84.25 89.41 7.33 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.223 -0.444 . . . . 74.409999999999997 110.919 179.946 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -45.02 157.76 0.32 Allowed Pre-proline 0 C--N 1.33 -0.274 0 CA-C-O 121.583 0.706 . . . . 71.129999999999995 111.124 -179.903 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 72' ' ' PRO . . . . . 0.687 ' O ' HD13 ' A' ' 8' ' ' LEU . 54.0 Cg_endo -69.77 2.87 3.15 Favored 'Trans proline' 0 C--N 1.341 0.173 0 C-N-CA 122.643 2.229 . . . . 53.009999999999998 112.368 179.899 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 73' ' ' MET . . . . . 0.486 ' O ' ' CB ' ' A' ' 76' ' ' TYR . 0.0 OUTLIER -117.7 -26.38 6.58 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.23 -0.441 . . . . 74.030000000000001 110.879 179.918 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 74' ' ' TYR . . . . . 0.637 ' CD1' ' C ' ' A' ' 74' ' ' TYR . 0.0 OUTLIER -47.14 148.71 1.95 Allowed Pre-proline 0 C--N 1.328 -0.327 0 CA-C-O 121.712 0.768 . . . . 64.129999999999995 110.915 -179.862 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 75' ' ' PRO . . . . . 0.561 ' C ' ' HA ' ' A' ' 74' ' ' TYR . 54.1 Cg_endo -69.78 -13.46 12.44 Favored 'Cis proline' 0 C--N 1.342 0.185 0 C-N-CA 122.67 -1.804 . . . . 74.140000000000001 112.361 -0.009 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 76' ' ' TYR . . . . . 0.486 ' CB ' ' O ' ' A' ' 73' ' ' MET . 9.4 t80 -34.95 -46.3 0.3 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.207 -0.452 . . . . 62.439999999999998 110.867 -179.866 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 77' ' ' THR . . . . . 0.449 HG23 ' CB ' ' A' ' 73' ' ' MET . 66.7 p -111.58 177.7 4.57 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.14 -0.482 . . . . 75.450000000000003 111.16 -179.953 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -98.33 135.03 21.39 Favored Pre-proline 0 C--N 1.328 -0.327 0 CA-C-O 121.578 0.704 . . . . 72.239999999999995 111.058 179.893 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 79' ' ' PRO . . . . . 0.806 ' HG3' HD11 ' A' ' 113' ' ' ILE . 53.5 Cg_endo -69.74 -167.27 0.22 Allowed 'Trans proline' 0 C--N 1.341 0.159 0 C-N-CA 122.667 2.245 . . . . 33.509999999999998 112.374 179.97 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -131.09 127.23 37.72 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.259 -0.428 . . . . 51.140000000000001 110.853 -179.97 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 81' ' ' ILE . . . . . 0.507 HD13 ' HA ' ' A' ' 68' ' ' PHE . 10.0 mm -119.54 140.59 43.03 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.144 -0.48 . . . . 74.329999999999998 111.202 179.9 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . 0.471 ' HG3' ' CD ' ' A' ' 84' ' ' LYS . 1.0 OUTLIER -146.27 137.92 24.79 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.229 -0.441 . . . . 71.230000000000004 110.908 179.969 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 83' ' ' PHE . . . . . 0.45 ' CD1' HD11 ' A' ' 66' ' ' LEU . 9.9 m-85 -93.48 140.0 30.08 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.158 -0.474 . . . . 71.340000000000003 110.871 -179.919 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 84' ' ' LYS . . . . . 0.471 ' CD ' ' HG3' ' A' ' 82' ' ' GLU . 10.6 mmmt -123.78 172.0 9.2 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.14 -0.482 . . . . 74.129999999999995 110.914 179.956 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . 0.478 HD22 ' N ' ' A' ' 85' ' ' ASN . 1.5 m-80 62.8 -74.19 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.23 -0.441 . . . . 74.109999999999999 110.947 179.971 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 86' ' ' VAL . . . . . 0.522 HG12 HD21 ' A' ' 94' ' ' LEU . 3.5 m 41.54 91.15 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.158 -0.473 . . . . 74.439999999999998 111.078 179.859 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -97.19 -85.72 0.35 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.179 -0.464 . . . . 72.540000000000006 110.893 179.979 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -52.58 -46.38 66.87 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.222 -0.444 . . . . 74.299999999999997 110.865 -179.943 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 89' ' ' VAL . . . . . 0.479 HG21 ' CD2' ' A' ' 94' ' ' LEU . 0.7 OUTLIER -60.45 141.38 17.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.221 -0.445 . . . . 71.120000000000005 111.154 179.926 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 90' ' ' MET . . . . . 0.432 ' C ' ' OD1' ' A' ' 91' ' ' ASP . 7.6 mtm -95.71 -54.76 3.24 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.181 -0.463 . . . . 75.140000000000001 110.895 179.979 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 91' ' ' ASP . . . . . 0.432 ' OD1' ' C ' ' A' ' 90' ' ' MET . 1.3 p-10 175.36 -34.58 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.184 -0.462 . . . . 63.5 110.874 179.911 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -54.55 -40.27 68.53 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.238 -0.437 . . . . 74.219999999999999 110.826 -179.77 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 93' ' ' GLN . . . . . 0.577 ' HG3' ' CZ ' ' A' ' 128' ' ' PHE . 1.5 mp0 -70.98 -37.46 72.74 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.134 -0.484 . . . . 70.430000000000007 110.95 -179.979 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . 0.522 HD21 HG12 ' A' ' 86' ' ' VAL . 39.5 mt -65.58 -49.21 69.68 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.187 -0.461 . . . . 75.120000000000005 110.941 179.95 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 41.2 mt-30 -65.91 -34.02 77.17 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.141 -0.481 . . . . 65.150000000000006 110.904 179.937 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 96' ' ' MET . . . . . . . . . . . . . 2.3 ttp -60.08 -41.15 91.83 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.194 -0.457 . . . . 75.230000000000004 110.839 -179.971 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 97' ' ' LEU . . . . . 0.855 HD22 HG22 ' A' ' 121' ' ' THR . 34.3 mt -65.99 -39.69 90.52 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.201 -0.454 . . . . 63.43 110.871 -179.941 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 98' ' ' LYS . . . . . 0.411 ' HD3' ' CZ ' ' A' ' 83' ' ' PHE . 3.2 mmtp -55.31 -39.33 69.8 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.19 -0.459 . . . . 74.219999999999999 110.892 179.846 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -66.24 -37.84 86.46 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.239 -0.437 . . . . 44.219999999999999 110.89 -179.917 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 100' ' ' GLU . . . . . 0.611 ' O ' HD12 ' A' ' 104' ' ' ILE . 2.4 mm-40 -74.14 -24.57 59.44 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.113 -0.494 . . . . 64.239999999999995 110.818 -179.924 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 101' ' ' PHE . . . . . 0.621 ' CD2' HD11 ' A' ' 117' ' ' ILE . 10.8 m-30 -59.38 -26.88 65.48 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.222 -0.444 . . . . 73.120000000000005 110.935 -179.929 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.27 -42.98 64.97 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.107 -0.497 . . . . 64.510000000000005 110.899 179.968 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.76 -40.87 84.0 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.213 -0.449 . . . . 64.340000000000003 110.917 179.862 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 104' ' ' ILE . . . . . 0.66 HD11 ' CD2' ' A' ' 120' ' ' PHE . 2.6 mt -63.55 -47.6 90.74 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.225 -0.443 . . . . 72.349999999999994 111.111 179.863 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 105' ' ' HIS . . . . . 0.478 ' O ' ' N ' ' A' ' 109' ' ' ARG . 28.2 t-80 -62.89 -42.51 99.8 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.148 -0.478 . . . . 71.510000000000005 110.888 179.912 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -56.52 -40.9 75.81 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.164 -0.471 . . . . 74.019999999999996 110.865 -179.924 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 107' ' ' THR . . . . . 0.449 HG22 ' O ' ' A' ' 104' ' ' ILE . 8.0 t -80.47 -31.18 37.42 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.222 -0.444 . . . . 55.340000000000003 111.146 -179.97 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 108' ' ' SER . . . . . 0.706 ' HB3' HG22 ' A' ' 113' ' ' ILE . 0.5 OUTLIER -103.9 21.91 15.48 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.201 -0.454 . . . . 43.439999999999998 110.877 -179.901 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 109' ' ' ARG . . . . . 0.478 ' N ' ' O ' ' A' ' 105' ' ' HIS . 0.0 OUTLIER -62.0 84.9 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.125 -0.488 . . . . 71.340000000000003 110.846 -179.93 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 110' ' ' GLY . . . . . 0.443 ' HA2' ' CB ' ' A' ' 75' ' ' PRO . . . 134.19 -23.15 3.7 Favored Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.705 -0.759 . . . . 65.219999999999999 112.452 179.988 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 111' ' ' GLN . . . . . . . . . . . . . 2.6 pt20 -109.06 -171.81 1.92 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.757 0.313 . . . . 73.530000000000001 110.894 -179.858 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 20.1 mt-10 -66.03 134.55 53.13 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.181 -0.463 . . . . 75.540000000000006 110.905 -179.987 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 113' ' ' ILE . . . . . 0.806 HD11 ' HG3' ' A' ' 79' ' ' PRO . 24.8 pt -123.23 -7.8 7.88 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.172 -0.467 . . . . 75.230000000000004 111.154 179.915 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 114' ' ' ILE . . . . . 0.83 ' O ' HG23 ' A' ' 118' ' ' THR . 28.6 mm -64.18 -44.19 97.46 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.161 -0.472 . . . . 73.209999999999994 111.101 179.865 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 115' ' ' PHE . . . . . 0.716 ' CD1' HD13 ' A' ' 25' ' ' ILE . 28.2 t80 -72.08 -36.9 69.65 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.194 -0.457 . . . . 71.439999999999998 110.864 179.99 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 50.2 mm-40 -65.93 -47.63 74.08 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.165 -0.47 . . . . 72.129999999999995 110.868 -179.927 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 117' ' ' ILE . . . . . 0.621 HD11 ' CD2' ' A' ' 101' ' ' PHE . 0.9 OUTLIER -64.26 -41.55 92.74 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.19 -0.459 . . . . 51.340000000000003 111.127 179.965 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 118' ' ' THR . . . . . 0.83 HG23 ' O ' ' A' ' 114' ' ' ILE . 71.1 p -68.03 -42.55 80.44 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.192 -0.458 . . . . 74.329999999999998 111.14 179.975 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 2.8 m -66.88 -43.48 83.4 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.249 -0.432 . . . . 54.25 110.861 -179.859 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 120' ' ' PHE . . . . . 0.66 ' CD2' HD11 ' A' ' 104' ' ' ILE . 0.3 OUTLIER -61.78 -47.65 84.23 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.115 -0.493 . . . . 73.219999999999999 110.871 -179.941 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 121' ' ' THR . . . . . 0.855 HG22 HD22 ' A' ' 97' ' ' LEU . 73.4 p -67.81 -40.76 83.83 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.13 -0.486 . . . . 61.140000000000001 111.116 -179.893 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 47.6 tt0 -64.3 -48.8 74.26 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.203 -0.453 . . . . 55.350000000000001 110.896 -179.94 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 123' ' ' GLU . . . . . 0.54 ' CG ' ' N ' ' A' ' 124' ' ' LYS . 3.5 pt-20 -61.84 -50.54 71.85 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.194 -0.457 . . . . 74.239999999999995 110.855 -179.929 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 124' ' ' LYS . . . . . 0.54 ' N ' ' CG ' ' A' ' 123' ' ' GLU . 0.0 OUTLIER -65.6 -37.18 85.88 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.159 -0.473 . . . . 63.340000000000003 110.871 -179.991 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 125' ' ' LEU . . . . . 0.659 HD21 ' N ' ' A' ' 54' ' ' SER . 1.1 tp -64.34 -51.5 63.09 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.249 -0.432 . . . . 71.540000000000006 110.912 179.901 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -57.2 -45.4 83.82 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.212 -0.449 . . . . 62.409999999999997 110.878 179.86 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 127' ' ' GLU . . . . . 0.448 ' HG3' ' N ' ' A' ' 128' ' ' PHE . 0.4 OUTLIER -61.27 -29.39 69.82 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.218 -0.446 . . . . 74.219999999999999 110.851 -179.885 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 128' ' ' PHE . . . . . 0.577 ' CZ ' ' HG3' ' A' ' 93' ' ' GLN . 0.3 OUTLIER -61.05 -69.04 0.25 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.18 -0.463 . . . . 71.310000000000002 110.863 -179.942 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 129' ' ' GLN . . . . . 0.641 ' CG ' HG22 ' A' ' 60' ' ' VAL . 0.9 OUTLIER -34.38 -37.01 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.155 -0.475 . . . . 74.140000000000001 110.902 -179.906 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 130' ' ' ASN . . . . . 0.42 ' N ' ' O ' ' A' ' 128' ' ' PHE . 2.5 t-20 -69.17 -48.47 62.11 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.247 -0.433 . . . . 61.219999999999999 110.859 -179.967 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 131' ' ' VAL . . . . . 0.489 ' N ' ' O ' ' A' ' 128' ' ' PHE . 4.4 m -126.45 80.23 0.67 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.144 -0.48 . . . . 75.450000000000003 111.109 179.97 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 132' ' ' VAL . . . . . . . . . . . . . 7.9 p -115.82 141.83 31.55 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.177 -0.465 . . . . 64.239999999999995 111.161 179.911 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 133' ' ' ASN . . . . . . . . . . . . . 34.1 t30 -69.78 82.06 0.45 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.214 -0.448 . . . . 64.400000000000006 110.841 -179.963 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 134' ' ' THR . . . . . . . . . . . . . 14.8 t -64.52 152.34 42.09 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.211 -0.45 . . . . 65.040000000000006 111.107 -179.97 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 27.9 tt0 -154.55 -39.44 0.09 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.24 -0.436 . . . . 62.43 110.883 -179.999 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 55.1 m 60.97 149.97 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.215 -0.448 . . . . 74.219999999999999 110.841 -179.803 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 137' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER 43.4 87.86 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.142 -0.481 . . . . 72.340000000000003 110.874 179.985 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--N 1.33 -0.264 0 CA-C-N 116.188 -0.46 . . . . 63.240000000000002 110.898 179.905 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.231 0.079 0 CA-C-O 120.753 0.311 . . . . 61.140000000000001 110.922 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 19.4 t -105.78 86.95 2.48 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.208 -0.451 . . . . 72.299999999999997 110.867 -179.764 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -120.17 -175.95 3.1 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.135 -0.484 . . . . 64.25 110.932 -179.985 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 3.6 m -111.44 120.88 43.64 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.242 -0.436 . . . . 71.439999999999998 110.874 -179.946 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' HIS . . . . . 0.419 ' NE2' ' CE1' ' A' ' 11' ' ' TYR . 23.6 t-80 -80.29 109.1 14.45 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.112 -0.495 . . . . 74.420000000000002 110.862 179.987 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -155.73 -48.95 0.08 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.225 -0.443 . . . . 71.140000000000001 110.935 -179.97 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . 0.415 ' CG2' ' HB3' ' A' ' 9' ' ' ASP . 12.2 t -86.56 162.65 17.9 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.228 -0.442 . . . . 74.099999999999994 111.173 179.89 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.532 HD13 ' O ' ' A' ' 72' ' ' PRO . 24.4 mt -68.73 -26.19 65.12 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.193 -0.458 . . . . 61.240000000000002 110.93 179.964 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . 0.415 ' HB3' ' CG2' ' A' ' 7' ' ' THR . 0.1 OUTLIER -49.93 -34.08 19.47 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.195 -0.457 . . . . 73.120000000000005 110.868 179.794 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 7.0 mm100 -68.11 -39.26 82.84 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.181 -0.463 . . . . 53.520000000000003 110.847 -179.863 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' TYR . . . . . 0.419 ' CE1' ' NE2' ' A' ' 5' ' ' HIS . 18.2 m-85 -58.9 -27.41 65.2 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.229 -0.441 . . . . 70.409999999999997 110.927 -179.858 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -60.72 -37.12 80.66 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.146 -0.479 . . . . 74.120000000000005 110.907 -179.906 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 3.1 mm-40 -58.58 -43.35 89.44 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.142 -0.481 . . . . 72.120000000000005 110.901 179.974 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 3.1 mp -66.06 -43.02 92.56 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.123 -0.489 . . . . 75.109999999999999 111.157 179.963 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . 0.49 ' HB3' HG21 ' A' ' 46' ' ' ILE . 73.0 mt-30 -62.62 -42.2 99.45 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.165 -0.47 . . . . 71.319999999999993 110.907 179.943 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -61.1 -42.02 97.76 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.187 -0.46 . . . . 73.230000000000004 110.89 -179.948 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 1.5 m-20 -59.04 -33.72 71.08 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.165 -0.47 . . . . 43.43 110.9 -179.889 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 1.7 mt-10 -64.74 -37.89 89.15 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.18 -0.464 . . . . 73.239999999999995 110.866 -179.966 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.407 ' CD2' HG13 ' A' ' 46' ' ' ILE . 7.2 mp -66.15 -51.61 56.27 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.159 -0.473 . . . . 73.329999999999998 110.93 -179.989 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -68.74 -33.35 73.76 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.171 -0.468 . . . . 73.519999999999996 110.925 179.923 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -66.44 -50.57 62.92 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.109 -0.496 . . . . 63.329999999999998 111.121 179.919 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . 0.75 HD11 ' HB2' ' A' ' 115' ' ' PHE . 0.5 OUTLIER -73.37 -37.15 50.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.201 -0.454 . . . . 72.519999999999996 111.176 179.968 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 30.8 mtp180 -52.79 -34.5 53.72 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.131 -0.486 . . . . 71.400000000000006 110.918 179.937 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -66.75 -31.2 71.69 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.187 -0.461 . . . . 61.200000000000003 110.844 -179.799 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . 0.771 HG21 ' HE1' ' A' ' 115' ' ' PHE . 3.5 mt -85.08 -44.5 17.33 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.142 -0.481 . . . . 52.340000000000003 111.123 179.926 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 27.7 m-85 -107.06 42.76 1.25 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.202 -0.453 . . . . 74.340000000000003 110.888 -179.925 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 1.9 mtm -41.29 -45.82 3.06 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.096 -0.502 . . . . 65.349999999999994 110.902 179.891 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -101.68 -14.23 17.46 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.202 -0.453 . . . . 70.200000000000003 110.878 179.928 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 3.1 m-20 -97.66 21.03 10.92 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.182 -0.463 . . . . 72.519999999999996 110.873 179.984 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' PHE . . . . . 0.75 ' HA ' HD13 ' A' ' 50' ' ' ILE . 5.4 t80 -109.87 137.23 47.95 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.204 -0.453 . . . . 73.310000000000002 110.878 -179.916 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 59.3 m -116.51 134.8 54.43 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.134 -0.485 . . . . 70.310000000000002 111.156 -179.914 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . 0.456 ' O ' ' CG ' ' A' ' 32' ' ' ASP . 0.0 OUTLIER -99.22 117.34 33.47 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.225 -0.443 . . . . 74.420000000000002 110.867 179.89 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.916 HD21 HG12 ' A' ' 47' ' ' ILE . 0.2 OUTLIER -121.19 -21.4 6.42 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.194 -0.457 . . . . 71.239999999999995 110.918 -179.972 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . 0.896 ' N ' HD23 ' A' ' 33' ' ' LEU . 0.6 OUTLIER -45.76 153.02 0.3 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.204 -0.453 . . . . 71.120000000000005 111.108 179.918 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -91.48 67.41 5.6 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.175 -0.466 . . . . 73.510000000000005 110.943 179.835 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . 0.409 ' CG ' ' HB ' ' A' ' 34' ' ' THR . 0.0 OUTLIER -116.71 152.52 34.14 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.233 -0.439 . . . . 70.219999999999999 110.854 -179.975 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . 0.402 ' O ' ' O ' ' A' ' 38' ' ' SER . 2.0 mmpt? 54.85 -92.57 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.19 -0.459 . . . . 73.450000000000003 110.947 179.977 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . 0.402 ' O ' ' O ' ' A' ' 37' ' ' LYS . 0.2 OUTLIER -52.29 -172.86 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.192 -0.458 . . . . 72.209999999999994 110.859 -179.936 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 3.1 m 75.64 -173.76 0.11 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.133 -0.485 . . . . 71.409999999999997 110.86 -179.811 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' TRP . . . . . . . . . . . . . 34.1 p90 -114.71 -4.04 12.78 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.143 -0.48 . . . . 70.010000000000005 110.911 -179.981 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -132.79 157.37 45.15 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.222 -0.444 . . . . 62.149999999999999 110.872 179.924 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . 0.431 ' C ' ' CD ' ' A' ' 44' ' ' PRO . 0.0 OUTLIER -121.28 72.88 1.01 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.191 -0.458 . . . . 63.240000000000002 110.877 179.993 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . 0.552 ' N ' ' CD ' ' A' ' 44' ' ' PRO . 0.8 OUTLIER -120.51 47.96 1.22 Allowed Pre-proline 0 C--N 1.329 -0.313 0 CA-C-O 121.577 0.703 . . . . 75.129999999999995 110.95 179.935 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' PRO . . . . . 0.552 ' CD ' ' N ' ' A' ' 43' ' ' GLN . 54.0 Cg_endo -69.74 128.32 15.87 Favored 'Trans proline' 0 C--N 1.341 0.171 0 C-N-CA 122.656 2.237 . . . . 74.239999999999995 112.34 -179.998 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' GLN . . . . . 0.567 ' O ' HG22 ' A' ' 46' ' ' ILE . 15.7 tt0 -107.79 11.46 28.2 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.24 -0.436 . . . . 70.120000000000005 110.908 179.999 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . 0.567 HG22 ' O ' ' A' ' 45' ' ' GLN . 0.2 OUTLIER 83.57 -29.55 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.21 -0.45 . . . . 73.439999999999998 111.163 -179.991 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . 0.916 HG12 HD21 ' A' ' 33' ' ' LEU . 0.2 OUTLIER -45.1 146.14 0.44 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.151 -0.477 . . . . 63.200000000000003 111.145 179.827 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' PHE . . . . . 0.854 ' HA ' HD22 ' A' ' 33' ' ' LEU . 5.3 p90 -150.82 163.09 39.47 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.157 -0.474 . . . . 55.009999999999998 110.881 179.964 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . 0.818 ' HG3' HD13 ' A' ' 33' ' ' LEU . 33.5 mt-10 -108.87 149.57 28.93 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.147 -0.478 . . . . 60.140000000000001 110.863 -179.9 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . 0.75 HD13 ' HA ' ' A' ' 30' ' ' PHE . 6.2 mm -131.74 136.27 57.35 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.138 -0.483 . . . . 65.230000000000004 111.098 179.982 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 50.7 m -83.75 130.96 34.95 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.172 -0.467 . . . . 54.210000000000001 111.157 179.947 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . 0.673 HD12 HD12 ' A' ' 66' ' ' LEU . 12.6 mt -133.46 156.44 47.73 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.221 -0.445 . . . . 73.230000000000004 110.898 179.962 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -175.09 168.06 3.45 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.207 -0.451 . . . . 71.310000000000002 110.916 179.977 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 1.7 m -60.88 168.21 2.47 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.207 -0.452 . . . . 74.530000000000001 110.859 -179.837 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 35.0 m -80.54 -29.58 12.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.137 -0.483 . . . . 74.310000000000002 111.089 179.943 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -114.56 -169.69 1.59 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.214 -0.448 . . . . 44.200000000000003 110.873 179.944 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 5.1 mmmt -115.64 -21.93 9.45 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.2 -0.455 . . . . 73.530000000000001 110.92 179.998 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . 0.548 ' HA ' ' C ' ' A' ' 59' ' ' PRO . 8.3 pt-20 -113.6 144.49 31.47 Favored Pre-proline 0 C--N 1.33 -0.258 0 CA-C-O 121.65 0.738 . . . . 54.030000000000001 110.913 179.932 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 59' ' ' PRO . . . . . 0.548 ' C ' ' HA ' ' A' ' 58' ' ' GLU . 53.6 Cg_endo -69.77 -7.39 9.97 Favored 'Cis proline' 0 C--N 1.341 0.144 0 C-N-CA 122.646 -1.814 . . . . 75.310000000000002 112.348 -0.036 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 60' ' ' VAL . . . . . 0.641 HG22 ' HG2' ' A' ' 129' ' ' GLN . 13.2 m -154.37 -179.92 0.3 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.176 -0.465 . . . . 74.310000000000002 111.122 179.877 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . 0.464 ' O ' ' C ' ' A' ' 62' ' ' SER . 1.2 pt-20 -112.83 -16.25 12.77 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.171 -0.468 . . . . 62.32 110.909 -179.953 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . 0.464 ' C ' ' O ' ' A' ' 61' ' ' GLU . 0.3 OUTLIER 33.14 91.54 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.126 -0.488 . . . . 52.030000000000001 110.867 -179.825 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 3.9 m -102.93 123.13 45.97 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.106 -0.497 . . . . 60.420000000000002 110.88 -179.832 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 64' ' ' ILE . . . . . 0.602 HD13 HD11 ' A' ' 94' ' ' LEU . 13.9 mt -138.15 150.94 24.74 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.142 -0.481 . . . . 73.040000000000006 111.156 179.944 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 65' ' ' THR . . . . . 0.573 HG23 ' O ' ' A' ' 50' ' ' ILE . 39.1 m -120.89 115.17 22.71 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.18 -0.464 . . . . 71.030000000000001 111.124 179.942 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . 0.716 HD11 HG21 ' A' ' 121' ' ' THR . 19.2 mt -90.95 110.77 22.02 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.192 -0.458 . . . . 54.219999999999999 110.944 179.96 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 9.1 t60 -100.92 114.52 28.46 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.21 -0.45 . . . . 74.329999999999998 110.855 179.892 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 68' ' ' PHE . . . . . 0.579 ' CG ' HD12 ' A' ' 114' ' ' ILE . 0.0 OUTLIER -105.17 141.13 37.26 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.195 -0.457 . . . . 73.400000000000006 110.885 -179.953 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -120.5 117.14 26.89 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.133 -0.485 . . . . 63.350000000000001 111.066 179.94 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 70' ' ' MET . . . . . 0.451 ' HE2' HD11 ' A' ' 114' ' ' ILE . 1.4 mmt -84.11 93.72 8.19 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.192 -0.458 . . . . 70.129999999999995 110.881 179.986 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -51.13 159.2 1.08 Allowed Pre-proline 0 C--N 1.329 -0.283 0 CA-C-O 121.582 0.706 . . . . 71.140000000000001 111.154 -179.922 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 72' ' ' PRO . . . . . 0.532 ' O ' HD13 ' A' ' 8' ' ' LEU . 53.9 Cg_endo -69.72 -4.5 14.12 Favored 'Trans proline' 0 C--O 1.231 0.174 0 C-N-CA 122.711 2.274 . . . . 65.019999999999996 112.339 179.973 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 73' ' ' MET . . . . . 0.527 ' HB3' HG23 ' A' ' 77' ' ' THR . 0.0 OUTLIER -109.28 -24.21 11.2 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.203 -0.453 . . . . 72.299999999999997 110.852 179.942 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 74' ' ' TYR . . . . . 0.651 ' CD1' ' C ' ' A' ' 74' ' ' TYR . 0.0 OUTLIER -48.29 150.75 2.1 Favored Pre-proline 0 C--N 1.328 -0.342 0 CA-C-O 121.688 0.756 . . . . 62.43 110.931 -179.859 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 75' ' ' PRO . . . . . 0.556 ' C ' ' HA ' ' A' ' 74' ' ' TYR . 54.2 Cg_endo -69.72 -11.69 11.89 Favored 'Cis proline' 0 C--N 1.341 0.171 0 C-N-CA 122.698 -1.792 . . . . 72.209999999999994 112.367 -0.124 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 76' ' ' TYR . . . . . 0.476 ' CB ' ' O ' ' A' ' 73' ' ' MET . 10.4 t80 -35.27 -52.88 0.62 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.221 -0.445 . . . . 64.010000000000005 110.969 -179.943 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 77' ' ' THR . . . . . 0.527 HG23 ' HB3' ' A' ' 73' ' ' MET . 53.2 p -101.39 175.3 5.62 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.087 -0.506 . . . . 75.510000000000005 111.139 -179.961 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -98.86 131.36 25.74 Favored Pre-proline 0 C--N 1.329 -0.288 0 CA-C-O 121.554 0.692 . . . . 72.140000000000001 111.079 179.884 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 79' ' ' PRO . . . . . 0.747 ' HG3' HD11 ' A' ' 113' ' ' ILE . 53.7 Cg_endo -69.77 176.84 6.23 Favored 'Trans proline' 0 C--N 1.341 0.171 0 C-N-CA 122.668 2.246 . . . . 74.049999999999997 112.369 179.957 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 2.0 tt0 -111.66 133.44 53.91 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.234 -0.439 . . . . 70.310000000000002 110.951 179.996 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 81' ' ' ILE . . . . . 0.473 HD13 ' HA ' ' A' ' 68' ' ' PHE . 10.0 mm -124.08 127.25 73.37 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.157 -0.474 . . . . 61.539999999999999 111.182 179.988 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . 0.478 ' HG3' ' CD ' ' A' ' 84' ' ' LYS . 7.3 pt-20 -135.07 142.13 46.24 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.22 -0.445 . . . . 74.140000000000001 110.902 179.975 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 83' ' ' PHE . . . . . 0.663 ' CE1' HD21 ' A' ' 66' ' ' LEU . 31.1 m-85 -93.23 140.88 29.04 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.165 -0.471 . . . . 71.219999999999999 110.839 -179.884 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 84' ' ' LYS . . . . . 0.478 ' CD ' ' HG3' ' A' ' 82' ' ' GLU . 9.7 mmmt -123.66 170.36 10.55 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.137 -0.483 . . . . 53.530000000000001 110.936 179.964 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . 0.44 ' O ' ' C ' ' A' ' 86' ' ' VAL . 2.7 m-80 62.92 -73.38 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.22 -0.446 . . . . 73.310000000000002 110.891 179.946 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 86' ' ' VAL . . . . . 1.096 HG11 HD21 ' A' ' 94' ' ' LEU . 6.4 m 34.94 90.67 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.131 -0.486 . . . . 75.099999999999994 111.166 179.942 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -101.92 -84.74 0.44 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.17 -0.468 . . . . 72.400000000000006 110.911 -179.954 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 88' ' ' ASN . . . . . 0.479 ' ND2' ' HB ' ' A' ' 60' ' ' VAL . 27.8 m120 -49.5 -40.21 36.72 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.185 -0.461 . . . . 74.349999999999994 110.856 -179.913 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 89' ' ' VAL . . . . . 0.813 HG21 HD13 ' A' ' 94' ' ' LEU . 2.4 p -68.17 139.08 21.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.167 -0.47 . . . . 43.210000000000001 111.119 179.909 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 90' ' ' MET . . . . . . . . . . . . . 5.4 mtm -87.22 -67.43 0.82 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.155 -0.475 . . . . 73.450000000000003 110.892 179.91 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -178.77 -30.44 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.21 -0.45 . . . . 73.329999999999998 110.832 179.954 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -53.79 -42.72 68.63 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.198 -0.456 . . . . 74.299999999999997 110.861 -179.775 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -69.92 -40.11 75.73 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.136 -0.484 . . . . 73.450000000000003 110.94 -179.985 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . 1.096 HD21 HG11 ' A' ' 86' ' ' VAL . 0.1 OUTLIER -59.52 -46.3 89.26 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.208 -0.451 . . . . 63.399999999999999 110.95 179.997 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 9.9 mm-40 -64.89 -38.88 92.45 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.129 -0.487 . . . . 64.540000000000006 110.951 179.907 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 96' ' ' MET . . . . . 0.561 ' SD ' ' CE1' ' A' ' 128' ' ' PHE . 19.8 ttp -61.06 -36.96 80.99 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.178 -0.465 . . . . 64.409999999999997 110.856 179.965 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 97' ' ' LEU . . . . . 1.015 HD22 HG22 ' A' ' 121' ' ' THR . 90.3 mt -62.2 -42.45 99.3 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.221 -0.445 . . . . 54.240000000000002 110.902 -179.942 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 98' ' ' LYS . . . . . 0.578 ' HA ' ' CD2' ' A' ' 101' ' ' PHE . 13.2 mmtm -54.86 -44.56 74.11 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.181 -0.463 . . . . 72.219999999999999 110.872 179.845 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 66.3 m -57.63 -39.23 76.5 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.253 -0.43 . . . . 60.130000000000003 110.836 -179.897 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 100' ' ' GLU . . . . . 0.569 ' O ' HD12 ' A' ' 104' ' ' ILE . 3.6 mm-40 -71.36 -26.67 62.9 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.177 -0.465 . . . . 72.400000000000006 110.879 -179.928 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 101' ' ' PHE . . . . . 0.591 ' CD1' ' O ' ' A' ' 97' ' ' LEU . 8.7 m-30 -59.38 -30.36 68.37 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.147 -0.479 . . . . 65.439999999999998 110.937 -179.963 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 1.4 tmpt? -71.56 -40.76 69.77 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.113 -0.494 . . . . 75.530000000000001 110.882 179.98 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 3.2 tmmm? -70.35 -43.25 70.57 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.227 -0.442 . . . . 65.219999999999999 110.88 179.913 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 104' ' ' ILE . . . . . 0.569 HD12 ' O ' ' A' ' 100' ' ' GLU . 3.0 mt -62.36 -47.5 92.74 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.202 -0.454 . . . . 72.420000000000002 111.159 179.861 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 105' ' ' HIS . . . . . 0.409 ' O ' ' N ' ' A' ' 109' ' ' ARG . 14.4 t-80 -62.53 -41.78 99.09 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.151 -0.477 . . . . 72.409999999999997 110.874 179.851 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 1.1 t-20 -58.03 -42.35 85.13 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.218 -0.446 . . . . 73.340000000000003 110.902 -179.978 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 107' ' ' THR . . . . . 0.457 HG22 ' O ' ' A' ' 104' ' ' ILE . 8.0 t -77.95 -35.55 50.24 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.157 -0.474 . . . . 71.319999999999993 111.159 -179.996 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 108' ' ' SER . . . . . 0.524 ' HB2' HG22 ' A' ' 113' ' ' ILE . 19.8 m -103.97 29.96 5.51 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.21 -0.45 . . . . 73.329999999999998 110.865 -179.871 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 109' ' ' ARG . . . . . 0.409 ' N ' ' O ' ' A' ' 105' ' ' HIS . 26.1 ttt180 -72.13 80.64 0.96 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.133 -0.485 . . . . 60.140000000000001 110.872 -179.956 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 141.15 -9.23 2.72 Favored Glycine 0 N--CA 1.452 -0.254 0 C-N-CA 120.699 -0.763 . . . . 44.439999999999998 112.477 -179.971 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 111' ' ' GLN . . . . . . . . . . . . . 9.2 pt20 -126.44 -161.68 1.08 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.761 0.315 . . . . 52.219999999999999 110.921 -179.873 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 33.7 mt-10 -70.86 134.22 47.12 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.219 -0.446 . . . . 72.530000000000001 110.862 -179.95 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 113' ' ' ILE . . . . . 0.747 HD11 ' HG3' ' A' ' 79' ' ' PRO . 31.1 pt -126.65 -11.31 4.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.149 -0.478 . . . . 24.329999999999998 111.161 179.972 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 114' ' ' ILE . . . . . 0.776 ' O ' HG23 ' A' ' 118' ' ' THR . 33.7 mm -61.87 -45.72 98.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.156 -0.475 . . . . 53.299999999999997 111.136 179.855 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 115' ' ' PHE . . . . . 0.771 ' HE1' HG21 ' A' ' 25' ' ' ILE . 13.1 t80 -72.51 -32.65 66.32 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.171 -0.468 . . . . 74.439999999999998 110.932 179.9 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 42.9 mm-40 -67.45 -47.65 69.53 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.105 -0.498 . . . . 43.299999999999997 110.901 -179.971 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 117' ' ' ILE . . . . . 0.478 ' CG2' ' N ' ' A' ' 118' ' ' THR . 0.8 OUTLIER -64.15 -41.92 93.95 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.142 -0.481 . . . . 71.430000000000007 111.111 179.979 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 118' ' ' THR . . . . . 0.776 HG23 ' O ' ' A' ' 114' ' ' ILE . 46.7 p -67.85 -42.43 81.37 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.201 -0.454 . . . . 71.230000000000004 111.158 179.958 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 6.8 m -66.14 -43.96 85.54 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.245 -0.434 . . . . 70.420000000000002 110.838 -179.842 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 120' ' ' PHE . . . . . 0.506 ' CG ' HD11 ' A' ' 104' ' ' ILE . 0.2 OUTLIER -62.11 -49.97 73.8 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.161 -0.472 . . . . 73.329999999999998 110.883 -179.979 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 121' ' ' THR . . . . . 1.015 HG22 HD22 ' A' ' 97' ' ' LEU . 53.5 p -63.28 -39.3 94.21 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.141 -0.481 . . . . 61.450000000000003 111.169 -179.96 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -64.49 -46.33 83.49 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.201 -0.454 . . . . 72.340000000000003 110.945 179.999 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 4.8 pt-20 -70.99 -38.19 72.71 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.219 -0.446 . . . . 73.450000000000003 110.842 -179.968 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 124' ' ' LYS . . . . . 0.441 ' CE ' ' HA ' ' A' ' 124' ' ' LYS . 0.2 OUTLIER -74.51 -29.93 61.59 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.218 -0.446 . . . . 53.420000000000002 110.902 -179.999 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 125' ' ' LEU . . . . . 0.847 ' O ' HD12 ' A' ' 125' ' ' LEU . 0.9 OUTLIER -68.34 -46.36 70.38 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.221 -0.445 . . . . 74.219999999999999 110.92 179.945 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 6.4 m-20 -59.84 -37.43 79.23 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.214 -0.448 . . . . 70.239999999999995 110.85 179.819 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 3.0 mm-40 -60.41 -49.74 76.36 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.198 -0.455 . . . . 72.239999999999995 110.947 -179.931 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 128' ' ' PHE . . . . . 0.561 ' CE1' ' SD ' ' A' ' 96' ' ' MET . 11.3 m-85 -65.85 -58.39 5.71 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.124 -0.489 . . . . 73.099999999999994 110.856 -179.949 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 129' ' ' GLN . . . . . 0.641 ' HG2' HG22 ' A' ' 60' ' ' VAL . 1.3 tm0? -45.43 -30.91 1.49 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.119 -0.491 . . . . 63.43 110.922 -179.911 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 130' ' ' ASN . . . . . . . . . . . . . 2.0 t-20 -66.6 -70.67 0.23 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.179 -0.464 . . . . 72.310000000000002 110.846 -179.958 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 4.5 p 177.15 -37.43 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.173 -0.467 . . . . 52.210000000000001 111.127 179.947 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 132' ' ' VAL . . . . . . . . . . . . . 54.5 t 63.31 93.73 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.141 -0.482 . . . . 74.439999999999998 111.123 179.946 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 133' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -157.42 158.89 36.7 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.183 -0.462 . . . . 65.129999999999995 110.881 179.981 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 134' ' ' THR . . . . . . . . . . . . . 75.6 p -76.36 87.23 3.14 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.178 -0.464 . . . . 61.43 111.125 -179.947 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 30.0 tt0 -156.8 -57.67 0.09 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.237 -0.438 . . . . 61.020000000000003 110.924 179.982 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 46.8 t -129.51 131.82 46.73 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.21 -0.45 . . . . 73.109999999999999 110.898 -179.818 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 137' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -165.11 160.28 18.59 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.162 -0.472 . . . . 65.019999999999996 110.87 179.985 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 24.7 tt0 . . . . . 0 C--N 1.33 -0.259 0 CA-C-N 116.145 -0.479 . . . . 75.109999999999999 110.933 179.913 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.231 0.11 0 CA-C-O 120.779 0.323 . . . . 61.539999999999999 110.854 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -139.73 70.33 1.36 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.26 -0.427 . . . . 74.450000000000003 110.9 -179.787 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 2.0 mm? 61.04 83.14 0.15 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.141 -0.481 . . . . 74.019999999999996 110.949 -179.964 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 25.2 t -151.65 92.3 1.74 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.188 -0.46 . . . . 72.299999999999997 110.864 -179.892 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' HIS . . . . . 0.502 ' CD2' ' O ' ' A' ' 5' ' ' HIS . 0.3 OUTLIER -109.37 125.29 52.22 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.189 -0.46 . . . . 71.099999999999994 110.826 179.967 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -142.19 -48.61 0.36 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.171 -0.468 . . . . 54.130000000000003 110.976 179.981 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 5.5 t -104.55 160.01 15.28 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.158 -0.473 . . . . 64.439999999999998 111.116 179.922 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 44.2 mt -66.13 -23.98 66.59 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.186 -0.461 . . . . 62.509999999999998 110.93 179.921 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -49.96 -30.6 10.72 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.217 -0.447 . . . . 73.140000000000001 110.847 179.863 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 5.1 mm100 -68.09 -40.01 82.72 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.213 -0.449 . . . . 73.049999999999997 110.884 -179.902 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 22.8 m-85 -61.9 -26.95 68.47 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.197 -0.456 . . . . 74.329999999999998 110.88 -179.805 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -58.96 -37.66 77.28 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.158 -0.474 . . . . 72.109999999999999 110.937 -179.958 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 2.2 mm-40 -63.07 -42.9 99.78 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.167 -0.47 . . . . 71.310000000000002 110.877 -179.97 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 3.8 mp -65.92 -41.99 91.03 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.163 -0.471 . . . . 73.230000000000004 111.126 179.989 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . 0.444 ' HB3' HG21 ' A' ' 46' ' ' ILE . 47.5 mt-30 -65.42 -44.02 88.68 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.199 -0.455 . . . . 73.230000000000004 110.897 179.944 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 1.7 t -62.35 -38.29 88.93 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.203 -0.453 . . . . 75.150000000000006 110.924 -179.952 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 1.6 m-20 -58.08 -33.9 69.56 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.126 -0.488 . . . . 65.409999999999997 110.896 -179.921 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 4.1 mt-10 -67.14 -39.1 86.51 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.165 -0.471 . . . . 73.109999999999999 110.859 -179.946 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.438 ' CD2' HG13 ' A' ' 46' ' ' ILE . 8.7 mp -63.87 -51.25 65.48 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.203 -0.453 . . . . 53.130000000000003 110.869 -179.941 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -68.51 -35.84 78.04 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.184 -0.462 . . . . 73.329999999999998 110.886 179.938 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -66.64 -50.36 63.21 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.133 -0.485 . . . . 74.430000000000007 111.137 179.907 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . 0.525 ' HA ' HD12 ' A' ' 25' ' ' ILE . 0.8 OUTLIER -73.12 -34.67 45.73 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.235 -0.439 . . . . 74.120000000000005 111.132 179.927 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -52.8 -35.46 56.91 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.17 -0.468 . . . . 64.109999999999999 110.891 179.977 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 53.3 p -67.18 -31.44 71.84 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.155 -0.475 . . . . 54.119999999999997 110.855 -179.782 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . 0.708 HD13 ' CE1' ' A' ' 115' ' ' PHE . 3.5 mt -83.84 -44.16 18.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.134 -0.484 . . . . 65.319999999999993 111.119 179.954 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' TYR . . . . . 0.44 ' CD2' HD12 ' A' ' 50' ' ' ILE . 19.8 m-85 -106.7 45.68 0.97 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.174 -0.466 . . . . 71.109999999999999 110.941 -179.982 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER -46.7 -54.88 8.73 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.117 -0.492 . . . . 74.409999999999997 110.9 179.919 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -96.49 -11.79 25.06 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.198 -0.456 . . . . 75.430000000000007 110.882 179.975 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -101.86 25.79 8.23 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.2 -0.454 . . . . 75.510000000000005 110.875 179.99 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' PHE . . . . . 0.483 ' HA ' HD13 ' A' ' 50' ' ' ILE . 3.9 t80 -111.41 134.65 52.84 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.205 -0.452 . . . . 63.100000000000001 110.865 -179.9 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 24.2 m -110.7 132.46 54.18 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.138 -0.483 . . . . 70.299999999999997 111.175 -179.947 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -95.73 114.28 26.0 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.228 -0.442 . . . . 71.200000000000003 110.89 179.936 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.645 HD12 ' N ' ' A' ' 34' ' ' THR . 0.2 OUTLIER -124.95 -0.13 7.92 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.174 -0.467 . . . . 51.409999999999997 110.88 -179.891 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . 0.645 ' N ' HD12 ' A' ' 33' ' ' LEU . 1.4 m -59.9 162.46 5.48 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.187 -0.461 . . . . 71.400000000000006 111.151 179.915 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 42.9 mttt -80.29 45.96 0.79 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.177 -0.465 . . . . 75.120000000000005 110.879 179.948 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 2.9 mmt85 -78.63 -62.05 1.81 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.257 -0.428 . . . . 70.200000000000003 110.904 179.937 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -105.02 31.15 5.02 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.175 -0.466 . . . . 64.340000000000003 110.894 179.967 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -86.17 -173.97 4.83 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.25 -0.432 . . . . 54.109999999999999 110.883 -179.906 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 8.8 m -125.5 95.14 4.35 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.148 -0.478 . . . . 53.100000000000001 110.868 -179.853 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' TRP . . . . . . . . . . . . . 0.1 OUTLIER -168.94 -66.91 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.11 -0.496 . . . . 63.329999999999998 110.883 179.986 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . 0.581 ' O ' ' C ' ' A' ' 42' ' ' LYS . 0.5 OUTLIER 176.18 57.5 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.221 -0.445 . . . . 72.430000000000007 110.857 179.91 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . 0.581 ' C ' ' O ' ' A' ' 41' ' ' ASP . 0.0 OUTLIER 22.07 68.5 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.181 -0.463 . . . . 74.140000000000001 110.927 180.0 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 1.5 tt0 -113.9 62.04 1.03 Allowed Pre-proline 0 C--N 1.329 -0.295 0 CA-C-O 121.571 0.701 . . . . 62.439999999999998 110.875 -179.998 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' PRO . . . . . 0.454 ' HD3' ' C ' ' A' ' 42' ' ' LYS . 54.2 Cg_endo -69.77 130.89 20.13 Favored 'Trans proline' 0 C--N 1.34 0.126 0 C-N-CA 122.718 2.279 . . . . 73.319999999999993 112.342 179.962 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' GLN . . . . . 0.649 ' HB3' HD12 ' A' ' 47' ' ' ILE . 24.3 tt0 -107.31 11.03 29.56 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.206 -0.452 . . . . 62.32 110.937 179.989 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . 0.486 HG22 ' O ' ' A' ' 45' ' ' GLN . 0.0 OUTLIER 82.43 -34.19 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.179 -0.464 . . . . 74.310000000000002 111.166 179.978 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . 0.649 HD12 ' HB3' ' A' ' 45' ' ' GLN . 0.2 OUTLIER -34.94 148.66 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.181 -0.463 . . . . 31.149999999999999 111.101 179.843 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' PHE . . . . . 0.617 ' CZ ' HG21 ' A' ' 114' ' ' ILE . 14.3 p90 -159.43 158.0 31.25 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.165 -0.47 . . . . 54.219999999999999 110.909 179.889 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . 0.462 ' CG ' ' HB2' ' A' ' 67' ' ' HIS . 5.7 mt-10 -109.61 160.74 16.01 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.157 -0.474 . . . . 75.040000000000006 110.94 -179.949 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . 0.483 HD13 ' HA ' ' A' ' 30' ' ' PHE . 19.0 mm -137.61 139.04 43.93 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 116.148 -0.478 . . . . 75.310000000000002 111.161 179.987 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 24.1 m -85.26 117.07 23.98 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.186 -0.461 . . . . 75.099999999999994 111.134 179.979 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . 0.598 HD12 HD22 ' A' ' 66' ' ' LEU . 17.1 mt -121.59 161.08 23.03 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.234 -0.439 . . . . 75.129999999999995 110.939 179.932 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -177.51 178.79 1.0 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.23 -0.441 . . . . 64.099999999999994 110.915 179.906 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -64.89 175.48 1.5 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.201 -0.454 . . . . 74.209999999999994 110.85 -179.75 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 16.4 m -80.69 -29.45 11.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.155 -0.475 . . . . 62.119999999999997 111.081 179.962 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 1.7 t0 -117.02 -169.13 1.59 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.201 -0.454 . . . . 43.530000000000001 110.901 179.954 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . 0.472 ' CD ' ' N ' ' A' ' 57' ' ' LYS . 0.0 OUTLIER -117.55 -12.62 10.34 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.257 -0.429 . . . . 71.340000000000003 110.88 -179.985 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . 0.543 ' HA ' ' C ' ' A' ' 59' ' ' PRO . 9.8 pt-20 -126.06 150.98 71.0 Favored Pre-proline 0 C--N 1.329 -0.294 0 CA-C-O 121.639 0.733 . . . . 73.420000000000002 110.924 179.895 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 59' ' ' PRO . . . . . 0.543 ' C ' ' HA ' ' A' ' 58' ' ' GLU . 53.7 Cg_endo -69.77 -5.94 9.17 Favored 'Cis proline' 0 C--N 1.342 0.191 0 C-N-CA 122.686 -1.798 . . . . 75.230000000000004 112.349 0.041 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 60' ' ' VAL . . . . . 0.729 HG11 ' OD1' ' A' ' 88' ' ' ASN . 33.4 m -140.75 172.32 11.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.25 -0.432 . . . . 74.140000000000001 111.165 179.93 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . 0.447 ' O ' ' C ' ' A' ' 62' ' ' SER . 5.4 tt0 -102.45 -21.97 14.14 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.163 -0.471 . . . . 73.420000000000002 110.86 -179.979 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . 0.816 ' HB3' HD11 ' A' ' 125' ' ' LEU . 41.7 m 34.0 90.78 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.181 -0.463 . . . . 55.009999999999998 110.889 -179.784 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 10.4 p -118.61 123.05 44.04 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.124 -0.489 . . . . 64.209999999999994 110.869 -179.836 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 64' ' ' ILE . . . . . 1.066 HD11 HG21 ' A' ' 89' ' ' VAL . 30.1 mt -133.05 139.31 49.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.093 -0.503 . . . . 73.230000000000004 111.125 179.976 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 20.4 m -104.53 116.87 32.85 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.176 -0.465 . . . . 74.019999999999996 111.157 179.959 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . 1.027 HD21 HG21 ' A' ' 121' ' ' THR . 1.4 mp -94.48 109.97 21.81 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.247 -0.433 . . . . 75.409999999999997 110.915 179.977 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 67' ' ' HIS . . . . . 0.531 ' CE1' HD21 ' A' ' 33' ' ' LEU . 1.9 t60 -97.4 109.96 22.61 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.18 -0.464 . . . . 73.140000000000001 110.833 179.875 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 68' ' ' PHE . . . . . 0.572 ' CE2' ' HB3' ' A' ' 66' ' ' LEU . 0.0 OUTLIER -105.11 139.97 38.98 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.206 -0.452 . . . . 73.299999999999997 110.839 -179.896 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -123.87 128.39 49.42 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.148 -0.478 . . . . 61.420000000000002 111.07 179.943 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 70' ' ' MET . . . . . 0.738 ' CE ' HD11 ' A' ' 114' ' ' ILE . 0.0 OUTLIER -96.32 103.42 15.32 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.23 -0.441 . . . . 65.209999999999994 110.882 179.953 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -57.33 161.17 5.82 Favored Pre-proline 0 C--N 1.33 -0.272 0 CA-C-O 121.564 0.697 . . . . 62.329999999999998 111.134 -179.935 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.8 -4.19 13.55 Favored 'Trans proline' 0 C--N 1.342 0.195 0 C-N-CA 122.692 2.261 . . . . 64.030000000000001 112.346 179.93 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 73' ' ' MET . . . . . 0.5 ' O ' ' CB ' ' A' ' 76' ' ' TYR . 0.0 OUTLIER -111.85 -24.26 10.09 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.199 -0.455 . . . . 74.319999999999993 110.891 179.92 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 74' ' ' TYR . . . . . 0.635 ' CD1' ' C ' ' A' ' 74' ' ' TYR . 0.0 OUTLIER -47.98 149.9 2.25 Favored Pre-proline 0 C--N 1.329 -0.319 0 CA-C-O 121.638 0.732 . . . . 75.439999999999998 110.924 -179.865 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 75' ' ' PRO . . . . . 0.542 ' C ' ' HA ' ' A' ' 74' ' ' TYR . 53.7 Cg_endo -69.79 -12.34 12.22 Favored 'Cis proline' 0 C--N 1.341 0.165 0 C-N-CA 122.696 -1.793 . . . . 75.120000000000005 112.302 -0.041 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 76' ' ' TYR . . . . . 0.5 ' CB ' ' O ' ' A' ' 73' ' ' MET . 9.4 t80 -33.95 -47.31 0.26 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.264 -0.425 . . . . 71.319999999999993 110.934 -179.925 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 77' ' ' THR . . . . . 0.41 HG23 ' CB ' ' A' ' 73' ' ' MET . 72.0 p -105.8 179.68 4.2 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.121 -0.491 . . . . 70.319999999999993 111.105 -179.964 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -100.74 129.95 26.44 Favored Pre-proline 0 C--N 1.329 -0.309 0 CA-C-O 121.638 0.733 . . . . 45.039999999999999 111.108 179.84 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 79' ' ' PRO . . . . . 0.616 ' HG3' HD11 ' A' ' 113' ' ' ILE . 53.9 Cg_endo -69.75 -175.18 1.07 Allowed 'Trans proline' 0 C--N 1.342 0.203 0 C-N-CA 122.685 2.256 . . . . 64.310000000000002 112.353 179.992 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . 0.58 ' O ' HD13 ' A' ' 81' ' ' ILE . 0.4 OUTLIER -124.18 141.2 52.26 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.26 -0.427 . . . . 73.230000000000004 110.871 -179.981 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 81' ' ' ILE . . . . . 0.58 HD13 ' O ' ' A' ' 80' ' ' GLU . 8.0 mm -133.02 143.89 38.12 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.141 -0.481 . . . . 61.539999999999999 111.096 179.983 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . 0.509 ' HG3' ' CD ' ' A' ' 84' ' ' LYS . 4.4 pt-20 -149.02 143.65 26.22 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.156 -0.475 . . . . 70.430000000000007 110.916 179.906 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 83' ' ' PHE . . . . . 0.465 ' CZ ' ' HD3' ' A' ' 98' ' ' LYS . 10.3 m-85 -96.21 136.85 36.13 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.167 -0.469 . . . . 74.219999999999999 110.898 -179.904 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 84' ' ' LYS . . . . . 0.509 ' CD ' ' HG3' ' A' ' 82' ' ' GLU . 12.8 mmmt -123.99 169.02 12.05 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.201 -0.454 . . . . 73.329999999999998 110.941 179.964 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . 0.571 HD22 ' N ' ' A' ' 85' ' ' ASN . 1.0 OUTLIER 64.26 -72.46 0.06 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.249 -0.432 . . . . 74.049999999999997 110.888 179.942 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 86' ' ' VAL . . . . . 0.513 HG11 HD11 ' A' ' 94' ' ' LEU . 6.8 m 33.76 90.84 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.18 -0.464 . . . . 74.140000000000001 111.101 179.904 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -99.95 -53.65 3.1 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.173 -0.467 . . . . 71.209999999999994 110.934 179.995 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 88' ' ' ASN . . . . . 0.729 ' OD1' HG11 ' A' ' 60' ' ' VAL . 20.9 t30 -85.4 20.88 1.89 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.206 -0.452 . . . . 63.340000000000003 110.866 -179.954 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 89' ' ' VAL . . . . . 1.066 HG21 HD11 ' A' ' 64' ' ' ILE . 2.8 t -130.81 154.62 40.96 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.175 -0.466 . . . . 74.019999999999996 111.133 179.918 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 90' ' ' MET . . . . . . . . . . . . . 3.0 mtm -108.31 -69.44 0.85 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.19 -0.459 . . . . 72.299999999999997 110.933 179.874 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 9.8 p-10 -170.82 -33.41 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.183 -0.462 . . . . 72.310000000000002 110.88 179.959 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 4.1 m -54.34 -46.47 72.93 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.197 -0.456 . . . . 64.099999999999994 110.869 -179.788 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 93' ' ' GLN . . . . . 0.441 ' HB2' ' CG1' ' A' ' 89' ' ' VAL . 4.1 mp0 -68.74 -38.78 80.39 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.131 -0.486 . . . . 74.319999999999993 110.897 -179.942 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . 0.521 ' CD1' HG11 ' A' ' 89' ' ' VAL . 8.2 mp -57.86 -49.16 77.63 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.185 -0.461 . . . . 64.340000000000003 110.931 179.977 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 74.2 mt-30 -66.08 -37.33 85.53 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.144 -0.48 . . . . 61.32 110.9 179.956 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 96' ' ' MET . . . . . . . . . . . . . 32.8 ttp -59.76 -41.27 90.66 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.205 -0.452 . . . . 62.240000000000002 110.884 179.958 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 97' ' ' LEU . . . . . 0.609 HD22 ' HA ' ' A' ' 121' ' ' THR . 87.6 mt -61.76 -44.8 96.18 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.21 -0.45 . . . . 75.129999999999995 110.945 -179.982 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 98' ' ' LYS . . . . . 0.48 ' HA ' ' CD2' ' A' ' 101' ' ' PHE . 5.5 mmtp -58.47 -34.98 71.48 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.169 -0.469 . . . . 74.239999999999995 110.893 179.81 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -63.89 -42.76 97.4 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.183 -0.462 . . . . 73.439999999999998 110.86 -179.847 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 100' ' ' GLU . . . . . 0.558 ' O ' HD12 ' A' ' 104' ' ' ILE . 69.5 mm-40 -71.0 -24.56 62.41 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.114 -0.494 . . . . 73.219999999999999 110.837 -179.948 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 101' ' ' PHE . . . . . 0.576 ' CD2' HD11 ' A' ' 117' ' ' ILE . 10.5 m-30 -59.57 -38.23 80.61 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.146 -0.479 . . . . 75.519999999999996 110.864 -179.905 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.28 -44.0 95.72 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.166 -0.47 . . . . 75.019999999999996 110.867 -179.988 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -67.36 -42.88 82.73 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.247 -0.433 . . . . 73.019999999999996 110.888 179.881 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 104' ' ' ILE . . . . . 0.904 HD11 ' CG ' ' A' ' 120' ' ' PHE . 3.4 mt -61.82 -47.68 92.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.245 -0.434 . . . . 60.420000000000002 111.158 179.855 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 105' ' ' HIS . . . . . 0.454 ' O ' ' N ' ' A' ' 109' ' ' ARG . 64.6 t-80 -62.97 -41.2 99.47 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.135 -0.484 . . . . 65.150000000000006 110.888 179.864 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 1.4 m-80 -56.82 -40.47 76.06 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.199 -0.455 . . . . 62.210000000000001 110.87 -179.941 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 107' ' ' THR . . . . . 0.413 ' CG2' ' O ' ' A' ' 104' ' ' ILE . 5.2 t -81.26 -26.31 35.88 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.212 -0.449 . . . . 72.230000000000004 111.112 -179.971 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 108' ' ' SER . . . . . 0.58 ' OG ' HG22 ' A' ' 113' ' ' ILE . 39.3 p -111.31 26.84 10.26 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.251 -0.431 . . . . 42.439999999999998 110.848 -179.813 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 109' ' ' ARG . . . . . 0.454 ' N ' ' O ' ' A' ' 105' ' ' HIS . 13.4 ttt-85 -68.34 76.55 0.26 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.154 -0.476 . . . . 74.239999999999995 110.868 -179.928 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 145.09 -20.22 1.94 Allowed Glycine 0 N--CA 1.451 -0.343 0 C-N-CA 120.78 -0.724 . . . . 55.439999999999998 112.501 -179.986 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 111' ' ' GLN . . . . . . . . . . . . . 7.3 pt20 -114.54 -170.2 1.69 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.749 0.309 . . . . 74.420000000000002 110.91 -179.877 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 32.8 mt-10 -62.3 128.92 38.34 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.204 -0.453 . . . . 75.420000000000002 110.874 -179.962 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 113' ' ' ILE . . . . . 0.616 HD11 ' HG3' ' A' ' 79' ' ' PRO . 21.2 pt -120.67 -15.08 7.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.133 -0.485 . . . . 63.25 111.098 179.999 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 114' ' ' ILE . . . . . 0.92 ' O ' HG23 ' A' ' 118' ' ' THR . 35.0 mm -60.11 -43.64 93.33 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.175 -0.466 . . . . 73.430000000000007 111.166 179.816 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 115' ' ' PHE . . . . . 0.708 ' CE1' HD13 ' A' ' 25' ' ' ILE . 22.0 t80 -72.31 -35.35 68.61 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.176 -0.465 . . . . 65.340000000000003 110.925 179.929 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 56.6 mm-40 -67.89 -47.62 68.3 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.096 -0.502 . . . . 74.430000000000007 110.929 -179.97 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 117' ' ' ILE . . . . . 0.576 HD11 ' CD2' ' A' ' 101' ' ' PHE . 1.1 tt -64.27 -40.45 89.11 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.133 -0.485 . . . . 61.310000000000002 111.15 179.947 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 118' ' ' THR . . . . . 0.92 HG23 ' O ' ' A' ' 114' ' ' ILE . 62.5 p -67.43 -43.38 81.32 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.181 -0.463 . . . . 74.019999999999996 111.149 179.978 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 1.7 t -67.83 -32.02 72.27 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.189 -0.459 . . . . 62.439999999999998 110.841 -179.867 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 120' ' ' PHE . . . . . 0.904 ' CG ' HD11 ' A' ' 104' ' ' ILE . 0.4 OUTLIER -76.01 -39.64 55.32 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.155 -0.475 . . . . 75.5 110.893 -179.932 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 121' ' ' THR . . . . . 1.027 HG21 HD21 ' A' ' 66' ' ' LEU . 14.8 p -69.36 -41.65 76.29 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.14 -0.482 . . . . 75.510000000000005 111.134 -179.933 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 122' ' ' GLN . . . . . 0.442 ' CG ' ' N ' ' A' ' 123' ' ' GLU . 9.0 pt20 -68.25 -46.97 69.01 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.227 -0.442 . . . . 65.150000000000006 110.904 -179.976 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 123' ' ' GLU . . . . . 0.442 ' N ' ' CG ' ' A' ' 122' ' ' GLN . 5.7 pt-20 -60.36 -36.61 78.41 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.197 -0.456 . . . . 73.25 110.869 -179.916 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 124' ' ' LYS . . . . . 0.459 ' CE ' ' HA ' ' A' ' 124' ' ' LYS . 0.0 OUTLIER -77.03 -38.54 52.62 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.146 -0.479 . . . . 74.420000000000002 110.921 179.969 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 125' ' ' LEU . . . . . 0.816 HD11 ' HB3' ' A' ' 62' ' ' SER . 2.3 tp -67.69 -43.2 80.69 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.203 -0.453 . . . . 64.230000000000004 110.938 179.927 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -63.19 -43.13 99.08 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.157 -0.474 . . . . 63.109999999999999 110.836 179.875 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 127' ' ' GLU . . . . . 0.446 ' HG3' ' N ' ' A' ' 128' ' ' PHE . 0.0 OUTLIER -67.22 -29.25 68.86 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.208 -0.451 . . . . 73.430000000000007 110.915 -179.912 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 128' ' ' PHE . . . . . 0.53 ' O ' HG23 ' A' ' 132' ' ' VAL . 0.2 OUTLIER -73.77 -59.72 2.59 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.117 -0.492 . . . . 73.439999999999998 110.916 -179.966 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 129' ' ' GLN . . . . . 0.549 ' CG ' ' CG2' ' A' ' 60' ' ' VAL . 1.5 tm0? -39.54 -41.25 0.98 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.13 -0.487 . . . . 74.409999999999997 110.921 -179.97 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 130' ' ' ASN . . . . . . . . . . . . . 1.4 t-20 -60.85 -41.71 96.41 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.183 -0.462 . . . . 53.509999999999998 110.896 -179.95 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 131' ' ' VAL . . . . . 0.45 ' O ' HG23 ' A' ' 131' ' ' VAL . 10.0 m -128.53 83.31 0.77 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.166 -0.47 . . . . 73.109999999999999 111.15 179.903 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 132' ' ' VAL . . . . . 0.53 HG23 ' O ' ' A' ' 128' ' ' PHE . 41.2 t -116.12 145.81 21.37 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.152 -0.476 . . . . 55.130000000000003 111.14 179.941 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 133' ' ' ASN . . . . . . . . . . . . . 7.5 p-10 -52.81 122.43 9.15 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.197 -0.456 . . . . 73.530000000000001 110.91 179.983 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 134' ' ' THR . . . . . . . . . . . . . 24.9 m 47.56 98.52 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.198 -0.456 . . . . 51.539999999999999 111.098 179.973 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -59.97 163.11 4.92 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.253 -0.431 . . . . 75.200000000000003 110.912 179.975 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -153.87 162.04 41.54 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.212 -0.449 . . . . 74.109999999999999 110.892 -179.851 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 137' ' ' LEU . . . . . . . . . . . . . 3.1 mt -127.32 142.17 51.52 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.165 -0.47 . . . . 73.409999999999997 110.886 -179.956 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 3.8 tt0 . . . . . 0 C--N 1.33 -0.278 0 CA-C-N 116.202 -0.454 . . . . 74.430000000000007 110.899 179.947 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 2.9 mpp? . . . . . 0 C--O 1.231 0.091 0 CA-C-O 120.794 0.33 . . . . 73.049999999999997 110.877 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 32.7 p -160.28 120.63 2.92 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.215 -0.448 . . . . 74.299999999999997 110.887 -179.782 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 10.7 tp 68.44 120.43 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.169 -0.469 . . . . 72.439999999999998 110.884 -179.992 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 16.8 t 178.31 58.03 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.199 -0.455 . . . . 62.100000000000001 110.843 -179.93 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' HIS . . . . . 0.45 ' O ' ' C ' ' A' ' 6' ' ' LEU . 6.7 m170 69.02 92.11 0.09 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.164 -0.471 . . . . 74.019999999999996 110.836 179.975 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . 0.45 ' C ' ' O ' ' A' ' 5' ' ' HIS . 0.5 OUTLIER 34.4 52.08 0.5 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.182 -0.463 . . . . 71.230000000000004 110.947 -179.966 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . 0.555 HG23 ' H ' ' A' ' 9' ' ' ASP . 10.0 t -79.68 175.83 10.26 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.199 -0.455 . . . . 72.200000000000003 111.131 -180.0 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 36.6 mt -54.39 -22.66 12.96 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.236 -0.438 . . . . 73.109999999999999 110.965 179.947 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . 0.555 ' H ' HG23 ' A' ' 7' ' ' THR . 33.6 t70 -54.89 -30.04 57.14 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.191 -0.459 . . . . 72.439999999999998 110.819 179.843 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . 0.405 ' HA ' ' NE2' ' A' ' 10' ' ' GLN . 4.2 mm-40 -66.27 -33.81 76.59 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.207 -0.451 . . . . 73.120000000000005 110.916 -179.915 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' TYR . . . . . 0.55 ' CE1' ' HD2' ' A' ' 75' ' ' PRO . 14.1 m-85 -64.37 -26.93 68.68 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.211 -0.45 . . . . 74.120000000000005 110.904 -179.864 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -59.58 -37.01 77.39 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.15 -0.477 . . . . 75.109999999999999 110.899 -179.854 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 2.9 mm-40 -61.45 -45.94 92.17 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.152 -0.476 . . . . 73.409999999999997 110.92 179.976 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . 0.487 ' H ' HD12 ' A' ' 14' ' ' ILE . 4.9 mp -67.79 -45.05 85.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.141 -0.481 . . . . 73.129999999999995 111.163 179.945 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . 0.498 ' NE2' ' O ' ' A' ' 71' ' ' THR . 86.8 mt-30 -61.29 -45.36 94.8 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.124 -0.489 . . . . 74.310000000000002 110.907 179.966 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 2.8 t -61.18 -41.92 97.64 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.182 -0.463 . . . . 74.120000000000005 110.891 -179.941 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 2.5 m-20 -57.63 -33.51 68.34 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.196 -0.456 . . . . 74.099999999999994 110.913 -179.919 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . 0.571 ' HG2' HD13 ' A' ' 114' ' ' ILE . 2.9 mt-10 -65.51 -41.2 93.45 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.181 -0.463 . . . . 75.409999999999997 110.897 179.987 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 8.9 mp -61.74 -51.84 66.72 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.109 -0.496 . . . . 74.150000000000006 110.921 -179.958 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -68.85 -37.41 79.11 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.192 -0.458 . . . . 74.25 110.901 179.912 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -61.01 -50.58 72.77 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.162 -0.472 . . . . 32.210000000000001 111.109 179.916 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . 0.407 HD11 ' HB2' ' A' ' 115' ' ' PHE . 0.6 OUTLIER -75.0 -36.09 37.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.236 -0.438 . . . . 73.299999999999997 111.168 179.968 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 18.7 mtp180 -52.63 -34.22 50.3 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.16 -0.473 . . . . 72.219999999999999 110.858 179.973 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -66.29 -33.55 75.99 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.219 -0.446 . . . . 65.109999999999999 110.847 -179.782 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . 0.745 HG21 ' HE1' ' A' ' 115' ' ' PHE . 3.3 mt -81.71 -44.9 20.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.12 -0.491 . . . . 73.219999999999999 111.139 179.97 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 21.4 m-85 -109.01 46.03 1.0 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.182 -0.463 . . . . 74.120000000000005 110.883 -179.948 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 3.2 mtm -41.7 -59.32 1.69 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.138 -0.483 . . . . 71.549999999999997 110.902 179.895 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 1.5 t70 -84.38 -25.12 29.35 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.197 -0.456 . . . . 73.129999999999995 110.834 179.968 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -85.38 30.75 0.6 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.234 -0.439 . . . . 73.420000000000002 110.851 -179.998 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' PHE . . . . . 0.579 ' HA ' HD13 ' A' ' 50' ' ' ILE . 6.0 t80 -117.14 139.47 50.7 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.205 -0.452 . . . . 72.329999999999998 110.835 -179.879 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 60.5 m -118.33 135.12 54.5 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.092 -0.504 . . . . 63.420000000000002 111.168 -179.916 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 12.6 t70 -99.92 117.17 33.66 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.256 -0.429 . . . . 75.310000000000002 110.891 179.872 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.895 HD21 HG12 ' A' ' 47' ' ' ILE . 1.2 pt? -118.58 -28.69 5.61 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.182 -0.463 . . . . 73.010000000000005 110.935 -179.98 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . 0.651 ' H ' HD23 ' A' ' 33' ' ' LEU . 0.2 OUTLIER -41.39 161.18 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.209 -0.45 . . . . 60.549999999999997 111.128 179.957 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . 0.441 ' O ' ' CD ' ' A' ' 35' ' ' LYS . 0.0 OUTLIER -75.6 50.39 0.54 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.168 -0.469 . . . . 71.030000000000001 110.927 179.877 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 1.8 mmt180 -72.22 -68.92 0.43 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.214 -0.448 . . . . 71.129999999999995 110.93 179.983 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 3.8 mmtp -118.79 39.61 3.47 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.205 -0.452 . . . . 71.140000000000001 110.9 179.917 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -121.51 119.41 31.9 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.216 -0.447 . . . . 73.129999999999995 110.842 -179.903 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 14.6 m -87.53 99.49 12.07 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.132 -0.485 . . . . 64.530000000000001 110.843 -179.823 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' TRP . . . . . . . . . . . . . 57.8 t-105 -172.58 -44.48 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.17 -0.468 . . . . 70.299999999999997 110.911 -179.991 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 26.0 t0 -139.37 146.43 40.2 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.246 -0.433 . . . . 75.120000000000005 110.887 179.928 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 9.6 mttt -123.93 60.21 1.12 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.196 -0.457 . . . . 54.43 110.888 -179.986 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 29.2 mt-30 -153.31 73.09 6.89 Favored Pre-proline 0 C--N 1.329 -0.306 0 CA-C-O 121.61 0.719 . . . . 60.439999999999998 110.941 179.952 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.78 163.15 39.36 Favored 'Trans proline' 0 C--N 1.341 0.179 0 C-N-CA 122.646 2.23 . . . . 74.430000000000007 112.354 -179.983 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' GLN . . . . . 0.657 ' HB3' HG23 ' A' ' 47' ' ' ILE . 11.7 tt0 -140.29 10.45 2.32 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.231 -0.44 . . . . 62.409999999999997 110.911 -179.982 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . 0.534 HG22 ' O ' ' A' ' 45' ' ' GLN . 0.0 OUTLIER 78.71 -7.87 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.225 -0.443 . . . . 75.129999999999995 111.132 179.976 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . 0.895 HG12 HD21 ' A' ' 33' ' ' LEU . 0.2 OUTLIER -53.12 147.1 2.27 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.18 -0.464 . . . . 54.030000000000001 111.119 179.829 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' PHE . . . . . 0.659 ' HA ' HD22 ' A' ' 33' ' ' LEU . 25.6 p90 -153.06 153.03 32.03 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.178 -0.464 . . . . 63.240000000000002 110.878 179.954 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . 0.459 ' CG ' HD13 ' A' ' 33' ' ' LEU . 12.4 mt-10 -108.36 150.83 26.82 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.158 -0.474 . . . . 71.450000000000003 110.904 -179.954 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . 0.579 HD13 ' HA ' ' A' ' 30' ' ' PHE . 11.5 mm -132.43 138.58 51.89 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.127 -0.488 . . . . 73.140000000000001 111.145 -179.991 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 96.8 m -85.86 127.36 34.56 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.177 -0.465 . . . . 63.140000000000001 111.141 179.984 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . 0.619 HD12 HD12 ' A' ' 66' ' ' LEU . 17.7 mt -128.02 164.5 22.22 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.19 -0.459 . . . . 63.130000000000003 110.883 179.965 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -178.62 172.21 1.44 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.134 -0.484 . . . . 64.010000000000005 110.886 179.933 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -66.53 173.71 3.21 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.187 -0.461 . . . . 74.209999999999994 110.836 -179.798 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 29.0 m -85.22 -27.35 6.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.146 -0.479 . . . . 61.32 111.14 179.92 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -114.72 -172.7 2.17 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.13 -0.486 . . . . 73.420000000000002 110.859 179.938 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 4.1 mmmm -116.24 -22.4 8.88 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.177 -0.465 . . . . 63.25 110.897 179.979 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . 0.541 ' HA ' ' C ' ' A' ' 59' ' ' PRO . 1.5 pt-20 -113.06 143.05 28.41 Favored Pre-proline 0 C--N 1.329 -0.31 0 CA-C-O 121.701 0.762 . . . . 75.450000000000003 110.899 179.931 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 59' ' ' PRO . . . . . 0.541 ' C ' ' HA ' ' A' ' 58' ' ' GLU . 53.5 Cg_endo -69.79 -13.2 12.43 Favored 'Cis proline' 0 C--N 1.342 0.189 0 C-N-CA 122.624 -1.823 . . . . 72.439999999999998 112.31 0.033 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 60' ' ' VAL . . . . . 0.491 HG22 ' CG ' ' A' ' 129' ' ' GLN . 8.5 m -149.49 176.26 0.92 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.263 -0.426 . . . . 71.230000000000004 111.076 179.939 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . 0.458 ' O ' ' C ' ' A' ' 62' ' ' SER . 0.9 OUTLIER -112.46 -16.24 12.93 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.128 -0.487 . . . . 75.540000000000006 110.882 179.994 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . 0.539 ' CB ' HD21 ' A' ' 125' ' ' LEU . 0.4 OUTLIER 33.67 91.12 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.174 -0.467 . . . . 54.43 110.849 -179.806 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 32.8 t -103.31 122.79 45.53 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.143 -0.48 . . . . 75.340000000000003 110.821 -179.803 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 64' ' ' ILE . . . . . 0.732 HD13 HD21 ' A' ' 94' ' ' LEU . 17.7 mt -137.19 143.05 35.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.164 -0.471 . . . . 71.450000000000003 111.121 179.937 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 15.4 m -107.84 115.03 29.4 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.207 -0.451 . . . . 75.120000000000005 111.13 179.945 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . 1.076 HD11 HG21 ' A' ' 121' ' ' THR . 12.3 mt -91.02 110.14 21.4 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.218 -0.446 . . . . 75.420000000000002 110.88 179.962 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 8.7 t60 -100.78 114.64 28.6 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.191 -0.459 . . . . 64.519999999999996 110.866 179.849 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 68' ' ' PHE . . . . . 0.523 ' HA ' HD13 ' A' ' 81' ' ' ILE . 0.0 OUTLIER -103.66 139.79 38.46 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.254 -0.43 . . . . 75.219999999999999 110.909 -179.942 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -120.04 120.81 37.37 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.182 -0.463 . . . . 73.239999999999995 111.131 179.933 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 70' ' ' MET . . . . . 0.662 ' HE3' HD11 ' A' ' 114' ' ' ILE . 12.6 mmt -85.45 104.3 15.12 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.241 -0.436 . . . . 72.150000000000006 110.875 179.995 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 71' ' ' THR . . . . . 0.498 ' O ' ' NE2' ' A' ' 15' ' ' GLN . 0.7 OUTLIER -59.93 158.12 26.83 Favored Pre-proline 0 C--N 1.329 -0.303 0 CA-C-O 121.593 0.711 . . . . 64.019999999999996 111.163 -179.938 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.76 1.05 4.78 Favored 'Trans proline' 0 C--N 1.342 0.213 0 C-N-CA 122.646 2.231 . . . . 55.549999999999997 112.356 179.94 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 73' ' ' MET . . . . . 0.479 ' O ' ' CB ' ' A' ' 76' ' ' TYR . 0.5 OUTLIER -116.67 -25.57 7.32 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.248 -0.433 . . . . 74.329999999999998 110.894 179.934 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 74' ' ' TYR . . . . . 0.62 ' CD1' ' C ' ' A' ' 74' ' ' TYR . 0.1 OUTLIER -46.6 147.61 2.02 Favored Pre-proline 0 C--N 1.329 -0.324 0 CA-C-O 121.664 0.745 . . . . 73.209999999999994 110.956 -179.933 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 75' ' ' PRO . . . . . 0.557 ' C ' ' HA ' ' A' ' 74' ' ' TYR . 53.4 Cg_endo -69.77 -14.86 12.55 Favored 'Cis proline' 0 C--N 1.342 0.184 0 C-N-CA 122.636 -1.818 . . . . 75.200000000000003 112.333 -0.049 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 76' ' ' TYR . . . . . 0.479 ' CB ' ' O ' ' A' ' 73' ' ' MET . 9.0 t80 -34.16 -45.33 0.21 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.202 -0.454 . . . . 65.409999999999997 110.938 -179.941 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 77' ' ' THR . . . . . 0.473 HG23 ' CB ' ' A' ' 73' ' ' MET . 51.9 p -114.97 163.45 15.56 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.099 -0.5 . . . . 73.319999999999993 111.163 -179.976 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -85.7 132.64 43.72 Favored Pre-proline 0 C--N 1.329 -0.326 0 CA-C-O 121.585 0.707 . . . . 72.340000000000003 111.09 179.865 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 79' ' ' PRO . . . . . 0.844 ' HG3' HD11 ' A' ' 113' ' ' ILE . 54.0 Cg_endo -69.71 -170.72 0.41 Allowed 'Trans proline' 0 C--N 1.341 0.165 0 C-N-CA 122.714 2.276 . . . . 75.129999999999995 112.367 -179.993 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . 0.429 ' HG3' ' N ' ' A' ' 81' ' ' ILE . 0.3 OUTLIER -124.36 140.11 53.26 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.242 -0.435 . . . . 72.230000000000004 110.924 179.955 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 81' ' ' ILE . . . . . 0.523 HD13 ' HA ' ' A' ' 68' ' ' PHE . 6.4 mm -130.42 137.07 57.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.127 -0.488 . . . . 64.519999999999996 111.152 179.957 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . 0.48 ' HG3' ' CD ' ' A' ' 84' ' ' LYS . 6.0 pt-20 -140.04 144.09 36.71 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.174 -0.466 . . . . 74.049999999999997 110.888 179.942 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 83' ' ' PHE . . . . . 0.692 ' CG ' HD22 ' A' ' 94' ' ' LEU . 58.6 m-85 -94.3 140.63 29.54 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.142 -0.481 . . . . 72.409999999999997 110.892 -179.918 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 84' ' ' LYS . . . . . 0.48 ' CD ' ' HG3' ' A' ' 82' ' ' GLU . 10.4 mmmt -124.2 169.62 11.55 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.172 -0.467 . . . . 72.120000000000005 110.904 179.932 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . 0.575 HD22 ' N ' ' A' ' 85' ' ' ASN . 1.0 OUTLIER 61.78 -74.69 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.216 -0.447 . . . . 64.450000000000003 110.95 179.982 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 86' ' ' VAL . . . . . 0.497 ' CG1' HD11 ' A' ' 94' ' ' LEU . 3.4 m 41.73 90.87 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.167 -0.469 . . . . 74.430000000000007 111.147 179.896 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 87' ' ' GLN . . . . . 0.472 ' NE2' ' OD1' ' A' ' 88' ' ' ASN . 0.2 OUTLIER -104.06 -95.92 0.32 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.167 -0.47 . . . . 74.540000000000006 110.989 179.957 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 88' ' ' ASN . . . . . 0.472 ' OD1' ' NE2' ' A' ' 87' ' ' GLN . 32.0 m120 -45.76 -36.04 4.79 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.183 -0.462 . . . . 62.009999999999998 110.891 -180.0 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 89' ' ' VAL . . . . . 0.541 HG21 ' HG ' ' A' ' 94' ' ' LEU . 3.2 p -63.94 149.97 10.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.16 -0.473 . . . . 62.140000000000001 111.106 179.942 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 90' ' ' MET . . . . . . . . . . . . . 29.8 mtm -98.75 -74.29 0.59 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.194 -0.457 . . . . 74.319999999999993 110.887 179.914 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 7.7 p-10 176.4 -32.34 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.276 -0.42 . . . . 71.329999999999998 110.85 179.932 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -54.43 -45.86 73.12 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.213 -0.449 . . . . 73.400000000000006 110.823 -179.759 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -70.84 -38.97 73.22 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.165 -0.47 . . . . 74.439999999999998 110.893 -179.928 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . 0.732 HD21 HD13 ' A' ' 64' ' ' ILE . 21.4 mt -58.87 -47.43 84.93 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.208 -0.451 . . . . 70.439999999999998 110.912 -179.979 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 26.4 mt-30 -61.06 -34.56 75.08 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.166 -0.47 . . . . 64.25 110.91 179.941 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 96' ' ' MET . . . . . 0.498 ' SD ' ' CE1' ' A' ' 128' ' ' PHE . 9.2 ttp -61.25 -37.94 84.89 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.212 -0.449 . . . . 75.239999999999995 110.838 -179.992 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 97' ' ' LEU . . . . . 0.571 ' O ' ' CD1' ' A' ' 101' ' ' PHE . 27.8 mt -64.32 -43.07 95.8 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.224 -0.444 . . . . 64.299999999999997 110.93 179.994 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 5.0 mmtp -55.06 -38.51 68.12 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.227 -0.442 . . . . 73.409999999999997 110.91 179.82 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -70.19 -42.14 72.8 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.196 -0.456 . . . . 73.129999999999995 110.854 -179.903 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 100' ' ' GLU . . . . . 0.566 ' O ' HD12 ' A' ' 104' ' ' ILE . 6.0 mt-10 -66.69 -24.3 66.24 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.149 -0.478 . . . . 61.509999999999998 110.899 -179.953 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 101' ' ' PHE . . . . . 0.65 ' CD2' HD11 ' A' ' 117' ' ' ILE . 9.4 m-30 -60.1 -31.12 69.74 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.138 -0.483 . . . . 74.230000000000004 110.905 -179.95 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.01 -40.76 87.37 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.148 -0.478 . . . . 71.109999999999999 110.877 179.948 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 1.6 mppt? -67.9 -42.95 80.39 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.226 -0.443 . . . . 74.400000000000006 110.92 179.853 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 104' ' ' ILE . . . . . 0.566 HD12 ' O ' ' A' ' 100' ' ' GLU . 2.3 mt -62.17 -47.59 92.39 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.218 -0.446 . . . . 72.209999999999994 111.1 179.879 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 105' ' ' HIS . . . . . . . . . . . . . 7.7 t-80 -62.93 -42.83 99.93 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.16 -0.473 . . . . 74.439999999999998 110.815 179.94 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -56.49 -41.76 77.18 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.218 -0.446 . . . . 64.150000000000006 110.927 -179.954 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 9.3 t -81.74 -23.63 36.58 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.147 -0.479 . . . . 74.230000000000004 111.157 -179.999 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 108' ' ' SER . . . . . 0.429 ' HB2' HG22 ' A' ' 113' ' ' ILE . 24.2 m -107.93 26.39 10.41 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.236 -0.438 . . . . 74.200000000000003 110.883 -179.89 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -65.73 86.04 0.08 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.113 -0.494 . . . . 73.200000000000003 110.845 -179.907 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 119.75 38.89 0.68 Allowed Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.779 -0.724 . . . . 62.420000000000002 112.464 -179.996 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 111' ' ' GLN . . . . . . . . . . . . . 10.9 pt20 -171.42 -176.43 1.85 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.735 0.302 . . . . 70.450000000000003 110.893 -179.914 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 63.1 mt-10 -60.57 131.59 51.2 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.214 -0.448 . . . . 62.130000000000003 110.911 -179.966 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 113' ' ' ILE . . . . . 0.844 HD11 ' HG3' ' A' ' 79' ' ' PRO . 7.6 pt -127.02 -5.53 4.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.187 -0.461 . . . . 62.310000000000002 111.137 179.969 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 114' ' ' ILE . . . . . 0.852 ' H ' HD12 ' A' ' 114' ' ' ILE . 3.6 mp -68.3 -46.61 80.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.185 -0.461 . . . . 73.239999999999995 111.134 179.828 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 115' ' ' PHE . . . . . 0.745 ' HE1' HG21 ' A' ' 25' ' ' ILE . 12.5 t80 -69.13 -33.83 74.07 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.187 -0.46 . . . . 65.120000000000005 110.853 179.954 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 51.9 mm-40 -68.06 -44.72 75.72 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.191 -0.459 . . . . 70.530000000000001 110.886 -179.949 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 117' ' ' ILE . . . . . 0.65 HD11 ' CD2' ' A' ' 101' ' ' PHE . 0.4 OUTLIER -66.41 -41.2 88.37 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 116.192 -0.458 . . . . 71.25 111.147 179.982 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 118' ' ' THR . . . . . 0.712 HG23 ' O ' ' A' ' 114' ' ' ILE . 69.8 p -67.88 -43.08 80.16 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.162 -0.472 . . . . 73.150000000000006 111.177 179.906 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -66.49 -31.59 72.41 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.209 -0.451 . . . . 71.129999999999995 110.907 -179.878 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 120' ' ' PHE . . . . . 0.441 ' CG ' HD11 ' A' ' 104' ' ' ILE . 0.3 OUTLIER -77.73 -44.73 26.86 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.091 -0.504 . . . . 75.120000000000005 110.912 -179.988 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 121' ' ' THR . . . . . 1.076 HG21 HD11 ' A' ' 66' ' ' LEU . 18.8 p -66.17 -45.42 80.97 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.167 -0.47 . . . . 55.130000000000003 111.203 -179.979 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 3.6 pp0? -60.91 -38.12 84.64 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.187 -0.46 . . . . 62.210000000000001 110.894 179.978 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 123' ' ' GLU . . . . . 0.497 ' CG ' ' N ' ' A' ' 124' ' ' LYS . 1.6 pt-20 -74.12 -48.26 30.7 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.228 -0.442 . . . . 73.430000000000007 110.894 -179.944 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 124' ' ' LYS . . . . . 0.497 ' N ' ' CG ' ' A' ' 123' ' ' GLU . 0.0 OUTLIER -63.5 -28.51 70.0 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.084 -0.507 . . . . 73.400000000000006 110.865 179.986 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 125' ' ' LEU . . . . . 0.668 HD23 ' O ' ' A' ' 125' ' ' LEU . 1.4 tt -68.36 -51.64 42.12 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.208 -0.451 . . . . 53.149999999999999 110.928 179.947 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 26.8 t70 -60.31 -37.19 79.79 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.208 -0.451 . . . . 50.530000000000001 110.882 179.837 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 1.6 mm-40 -60.18 -48.68 80.69 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.185 -0.461 . . . . 73.409999999999997 110.838 -179.895 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 128' ' ' PHE . . . . . 0.498 ' CE1' ' SD ' ' A' ' 96' ' ' MET . 7.4 m-85 -64.19 -61.51 2.2 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.152 -0.477 . . . . 73.510000000000005 110.874 -179.907 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 129' ' ' GLN . . . . . 0.491 ' CG ' HG22 ' A' ' 60' ' ' VAL . 1.4 tm0? -42.86 -35.48 1.2 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.157 -0.474 . . . . 63.310000000000002 110.886 -179.916 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 130' ' ' ASN . . . . . . . . . . . . . 1.9 m-20 -69.57 -38.84 77.55 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.205 -0.452 . . . . 45.200000000000003 110.891 -179.949 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 131' ' ' VAL . . . . . 0.501 ' O ' HG23 ' A' ' 131' ' ' VAL . 3.2 m -110.81 26.66 2.75 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.166 -0.47 . . . . 55.229999999999997 111.136 179.883 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 132' ' ' VAL . . . . . 0.418 ' N ' ' O ' ' A' ' 128' ' ' PHE . 1.8 p -90.85 158.87 2.86 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.189 -0.459 . . . . 64.409999999999997 111.111 179.936 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 133' ' ' ASN . . . . . . . . . . . . . 1.6 m-20 -115.23 86.67 2.5 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.183 -0.462 . . . . 75.519999999999996 110.853 -179.964 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 134' ' ' THR . . . . . . . . . . . . . 43.1 p -139.38 157.25 46.19 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.144 -0.48 . . . . 72.299999999999997 111.127 -179.982 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -139.63 103.56 4.71 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.198 -0.456 . . . . 50.140000000000001 110.888 179.994 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 42.2 t -43.26 139.46 1.91 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.216 -0.447 . . . . 64.200000000000003 110.878 -179.843 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 137' ' ' LEU . . . . . . . . . . . . . 32.5 tp -170.32 133.75 1.12 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.12 -0.491 . . . . 73.140000000000001 110.958 179.993 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 C--N 1.329 -0.298 0 CA-C-N 116.214 -0.448 . . . . 65.530000000000001 110.885 179.949 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--O 1.231 0.118 0 CA-C-O 120.762 0.315 . . . . 73.049999999999997 110.873 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . 0.687 ' O ' HD12 ' A' ' 3' ' ' LEU . 58.3 m -166.38 111.11 0.8 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.257 -0.429 . . . . 63.240000000000002 110.866 -179.761 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . 0.687 HD12 ' O ' ' A' ' 2' ' ' SER . 0.2 OUTLIER -160.77 177.97 9.9 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.13 -0.486 . . . . 74.439999999999998 110.923 179.954 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -111.73 -71.54 0.75 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.174 -0.466 . . . . 50.399999999999999 110.878 -179.954 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 32.4 m-70 -55.09 -179.51 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.101 -0.5 . . . . 72.340000000000003 110.877 179.979 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 3.2 mt -42.84 123.3 2.67 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.251 -0.432 . . . . 71.340000000000003 110.906 -179.953 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 9.7 t -163.8 172.34 14.25 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.158 -0.474 . . . . 74.0 111.156 179.949 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.409 HD22 ' O ' ' A' ' 72' ' ' PRO . 23.4 mt -52.6 -32.96 44.07 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.247 -0.433 . . . . 65.450000000000003 110.912 179.958 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 6.3 m-20 -50.96 -34.59 29.51 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.251 -0.432 . . . . 73.409999999999997 110.86 179.827 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 36.6 mm-40 -66.33 -36.38 82.76 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.178 -0.465 . . . . 51.210000000000001 110.897 -179.892 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 17.9 m-85 -65.2 -26.05 67.97 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.168 -0.469 . . . . 74.239999999999995 110.919 -179.857 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -58.73 -37.59 76.51 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.106 -0.497 . . . . 54.420000000000002 110.927 -179.871 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 1.1 mm-40 -58.26 -41.68 84.78 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.104 -0.498 . . . . 70.230000000000004 110.898 179.987 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 2.3 mp -68.08 -40.16 82.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.208 -0.451 . . . . 73.219999999999999 111.141 179.939 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . 0.602 ' OE1' ' CE1' ' A' ' 74' ' ' TYR . 12.6 mm-40 -62.76 -45.04 94.55 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.133 -0.485 . . . . 64.120000000000005 110.87 179.989 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 3.2 t -58.52 -44.51 89.57 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.163 -0.471 . . . . 62.130000000000003 110.889 -179.925 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . 0.4 ' O ' ' HG3' ' A' ' 20' ' ' GLU . 0.6 OUTLIER -57.58 -33.51 68.25 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.217 -0.447 . . . . 71.040000000000006 110.911 -179.931 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 2.0 mm-40 -66.05 -37.69 86.47 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.179 -0.464 . . . . 63.299999999999997 110.896 -179.979 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.647 HD21 HG13 ' A' ' 46' ' ' ILE . 9.2 mp -65.7 -51.39 59.71 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.128 -0.487 . . . . 53.439999999999998 110.929 -179.995 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . 0.4 ' HG3' ' O ' ' A' ' 17' ' ' ASN . 2.0 pt-20 -68.25 -32.58 72.87 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.207 -0.452 . . . . 51.329999999999998 110.902 179.902 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -66.05 -49.92 65.99 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.143 -0.48 . . . . 73.329999999999998 111.103 179.952 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . 0.421 ' HA ' HD12 ' A' ' 25' ' ' ILE . 0.7 OUTLIER -77.01 -34.58 22.03 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.226 -0.443 . . . . 72.409999999999997 111.153 179.966 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . 0.403 ' CG ' ' O ' ' A' ' 19' ' ' LEU . 26.6 mtp180 -52.34 -34.45 47.37 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.184 -0.462 . . . . 75.129999999999995 110.913 179.935 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -67.16 -35.02 78.79 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.187 -0.461 . . . . 74.329999999999998 110.86 -179.758 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . 0.678 HG21 ' HE1' ' A' ' 115' ' ' PHE . 3.2 mt -80.61 -44.4 21.65 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.093 -0.503 . . . . 75.120000000000005 111.132 179.895 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 19.9 m-85 -110.73 45.89 1.11 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.208 -0.451 . . . . 62.310000000000002 110.92 -179.941 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 3.1 mtm -43.49 -57.23 3.2 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.127 -0.488 . . . . 74.209999999999994 110.887 179.884 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 5.4 m-20 -81.84 -35.94 28.85 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.203 -0.453 . . . . 71.409999999999997 110.883 179.949 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -80.62 44.03 0.7 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.218 -0.446 . . . . 73.430000000000007 110.827 -179.983 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' PHE . . . . . 0.542 ' HA ' HD13 ' A' ' 50' ' ' ILE . 10.1 t80 -129.15 123.72 32.85 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.233 -0.44 . . . . 71.140000000000001 110.921 -179.937 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 20.3 m -113.17 135.03 54.26 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.171 -0.468 . . . . 64.530000000000001 111.101 -179.882 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -95.94 113.99 25.67 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.216 -0.447 . . . . 52.109999999999999 110.868 179.924 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 1.115 HD23 ' N ' ' A' ' 34' ' ' THR . 0.1 OUTLIER -113.36 -18.74 11.96 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.162 -0.472 . . . . 73.219999999999999 110.93 -179.935 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . 1.115 ' N ' HD23 ' A' ' 33' ' ' LEU . 2.5 m -37.99 156.66 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.163 -0.471 . . . . 73.329999999999998 111.143 179.94 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -73.89 62.82 0.87 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.198 -0.456 . . . . 75.129999999999995 110.905 179.924 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 2.1 mmm180 -129.06 -32.57 2.04 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.17 -0.468 . . . . 72.109999999999999 110.843 -179.984 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . 0.466 ' O ' ' CB ' ' A' ' 38' ' ' SER . 0.0 OUTLIER -72.05 122.51 21.03 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.216 -0.447 . . . . 72.530000000000001 110.896 179.967 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . 0.466 ' CB ' ' O ' ' A' ' 37' ' ' LYS . 3.7 t 80.57 -48.54 0.3 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.214 -0.448 . . . . 74.430000000000007 110.825 -179.942 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 14.5 m -101.83 172.08 7.15 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.147 -0.479 . . . . 64.5 110.842 -179.817 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' TRP . . . . . 0.52 ' CG ' ' N ' ' A' ' 41' ' ' ASP . 8.9 p90 -88.29 -48.09 7.93 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.141 -0.481 . . . . 75.530000000000001 110.963 179.988 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . 0.52 ' N ' ' CG ' ' A' ' 40' ' ' TRP . 0.2 OUTLIER 172.97 132.98 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.166 -0.47 . . . . 71.420000000000002 110.846 179.944 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 18.1 mttt -120.24 -90.41 0.58 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.194 -0.457 . . . . 74.150000000000006 110.907 179.959 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . 0.654 ' N ' ' CD ' ' A' ' 44' ' ' PRO . 4.3 mp0 -129.35 41.48 0.74 Allowed Pre-proline 0 C--N 1.328 -0.329 0 CA-C-O 121.598 0.713 . . . . 64.109999999999999 110.941 179.912 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' PRO . . . . . 0.654 ' CD ' ' N ' ' A' ' 43' ' ' GLN . 53.9 Cg_endo -69.77 -172.73 0.61 Allowed 'Trans proline' 0 C--N 1.341 0.178 0 C-N-CA 122.685 2.257 . . . . 74.420000000000002 112.333 179.994 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' GLN . . . . . 0.997 ' HG2' HG23 ' A' ' 47' ' ' ILE . 0.3 OUTLIER -178.74 29.81 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.208 -0.451 . . . . 74.239999999999995 110.907 -179.973 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . 0.661 HG22 ' O ' ' A' ' 45' ' ' GLN . 0.1 OUTLIER 87.52 -18.01 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.214 -0.448 . . . . 73.150000000000006 111.184 -179.971 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . 0.997 HG23 ' HG2' ' A' ' 45' ' ' GLN . 0.1 OUTLIER -38.28 147.2 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.164 -0.471 . . . . 64.230000000000004 111.139 179.811 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 48' ' ' PHE . . . . . 0.86 ' HA ' HD22 ' A' ' 33' ' ' LEU . 1.9 p90 -162.02 160.93 28.19 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.149 -0.478 . . . . 64.120000000000005 110.871 179.975 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . 0.676 ' CG ' HD13 ' A' ' 33' ' ' LEU . 18.8 mt-10 -110.61 155.61 22.12 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.153 -0.476 . . . . 72.329999999999998 110.929 -179.948 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . 0.542 HD13 ' HA ' ' A' ' 30' ' ' PHE . 9.2 mm -135.44 142.28 40.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.2 -0.454 . . . . 64.120000000000005 111.142 179.935 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 89.7 m -88.12 139.18 30.77 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.168 -0.469 . . . . 74.219999999999999 111.167 179.938 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . 0.679 HD12 HD12 ' A' ' 66' ' ' LEU . 17.4 mt -141.12 162.63 35.04 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.232 -0.44 . . . . 64.310000000000002 110.918 179.957 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 53' ' ' ARG . . . . . 0.491 ' C ' HD21 ' A' ' 125' ' ' LEU . 0.0 OUTLIER -178.27 173.76 1.38 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.179 -0.464 . . . . 74.420000000000002 110.817 179.969 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . 0.535 ' N ' HD21 ' A' ' 125' ' ' LEU . 10.9 p -67.46 -173.6 0.32 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.192 -0.458 . . . . 61.100000000000001 110.888 -179.801 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . 0.47 HG13 ' OD1' ' A' ' 126' ' ' ASP . 34.0 m -94.13 -28.94 4.21 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.169 -0.468 . . . . 62.020000000000003 111.148 179.935 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -113.54 -173.8 2.34 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.123 -0.489 . . . . 62.350000000000001 110.861 179.941 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -117.61 -13.56 10.25 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.188 -0.46 . . . . 74.319999999999993 110.878 179.986 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . 0.556 ' HA ' ' C ' ' A' ' 59' ' ' PRO . 5.9 pt-20 -122.67 144.11 41.69 Favored Pre-proline 0 C--N 1.329 -0.296 0 CA-C-O 121.637 0.732 . . . . 75.310000000000002 110.85 -179.975 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 59' ' ' PRO . . . . . 0.556 ' C ' ' HA ' ' A' ' 58' ' ' GLU . 53.9 Cg_endo -69.76 -5.18 8.73 Favored 'Cis proline' 0 C--N 1.342 0.2 0 C-N-CA 122.663 -1.807 . . . . 74.150000000000006 112.316 -0.042 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 60' ' ' VAL . . . . . 0.604 HG22 ' CG ' ' A' ' 129' ' ' GLN . 14.9 m -154.9 -179.5 0.25 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.256 -0.429 . . . . 72.099999999999994 111.17 179.912 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . 0.429 ' O ' ' C ' ' A' ' 62' ' ' SER . 1.2 pt-20 -118.91 -12.8 9.53 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.193 -0.458 . . . . 71.430000000000007 110.843 179.989 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . 0.919 ' HB3' HD11 ' A' ' 125' ' ' LEU . 7.8 t 35.51 90.78 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.206 -0.452 . . . . 74.310000000000002 110.841 -179.811 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 6.4 t -104.87 123.04 47.02 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.117 -0.492 . . . . 75.010000000000005 110.85 -179.83 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 64' ' ' ILE . . . . . 0.625 HD11 HG11 ' A' ' 89' ' ' VAL . 20.7 mt -136.2 132.18 49.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.121 -0.491 . . . . 74.519999999999996 111.088 179.992 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 87.0 m -95.84 113.96 25.65 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.218 -0.446 . . . . 75.439999999999998 111.1 179.95 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . 0.774 HD11 HG21 ' A' ' 121' ' ' THR . 11.8 mt -94.54 112.62 24.39 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.236 -0.438 . . . . 75.439999999999998 110.913 179.906 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 67' ' ' HIS . . . . . 0.508 ' CE1' HD11 ' A' ' 33' ' ' LEU . 2.6 t60 -108.78 112.0 24.05 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.188 -0.46 . . . . 44.020000000000003 110.811 179.864 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 68' ' ' PHE . . . . . 0.556 ' CE1' HG23 ' A' ' 114' ' ' ILE . 0.0 OUTLIER -102.95 145.11 30.34 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.181 -0.463 . . . . 51.350000000000001 110.878 -179.946 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . 0.628 ' HA ' HG22 ' A' ' 47' ' ' ILE . . . -122.32 110.74 16.05 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.135 -0.484 . . . . 54.32 111.124 179.911 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 70' ' ' MET . . . . . 0.503 ' CE ' HD11 ' A' ' 114' ' ' ILE . 3.9 mmt -76.04 86.46 2.94 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.222 -0.444 . . . . 65.319999999999993 110.848 -179.998 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -40.34 156.57 0.18 Allowed Pre-proline 0 C--N 1.33 -0.274 0 CA-C-O 121.579 0.704 . . . . 70.140000000000001 111.145 -179.944 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 72' ' ' PRO . . . . . 0.409 ' O ' HD22 ' A' ' 8' ' ' LEU . 54.0 Cg_endo -69.73 1.47 4.38 Favored 'Trans proline' 0 C--N 1.341 0.161 0 C-N-CA 122.687 2.258 . . . . 41.219999999999999 112.368 179.923 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 73' ' ' MET . . . . . 0.501 ' O ' ' CB ' ' A' ' 76' ' ' TYR . 0.0 OUTLIER -118.25 -26.14 6.4 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.192 -0.458 . . . . 73.310000000000002 110.909 179.908 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 74' ' ' TYR . . . . . 0.656 ' CD1' ' C ' ' A' ' 74' ' ' TYR . 0.0 OUTLIER -48.05 150.65 1.98 Allowed Pre-proline 0 C--N 1.328 -0.346 0 CA-C-O 121.659 0.742 . . . . 75.239999999999995 110.91 -179.864 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 75' ' ' PRO . . . . . 0.546 ' C ' ' HA ' ' A' ' 74' ' ' TYR . 54.3 Cg_endo -69.76 -11.12 11.79 Favored 'Cis proline' 0 C--N 1.34 0.129 0 C-N-CA 122.684 -1.798 . . . . 75.230000000000004 112.365 -0.09 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 76' ' ' TYR . . . . . 0.501 ' CB ' ' O ' ' A' ' 73' ' ' MET . 16.4 t80 -32.82 -53.9 0.35 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.199 -0.455 . . . . 72.25 110.949 -179.96 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 77' ' ' THR . . . . . 0.427 HG23 ' HB3' ' A' ' 73' ' ' MET . 29.6 p -106.98 171.44 7.37 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.075 -0.511 . . . . 43.420000000000002 111.162 -179.947 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -85.09 130.19 53.09 Favored Pre-proline 0 C--N 1.329 -0.325 0 CA-C-O 121.566 0.698 . . . . 43.210000000000001 111.107 179.881 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 79' ' ' PRO . . . . . 0.573 ' HG3' HD11 ' A' ' 113' ' ' ILE . 53.4 Cg_endo -69.8 174.13 9.99 Favored 'Trans proline' 0 C--N 1.341 0.168 0 C-N-CA 122.675 2.25 . . . . 43.520000000000003 112.338 -179.965 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -120.45 137.69 54.2 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.223 -0.444 . . . . 62.229999999999997 110.857 -179.962 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 81' ' ' ILE . . . . . 0.598 HD13 HD13 ' A' ' 117' ' ' ILE . 13.7 mt -143.68 150.13 17.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.136 -0.484 . . . . 62.350000000000001 111.163 179.953 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . 0.492 ' HG3' ' CD ' ' A' ' 84' ' ' LYS . 9.5 pt-20 -149.0 147.48 28.61 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.21 -0.45 . . . . 75.430000000000007 110.915 179.959 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 83' ' ' PHE . . . . . 0.584 ' CG ' HD22 ' A' ' 94' ' ' LEU . 15.2 m-85 -90.51 140.96 29.24 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.154 -0.476 . . . . 74.019999999999996 110.851 -179.901 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 84' ' ' LYS . . . . . 0.512 ' O ' ' N ' ' A' ' 86' ' ' VAL . 8.9 mmmt -124.57 174.43 7.83 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.166 -0.47 . . . . 71.040000000000006 110.91 179.919 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . 0.413 ' O ' ' CG2' ' A' ' 86' ' ' VAL . 2.5 m-80 59.3 -75.75 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.215 -0.448 . . . . 73.140000000000001 110.915 179.998 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 86' ' ' VAL . . . . . 0.595 HG11 HD11 ' A' ' 94' ' ' LEU . 3.5 m 41.73 92.65 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.19 -0.459 . . . . 72.219999999999999 111.104 179.901 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -96.22 -77.82 0.47 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.189 -0.46 . . . . 64.5 110.861 -179.958 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -59.71 -56.82 17.09 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.202 -0.454 . . . . 61.25 110.881 -179.937 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 89' ' ' VAL . . . . . 0.664 HG21 ' HG ' ' A' ' 94' ' ' LEU . 2.1 p -51.07 136.68 9.95 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.19 -0.459 . . . . 74.310000000000002 111.158 179.887 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 90' ' ' MET . . . . . 0.625 ' SD ' HG22 ' A' ' 134' ' ' THR . 6.8 mtm -88.97 -70.37 0.65 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.121 -0.491 . . . . 44.229999999999997 110.912 179.906 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 91' ' ' ASP . . . . . 0.433 ' HA ' HD12 ' A' ' 94' ' ' LEU . 10.3 t0 -175.19 -31.62 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.217 -0.447 . . . . 73.310000000000002 110.867 179.957 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -53.98 -46.76 71.78 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.191 -0.459 . . . . 71.400000000000006 110.85 -179.722 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 93' ' ' GLN . . . . . 0.545 ' HG3' ' CE1' ' A' ' 128' ' ' PHE . 0.3 OUTLIER -70.24 -37.69 75.01 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.158 -0.474 . . . . 63.229999999999997 110.908 -179.978 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . 0.664 ' HG ' HG21 ' A' ' 89' ' ' VAL . 48.1 mt -59.2 -47.54 84.94 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.203 -0.453 . . . . 74.329999999999998 110.96 179.995 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 1.7 mt-30 -61.42 -35.74 78.39 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.181 -0.463 . . . . 62.340000000000003 110.857 179.932 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 96' ' ' MET . . . . . . . . . . . . . 31.7 ttp -61.44 -42.25 98.46 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.21 -0.45 . . . . 74.400000000000006 110.827 -179.964 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 97' ' ' LEU . . . . . 0.643 HD22 HG22 ' A' ' 121' ' ' THR . 79.8 mt -60.02 -43.82 95.02 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.243 -0.435 . . . . 71.530000000000001 110.965 -179.995 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 98' ' ' LYS . . . . . 0.499 ' HD3' ' CE2' ' A' ' 83' ' ' PHE . 6.0 mmtp -55.49 -39.06 69.96 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.18 -0.464 . . . . 73.319999999999993 110.867 179.809 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 57.1 m -64.11 -40.2 95.69 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.25 -0.432 . . . . 60.43 110.862 -179.888 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 100' ' ' GLU . . . . . 0.575 ' OE1' ' CZ ' ' A' ' 120' ' ' PHE . 19.5 mm-40 -71.44 -27.24 63.14 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.116 -0.493 . . . . 73.310000000000002 110.91 -179.983 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 101' ' ' PHE . . . . . 0.745 ' CG ' HD11 ' A' ' 117' ' ' ILE . 10.5 m-30 -60.19 -31.12 69.84 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.173 -0.467 . . . . 64.349999999999994 110.856 -179.867 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 14.1 ttmt -73.92 -41.54 61.92 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.165 -0.47 . . . . 73.200000000000003 110.898 179.958 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 17.4 ttpp -69.82 -41.25 75.24 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.167 -0.469 . . . . 74.120000000000005 110.905 179.856 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 104' ' ' ILE . . . . . 0.562 HD12 ' O ' ' A' ' 100' ' ' GLU . 3.9 mt -64.45 -47.59 88.72 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 116.257 -0.429 . . . . 55.25 111.131 179.86 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 105' ' ' HIS . . . . . . . . . . . . . 2.1 t60 -62.82 -43.62 98.33 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.197 -0.456 . . . . 73.420000000000002 110.86 179.861 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -56.53 -43.3 79.69 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.196 -0.456 . . . . 72.219999999999999 110.872 -179.913 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 107' ' ' THR . . . . . 0.432 HG22 ' O ' ' A' ' 104' ' ' ILE . 9.9 t -77.87 -30.12 50.7 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.166 -0.47 . . . . 61.130000000000003 111.161 -179.991 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 108' ' ' SER . . . . . 0.425 ' CB ' HG22 ' A' ' 113' ' ' ILE . 27.0 m -107.05 33.08 4.15 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.221 -0.445 . . . . 71.319999999999993 110.846 -179.867 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 34.1 ttt180 -76.57 80.65 3.24 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.149 -0.478 . . . . 71.409999999999997 110.859 -179.93 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 151.21 -29.44 0.98 Allowed Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.694 -0.765 . . . . 51.109999999999999 112.484 -179.953 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 111' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -111.41 -164.43 0.92 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.784 0.326 . . . . 63.5 110.956 -179.909 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 12.2 mt-10 -67.23 133.87 50.56 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.234 -0.439 . . . . 63.219999999999999 110.839 -179.924 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 113' ' ' ILE . . . . . 0.573 HD11 ' HG3' ' A' ' 79' ' ' PRO . 2.8 pt -122.95 -16.94 5.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.096 -0.502 . . . . 44.210000000000001 111.121 179.986 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 114' ' ' ILE . . . . . 0.698 ' O ' HG23 ' A' ' 118' ' ' THR . 9.5 mm -57.18 -43.12 81.09 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 116.152 -0.476 . . . . 61.450000000000003 111.065 179.879 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 115' ' ' PHE . . . . . 0.678 ' HE1' HG21 ' A' ' 25' ' ' ILE . 20.0 t80 -70.58 -31.94 69.14 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.167 -0.47 . . . . 72.430000000000007 110.89 179.991 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 9.1 mm-40 -68.21 -47.79 66.9 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.144 -0.48 . . . . 72.010000000000005 110.862 -179.892 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 117' ' ' ILE . . . . . 0.745 HD11 ' CG ' ' A' ' 101' ' ' PHE . 0.7 OUTLIER -66.02 -42.34 91.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.134 -0.484 . . . . 71.030000000000001 111.117 -179.999 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 118' ' ' THR . . . . . 0.698 HG23 ' O ' ' A' ' 114' ' ' ILE . 70.8 p -68.01 -41.69 81.85 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.192 -0.458 . . . . 74.310000000000002 111.169 179.98 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 29.5 t -67.33 -39.71 85.84 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.199 -0.455 . . . . 71.409999999999997 110.858 -179.873 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 120' ' ' PHE . . . . . 0.575 ' CZ ' ' OE1' ' A' ' 100' ' ' GLU . 1.0 OUTLIER -67.13 -47.75 70.17 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.147 -0.479 . . . . 74.409999999999997 110.894 -179.923 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 121' ' ' THR . . . . . 0.774 HG21 HD11 ' A' ' 66' ' ' LEU . 34.8 p -65.44 -39.72 92.42 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.141 -0.481 . . . . 74.209999999999994 111.133 -179.955 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 37.6 tt0 -65.03 -47.04 78.85 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.223 -0.444 . . . . 75.400000000000006 110.907 -180.0 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 123' ' ' GLU . . . . . 0.438 ' CG ' ' N ' ' A' ' 124' ' ' LYS . 3.6 pt-20 -67.05 -44.42 80.19 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.231 -0.44 . . . . 64.450000000000003 110.88 -179.949 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 124' ' ' LYS . . . . . 0.59 ' O ' ' CE1' ' A' ' 128' ' ' PHE . 0.0 OUTLIER -70.78 -32.32 69.39 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.141 -0.481 . . . . 74.340000000000003 110.848 -180.0 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 125' ' ' LEU . . . . . 0.919 HD11 ' HB3' ' A' ' 62' ' ' SER . 1.9 tp -63.25 -42.42 99.17 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.221 -0.445 . . . . 75.239999999999995 110.91 179.933 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 126' ' ' ASP . . . . . 0.47 ' OD1' HG13 ' A' ' 55' ' ' VAL . 9.3 m-20 -59.65 -38.65 81.98 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.186 -0.461 . . . . 62.409999999999997 110.855 179.834 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 1.6 mt-10 -62.68 -36.12 81.88 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.142 -0.481 . . . . 74.420000000000002 110.862 -179.858 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 128' ' ' PHE . . . . . 0.59 ' CE1' ' O ' ' A' ' 124' ' ' LYS . 7.0 m-30 -48.58 -64.55 0.77 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.221 -0.445 . . . . 73.439999999999998 110.894 -179.93 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 129' ' ' GLN . . . . . 0.604 ' CG ' HG22 ' A' ' 60' ' ' VAL . 4.4 mt-30 -48.46 -33.31 9.12 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.115 -0.493 . . . . 74.540000000000006 110.965 -179.972 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 130' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -62.26 -48.4 80.09 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.207 -0.451 . . . . 60.299999999999997 110.892 179.998 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 131' ' ' VAL . . . . . 0.597 ' O ' HG23 ' A' ' 131' ' ' VAL . 19.3 m -137.3 92.94 0.93 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.178 -0.464 . . . . 62.140000000000001 111.13 179.937 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 132' ' ' VAL . . . . . 0.559 HG23 ' O ' ' A' ' 128' ' ' PHE . 98.8 t -106.64 147.0 12.44 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.159 -0.473 . . . . 70.340000000000003 111.142 179.927 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 133' ' ' ASN . . . . . . . . . . . . . 2.9 t-20 -122.83 97.45 5.45 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.157 -0.474 . . . . 51.310000000000002 110.903 -179.992 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 134' ' ' THR . . . . . 0.625 HG22 ' SD ' ' A' ' 90' ' ' MET . 71.6 p -124.12 -61.05 1.38 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.181 -0.463 . . . . 73.209999999999994 111.135 -179.968 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 135' ' ' GLN . . . . . 0.438 ' C ' ' O ' ' A' ' 134' ' ' THR . 0.0 OUTLIER 34.79 44.68 0.13 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.222 -0.445 . . . . 63.25 110.901 -179.948 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -165.11 39.66 0.07 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.229 -0.442 . . . . 72.329999999999998 110.881 -179.831 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 137' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -157.14 -53.33 0.08 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.136 -0.483 . . . . 70.319999999999993 110.931 179.993 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--N 1.329 -0.296 0 CA-C-N 116.187 -0.46 . . . . 65.340000000000003 110.915 179.909 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 14.4 ttm . . . . . 0 C--O 1.231 0.117 0 CA-C-O 120.761 0.315 . . . . 60.210000000000001 110.859 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 54.1 p -146.64 143.36 28.75 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.209 -0.451 . . . . 62.100000000000001 110.826 -179.821 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 28.8 mt 60.94 149.77 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.146 -0.479 . . . . 70.129999999999995 110.9 179.964 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 50.5 m -156.35 109.07 2.6 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.22 -0.446 . . . . 65.040000000000006 110.849 -179.904 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER 177.72 154.53 0.31 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.168 -0.469 . . . . 71.409999999999997 110.855 179.982 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -68.98 90.57 0.45 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.204 -0.453 . . . . 75.430000000000007 110.933 -179.974 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 1.9 t -165.45 171.63 13.09 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.202 -0.454 . . . . 74.219999999999999 111.138 179.945 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 60.5 mt -51.96 -26.15 9.85 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.197 -0.456 . . . . 74.099999999999994 110.924 179.978 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . 0.45 ' N ' ' OD1' ' A' ' 9' ' ' ASP . 0.8 OUTLIER -51.82 -35.23 43.63 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.18 -0.463 . . . . 55.109999999999999 110.844 179.886 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 71.5 mm-40 -65.23 -40.42 94.03 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.238 -0.437 . . . . 74.439999999999998 110.914 -179.952 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 13.6 m-85 -54.69 -23.15 16.21 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.199 -0.455 . . . . 74.120000000000005 110.909 -179.862 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER -57.48 -36.39 71.41 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.124 -0.489 . . . . 71.430000000000007 110.974 -179.938 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . 0.496 ' HG3' ' N ' ' A' ' 14' ' ' ILE . 4.8 pt-20 -62.24 -42.09 99.01 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.084 -0.507 . . . . 72.329999999999998 110.898 179.957 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . 0.496 ' N ' ' HG3' ' A' ' 13' ' ' GLU . 3.9 mp -68.52 -42.75 83.88 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-N 116.147 -0.478 . . . . 75.109999999999999 111.142 179.989 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . 0.585 ' OE1' ' CE1' ' A' ' 74' ' ' TYR . 10.8 mm-40 -66.06 -45.9 79.71 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.184 -0.462 . . . . 35.509999999999998 110.906 179.931 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 43.2 t -59.56 -41.53 90.33 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.185 -0.461 . . . . 45.340000000000003 110.882 -179.929 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -59.71 -33.65 71.89 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.208 -0.451 . . . . 73.129999999999995 110.918 -179.925 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 7.6 mt-10 -62.67 -38.09 89.0 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.162 -0.472 . . . . 74.319999999999993 110.906 -179.997 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.464 ' CD2' HG13 ' A' ' 46' ' ' ILE . 9.9 mp -66.65 -51.64 53.86 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.122 -0.49 . . . . 53.32 110.887 -179.955 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 3.0 pt-20 -68.74 -32.7 72.67 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.18 -0.464 . . . . 72.329999999999998 110.881 179.94 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -66.66 -48.33 69.72 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.186 -0.461 . . . . 53.520000000000003 111.113 179.923 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . 0.638 HD11 ' HB2' ' A' ' 115' ' ' PHE . 0.9 OUTLIER -75.85 -34.68 28.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.22 -0.446 . . . . 74.409999999999997 111.116 179.984 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -55.55 -34.44 64.74 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.169 -0.469 . . . . 65.030000000000001 110.833 -179.993 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -64.96 -35.73 82.12 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.254 -0.43 . . . . 61.399999999999999 110.861 -179.816 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . 0.663 HG21 ' HE1' ' A' ' 115' ' ' PHE . 3.1 mt -82.86 -41.23 17.16 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.125 -0.489 . . . . 63.109999999999999 111.139 179.967 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 23.0 m-85 -109.9 45.36 1.1 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.158 -0.474 . . . . 65.340000000000003 110.899 -179.97 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 1.8 mtm -43.55 -53.64 5.45 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.144 -0.48 . . . . 54.32 110.891 179.884 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -94.85 -20.86 19.08 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.18 -0.464 . . . . 71.219999999999999 110.836 -179.985 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -88.32 19.76 3.62 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.166 -0.47 . . . . 72.040000000000006 110.887 -179.984 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' PHE . . . . . 0.66 ' HA ' HD13 ' A' ' 50' ' ' ILE . 1.9 t80 -105.97 145.96 30.66 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.23 -0.441 . . . . 74.530000000000001 110.887 -179.887 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 40.1 m -125.71 133.41 52.13 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.121 -0.491 . . . . 52.549999999999997 111.077 -179.849 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 1.1 t0 -97.94 115.5 28.27 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.188 -0.46 . . . . 73.540000000000006 110.891 179.882 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 1.107 HD23 ' N ' ' A' ' 34' ' ' THR . 0.1 OUTLIER -118.91 -21.21 7.85 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.2 -0.454 . . . . 71.109999999999999 110.908 -179.92 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . 1.107 ' N ' HD23 ' A' ' 33' ' ' LEU . 2.1 m -33.91 108.81 0.06 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.183 -0.462 . . . . 53.43 111.158 179.922 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -39.46 94.74 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.244 -0.435 . . . . 73.129999999999995 110.891 179.923 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . 0.456 ' N ' ' O ' ' A' ' 34' ' ' THR . 83.1 mtt180 -128.8 -77.22 0.56 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.199 -0.455 . . . . 73.329999999999998 110.85 179.996 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . 0.419 ' O ' ' C ' ' A' ' 38' ' ' SER . 0.4 OUTLIER -107.5 151.88 24.98 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.25 -0.432 . . . . 70.319999999999993 110.913 179.948 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . 0.419 ' C ' ' O ' ' A' ' 37' ' ' LYS . 0.6 OUTLIER 36.74 84.54 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.214 -0.448 . . . . 71.120000000000005 110.848 -179.852 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 49.5 m -147.42 -174.11 4.44 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.125 -0.489 . . . . 71.319999999999993 110.878 -179.842 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' TRP . . . . . . . . . . . . . 54.9 t-105 -108.78 -37.49 5.87 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.124 -0.489 . . . . 74.430000000000007 110.926 179.992 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 41.0 m-20 -124.35 156.92 36.21 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.2 -0.454 . . . . 75.230000000000004 110.892 179.943 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -125.54 73.09 1.3 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.211 -0.45 . . . . 71.239999999999995 110.913 179.984 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -152.51 58.21 2.42 Favored Pre-proline 0 C--N 1.329 -0.321 0 CA-C-O 121.589 0.709 . . . . 75.129999999999995 110.91 179.974 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.75 -166.9 0.2 Allowed 'Trans proline' 0 C--N 1.342 0.196 0 C-N-CA 122.674 2.249 . . . . 63.32 112.383 179.999 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' GLN . . . . . 0.961 ' HG2' HG23 ' A' ' 47' ' ' ILE . 0.1 OUTLIER -179.87 33.52 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.262 -0.426 . . . . 74.209999999999994 110.959 -179.963 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . 0.649 HG22 ' O ' ' A' ' 45' ' ' GLN . 0.1 OUTLIER 86.75 -12.55 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.199 -0.455 . . . . 75.450000000000003 111.136 179.964 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . 0.961 HG23 ' HG2' ' A' ' 45' ' ' GLN . 0.1 OUTLIER -52.41 149.18 1.36 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.157 -0.474 . . . . 72.099999999999994 111.143 179.836 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 48' ' ' PHE . . . . . 0.925 ' HA ' HD22 ' A' ' 33' ' ' LEU . 30.2 p90 -161.88 162.8 29.41 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.197 -0.456 . . . . 75.519999999999996 110.909 179.945 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . 0.768 ' CG ' HD13 ' A' ' 33' ' ' LEU . 5.8 mt-10 -111.91 159.74 18.09 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.146 -0.479 . . . . 74.319999999999993 110.908 -179.911 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . 0.66 HD13 ' HA ' ' A' ' 30' ' ' PHE . 13.1 mm -135.25 142.7 39.1 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 116.191 -0.459 . . . . 74.129999999999995 111.143 179.961 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 83.9 m -84.88 129.58 34.79 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.185 -0.461 . . . . 63.43 111.116 179.984 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . 0.464 HD23 ' HA ' ' A' ' 52' ' ' LEU . 12.0 mt -135.74 155.58 50.15 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.18 -0.464 . . . . 71.299999999999997 110.916 179.948 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -175.15 165.56 3.4 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.213 -0.449 . . . . 73.310000000000002 110.853 179.93 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -54.93 170.65 0.17 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.191 -0.459 . . . . 71.439999999999998 110.847 -179.785 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 18.7 m -84.43 -22.65 7.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.133 -0.485 . . . . 74.409999999999997 111.105 179.978 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -115.9 -176.99 3.05 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.151 -0.477 . . . . 75.239999999999995 110.846 179.995 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 6.1 mmmm -115.63 -7.28 12.17 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.192 -0.458 . . . . 72.430000000000007 110.927 179.955 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . 0.551 ' HA ' ' C ' ' A' ' 59' ' ' PRO . 44.6 mt-10 -129.01 148.17 67.89 Favored Pre-proline 0 C--N 1.33 -0.269 0 CA-C-O 121.652 0.739 . . . . 74.519999999999996 110.867 179.986 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 59' ' ' PRO . . . . . 0.551 ' C ' ' HA ' ' A' ' 58' ' ' GLU . 54.0 Cg_endo -69.73 -3.51 7.7 Favored 'Cis proline' 0 C--N 1.342 0.185 0 C-N-CA 122.686 -1.798 . . . . 63.439999999999998 112.369 -0.035 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 60' ' ' VAL . . . . . 0.501 HG22 ' CG ' ' A' ' 129' ' ' GLN . 18.6 m -148.44 179.06 0.74 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.235 -0.439 . . . . 70.319999999999993 111.132 179.94 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . 0.437 ' O ' ' C ' ' A' ' 62' ' ' SER . 8.7 tt0 -107.28 -17.17 14.21 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.137 -0.483 . . . . 61.539999999999999 110.886 -179.988 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . 0.592 ' CB ' HD21 ' A' ' 125' ' ' LEU . 1.0 OUTLIER 34.15 91.0 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.137 -0.483 . . . . 34.329999999999998 110.829 -179.807 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 35.1 t -112.71 122.98 49.26 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.127 -0.488 . . . . 45.130000000000003 110.86 -179.856 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 64' ' ' ILE . . . . . 0.799 HD13 HD21 ' A' ' 94' ' ' LEU . 17.8 mt -136.53 138.63 46.36 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.121 -0.49 . . . . 63.439999999999998 111.141 179.959 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 90.5 m -104.38 113.89 27.75 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.2 -0.455 . . . . 75.150000000000006 111.112 179.974 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . 0.98 HD11 HG21 ' A' ' 121' ' ' THR . 7.1 mt -93.06 113.26 25.48 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.197 -0.456 . . . . 71.140000000000001 110.883 179.972 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 67' ' ' HIS . . . . . 0.624 ' CE1' HD11 ' A' ' 33' ' ' LEU . 12.6 t60 -105.13 112.56 25.73 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.179 -0.464 . . . . 72.109999999999999 110.859 179.872 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 68' ' ' PHE . . . . . 0.598 ' CZ ' HG23 ' A' ' 114' ' ' ILE . 0.0 OUTLIER -103.65 139.88 38.33 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.183 -0.462 . . . . 54.109999999999999 110.889 -179.927 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . 0.457 ' HA ' HG22 ' A' ' 47' ' ' ILE . . . -114.47 115.67 27.62 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.14 -0.482 . . . . 65.129999999999995 111.081 179.949 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 70' ' ' MET . . . . . 0.48 ' HE2' HD11 ' A' ' 114' ' ' ILE . 5.9 mmt -79.11 102.25 8.34 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.229 -0.441 . . . . 62.350000000000001 110.84 179.99 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -60.84 153.95 61.49 Favored Pre-proline 0 C--N 1.33 -0.255 0 CA-C-O 121.632 0.729 . . . . 74.319999999999993 111.123 -179.956 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_endo -69.73 0.47 5.57 Favored 'Trans proline' 0 C--N 1.341 0.18 0 C-N-CA 122.643 2.229 . . . . 64.150000000000006 112.342 179.906 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 73' ' ' MET . . . . . 0.657 ' HB3' HG23 ' A' ' 77' ' ' THR . 0.0 OUTLIER -114.38 -26.92 7.77 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.236 -0.438 . . . . 55.140000000000001 110.932 179.858 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 74' ' ' TYR . . . . . 0.639 ' CD1' ' C ' ' A' ' 74' ' ' TYR . 0.0 OUTLIER -47.3 149.38 1.86 Allowed Pre-proline 0 C--N 1.328 -0.349 0 CA-C-O 121.673 0.749 . . . . 74.340000000000003 110.881 -179.853 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 75' ' ' PRO . . . . . 0.551 ' C ' ' HA ' ' A' ' 74' ' ' TYR . 53.2 Cg_endo -69.78 -13.12 12.39 Favored 'Cis proline' 0 C--N 1.341 0.175 0 C-N-CA 122.709 -1.788 . . . . 61.020000000000003 112.342 -0.031 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 76' ' ' TYR . . . . . 0.476 ' CB ' ' O ' ' A' ' 73' ' ' MET . 3.3 t80 -33.44 -52.4 0.38 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.211 -0.449 . . . . 75.409999999999997 110.934 -179.91 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 77' ' ' THR . . . . . 0.657 HG23 ' HB3' ' A' ' 73' ' ' MET . 43.1 p -106.37 -176.6 3.12 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.099 -0.5 . . . . 52.43 111.189 179.99 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -105.88 130.39 23.09 Favored Pre-proline 0 C--N 1.328 -0.338 0 CA-C-O 121.597 0.713 . . . . 53.530000000000001 111.113 179.865 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 79' ' ' PRO . . . . . 0.842 ' HG3' HD11 ' A' ' 113' ' ' ILE . 53.6 Cg_endo -69.79 -170.88 0.42 Allowed 'Trans proline' 0 C--N 1.342 0.228 0 C-N-CA 122.66 2.24 . . . . 72.319999999999993 112.344 -179.949 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . 0.468 ' HG3' ' N ' ' A' ' 81' ' ' ILE . 0.4 OUTLIER -123.88 142.12 51.41 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.246 -0.434 . . . . 71.409999999999997 110.922 -179.957 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 81' ' ' ILE . . . . . 0.736 ' CG2' HD22 ' A' ' 66' ' ' LEU . 2.3 mm -131.37 143.25 41.15 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.176 -0.465 . . . . 74.109999999999999 111.147 179.972 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . 0.481 ' HG3' ' CD ' ' A' ' 84' ' ' LYS . 4.3 pt-20 -148.58 142.07 25.35 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.182 -0.463 . . . . 74.239999999999995 110.856 179.973 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 83' ' ' PHE . . . . . 0.792 ' CG ' HD22 ' A' ' 94' ' ' LEU . 36.4 m-85 -95.19 141.37 28.88 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.13 -0.487 . . . . 72.109999999999999 110.902 -179.972 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 84' ' ' LYS . . . . . 0.484 ' O ' ' N ' ' A' ' 86' ' ' VAL . 7.7 mmmt -124.17 170.26 10.9 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.116 -0.493 . . . . 73.450000000000003 110.896 179.967 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . 0.547 HD22 ' N ' ' A' ' 85' ' ' ASN . 1.1 m-80 60.55 -75.68 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.209 -0.451 . . . . 73.319999999999993 110.904 179.954 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 86' ' ' VAL . . . . . 1.125 HG11 HD11 ' A' ' 94' ' ' LEU . 2.5 m 40.3 93.42 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-N 116.21 -0.45 . . . . 64.239999999999995 111.146 179.91 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -93.72 -93.61 0.17 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.1 -0.5 . . . . 63.030000000000001 110.923 -179.992 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 88' ' ' ASN . . . . . 0.424 ' CG ' HG21 ' A' ' 60' ' ' VAL . 1.3 t30 -44.44 -48.45 9.96 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.197 -0.456 . . . . 75.030000000000001 110.907 -179.931 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 89' ' ' VAL . . . . . 0.675 HG11 HD11 ' A' ' 64' ' ' ILE . 2.0 p -60.1 141.11 17.16 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.171 -0.468 . . . . 72.239999999999995 111.119 179.908 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 90' ' ' MET . . . . . . . . . . . . . 5.5 mtm -92.55 -63.98 1.16 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.182 -0.463 . . . . 72.319999999999993 110.883 179.911 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 1.4 t0 173.88 -27.44 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.231 -0.441 . . . . 74.540000000000006 110.907 -179.997 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -54.38 -47.05 73.12 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.194 -0.457 . . . . 70.219999999999999 110.859 -179.745 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 93' ' ' GLN . . . . . 0.435 ' HB2' ' CD2' ' A' ' 128' ' ' PHE . 0.8 OUTLIER -71.08 -36.94 72.44 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.14 -0.482 . . . . 75.239999999999995 110.934 179.999 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . 1.125 HD11 HG11 ' A' ' 86' ' ' VAL . 21.9 mt -57.95 -44.21 86.87 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.198 -0.456 . . . . 72.310000000000002 110.922 -179.983 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 2.9 mm-40 -63.76 -35.26 80.0 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.203 -0.453 . . . . 72.510000000000005 110.873 179.954 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 96' ' ' MET . . . . . . . . . . . . . 23.1 ttp -59.99 -44.35 94.58 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.226 -0.443 . . . . 75.129999999999995 110.918 179.935 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 97' ' ' LEU . . . . . 0.525 HD22 ' HA ' ' A' ' 121' ' ' THR . 34.5 mt -57.79 -41.95 83.13 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.246 -0.434 . . . . 54.340000000000003 110.903 179.987 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 98' ' ' LYS . . . . . 0.436 ' HD3' ' CE2' ' A' ' 83' ' ' PHE . 12.9 mmtm -54.64 -37.09 65.26 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.151 -0.477 . . . . 62.439999999999998 110.927 179.819 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -68.81 -41.97 77.92 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.249 -0.432 . . . . 73.209999999999994 110.877 -179.894 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -69.17 -26.01 64.64 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.105 -0.498 . . . . 62.409999999999997 110.869 -179.98 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 101' ' ' PHE . . . . . 0.796 ' CD2' HD11 ' A' ' 117' ' ' ILE . 10.6 m-30 -59.7 -33.12 71.19 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.161 -0.472 . . . . 72.230000000000004 110.895 -179.92 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -63.99 -44.13 93.62 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.155 -0.475 . . . . 73.329999999999998 110.899 179.948 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.86 -36.17 77.79 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.238 -0.437 . . . . 73.010000000000005 110.934 179.846 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 104' ' ' ILE . . . . . 0.429 ' O ' HG22 ' A' ' 107' ' ' THR . 5.2 mt -63.22 -47.65 91.25 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.216 -0.447 . . . . 64.420000000000002 111.128 179.865 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 105' ' ' HIS . . . . . . . . . . . . . 5.9 t60 -62.96 -41.8 99.64 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.209 -0.45 . . . . 75.430000000000007 110.872 179.86 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -58.91 -43.6 91.1 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.231 -0.44 . . . . 72.310000000000002 110.896 -179.958 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 107' ' ' THR . . . . . 0.429 HG22 ' O ' ' A' ' 104' ' ' ILE . 10.2 t -76.75 -27.9 55.54 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.144 -0.48 . . . . 74.329999999999998 111.152 -179.973 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 60.2 m -114.37 37.44 3.37 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.188 -0.46 . . . . 71.439999999999998 110.883 -179.83 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 18.7 ttt180 -81.6 77.44 8.45 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.088 -0.506 . . . . 64.040000000000006 110.88 -179.949 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 154.1 -15.12 0.58 Allowed Glycine 0 N--CA 1.451 -0.334 0 C-N-CA 120.757 -0.735 . . . . 51.219999999999999 112.493 -179.97 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 111' ' ' GLN . . . . . . . . . . . . . 14.3 pt20 -130.0 -166.21 1.64 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.754 0.311 . . . . 74.409999999999997 110.901 -179.886 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 66.1 mt-10 -61.4 131.87 51.65 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.158 -0.474 . . . . 65.400000000000006 110.918 -179.921 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 113' ' ' ILE . . . . . 0.842 HD11 ' HG3' ' A' ' 79' ' ' PRO . 20.6 pt -121.25 -8.11 9.91 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-N 116.163 -0.472 . . . . 73.150000000000006 111.128 179.966 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 114' ' ' ILE . . . . . 0.603 ' O ' HG23 ' A' ' 118' ' ' THR . 27.7 mm -66.52 -44.77 90.05 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-N 116.153 -0.476 . . . . 75.439999999999998 111.175 179.867 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 115' ' ' PHE . . . . . 0.663 ' HE1' HG21 ' A' ' 25' ' ' ILE . 28.8 t80 -68.04 -33.47 74.64 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.195 -0.457 . . . . 73.239999999999995 110.856 179.894 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 -67.79 -47.02 70.32 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.195 -0.457 . . . . 42.520000000000003 110.937 -179.928 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 117' ' ' ILE . . . . . 0.796 HD11 ' CD2' ' A' ' 101' ' ' PHE . 0.4 OUTLIER -64.18 -39.4 85.35 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.103 -0.499 . . . . 74.230000000000004 111.151 179.946 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 118' ' ' THR . . . . . 0.603 HG23 ' O ' ' A' ' 114' ' ' ILE . 74.2 p -68.19 -43.38 78.23 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.158 -0.474 . . . . 73.200000000000003 111.144 179.956 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -63.0 -44.09 96.99 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.258 -0.428 . . . . 72.319999999999993 110.906 -179.88 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -68.29 -46.62 69.83 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.103 -0.498 . . . . 72.129999999999995 110.883 -179.964 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 121' ' ' THR . . . . . 0.98 HG21 HD11 ' A' ' 66' ' ' LEU . 14.7 p -62.97 -39.18 93.91 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.089 -0.505 . . . . 75.409999999999997 111.148 -179.905 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 49.0 tp60 -65.71 -45.14 83.87 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.218 -0.446 . . . . 64.140000000000001 110.958 179.999 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 6.4 pt-20 -74.0 -29.89 62.19 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.148 -0.478 . . . . 72.140000000000001 110.881 -179.952 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 124' ' ' LYS . . . . . 0.501 ' CE ' ' HA ' ' A' ' 124' ' ' LYS . 0.0 OUTLIER -75.51 -45.48 37.95 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.165 -0.47 . . . . 74.530000000000001 110.894 179.971 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 125' ' ' LEU . . . . . 0.98 HD13 ' N ' ' A' ' 126' ' ' ASP . 0.0 OUTLIER -69.5 -42.84 74.22 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.205 -0.452 . . . . 73.439999999999998 110.957 179.917 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 126' ' ' ASP . . . . . 0.98 ' N ' HD13 ' A' ' 125' ' ' LEU . 14.3 t0 -60.25 -45.69 92.39 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.181 -0.463 . . . . 73.019999999999996 110.893 179.804 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 127' ' ' GLU . . . . . 0.489 ' HG3' ' N ' ' A' ' 128' ' ' PHE . 0.3 OUTLIER -60.94 -27.86 68.53 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.227 -0.442 . . . . 72.530000000000001 110.87 -179.922 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 128' ' ' PHE . . . . . 0.6 ' CD1' HG23 ' A' ' 132' ' ' VAL . 0.1 OUTLIER -73.96 -50.34 20.42 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.194 -0.457 . . . . 55.100000000000001 110.922 -179.95 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 129' ' ' GLN . . . . . 0.501 ' CG ' HG22 ' A' ' 60' ' ' VAL . 1.5 tm0? -58.18 -14.61 7.38 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.181 -0.463 . . . . 71.340000000000003 110.941 -179.967 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 130' ' ' ASN . . . . . . . . . . . . . 13.0 t30 -58.29 -62.52 1.78 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.158 -0.474 . . . . 64.319999999999993 110.892 -179.973 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 131' ' ' VAL . . . . . 0.471 ' O ' ' O ' ' A' ' 132' ' ' VAL . 14.9 m -128.98 -27.35 0.99 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.144 -0.48 . . . . 72.140000000000001 111.13 179.902 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 132' ' ' VAL . . . . . 0.856 HG13 ' N ' ' A' ' 133' ' ' ASN . 0.4 OUTLIER 38.2 -162.34 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.19 -0.459 . . . . 75.299999999999997 111.107 179.86 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 133' ' ' ASN . . . . . 0.856 ' N ' HG13 ' A' ' 132' ' ' VAL . 0.6 OUTLIER -89.74 -58.02 2.66 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.159 -0.473 . . . . 71.230000000000004 110.868 179.992 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 134' ' ' THR . . . . . . . . . . . . . 58.8 m -133.8 141.56 47.51 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.198 -0.456 . . . . 73.540000000000006 111.122 -179.985 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -178.54 135.85 0.15 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.182 -0.463 . . . . 62.43 110.961 179.972 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 11.0 t -163.08 173.36 13.63 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.219 -0.446 . . . . 74.209999999999994 110.88 -179.781 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 137' ' ' LEU . . . . . . . . . . . . . 2.0 mp -107.48 142.81 36.77 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.156 -0.475 . . . . 64.349999999999994 110.928 -179.981 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.33 -0.271 0 CA-C-N 116.218 -0.446 . . . . 73.540000000000006 110.866 179.932 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.232 0.134 0 CA-C-O 120.735 0.302 . . . . 73.109999999999999 110.882 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 24.3 m -41.0 121.15 1.47 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.235 -0.438 . . . . 52.439999999999998 110.87 -179.797 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 3.7 pp -50.48 -18.0 0.58 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.108 -0.496 . . . . 42.140000000000001 110.917 179.995 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 87.4 p -73.27 152.55 40.95 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.199 -0.455 . . . . 64.540000000000006 110.882 -179.963 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' HIS . . . . . 0.422 ' O ' ' C ' ' A' ' 6' ' ' LEU . 1.6 m80 56.07 167.67 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.159 -0.473 . . . . 73.25 110.855 179.995 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . 0.422 ' C ' ' O ' ' A' ' 5' ' ' HIS . 0.3 OUTLIER 36.29 84.72 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.23 -0.441 . . . . 74.439999999999998 110.919 -179.983 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 11.3 t -87.44 158.84 18.88 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.228 -0.442 . . . . 71.120000000000005 111.161 179.953 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.636 HD13 ' O ' ' A' ' 72' ' ' PRO . 19.3 mt -61.54 -22.53 65.24 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.208 -0.451 . . . . 75.319999999999993 110.917 179.945 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . 0.42 ' OD1' ' N ' ' A' ' 9' ' ' ASP . 0.4 OUTLIER -55.63 -28.0 52.84 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.188 -0.46 . . . . 75.439999999999998 110.903 179.842 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 75.1 mm-40 -68.05 -36.79 80.45 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.227 -0.442 . . . . 45.399999999999999 110.895 -179.931 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 23.8 m-85 -63.94 -25.78 68.29 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.206 -0.452 . . . . 73.129999999999995 110.927 -179.879 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -59.4 -37.55 78.28 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.144 -0.48 . . . . 73.549999999999997 110.913 -179.916 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 2.2 mm-40 -60.23 -45.42 93.28 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.149 -0.478 . . . . 60.020000000000003 110.898 -179.985 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 3.7 mp -68.03 -41.06 84.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.098 -0.501 . . . . 70.219999999999999 111.166 179.954 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . 0.427 ' HG2' ' CB ' ' A' ' 70' ' ' MET . 0.8 OUTLIER -63.16 -47.87 80.84 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.207 -0.451 . . . . 72.409999999999997 110.961 179.895 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 3.8 t -58.83 -43.17 90.62 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.179 -0.464 . . . . 71.430000000000007 110.859 -179.938 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 1.1 t30 -57.79 -33.65 68.77 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.192 -0.458 . . . . 74.310000000000002 110.898 -179.854 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 4.9 mt-10 -66.1 -37.7 86.4 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.155 -0.475 . . . . 70.319999999999993 110.87 179.99 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.446 ' CD2' HG13 ' A' ' 46' ' ' ILE . 9.7 mp -64.99 -51.53 61.18 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.199 -0.455 . . . . 75.400000000000006 110.897 -179.939 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 1.5 pt-20 -68.58 -33.49 74.16 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.2 -0.455 . . . . 65.109999999999999 110.837 179.977 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -65.89 -49.63 67.37 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.214 -0.448 . . . . 74.120000000000005 111.116 179.967 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . 0.73 HD11 ' HB2' ' A' ' 115' ' ' PHE . 0.6 OUTLIER -74.9 -34.41 32.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.2 -0.455 . . . . 60.409999999999997 111.172 179.928 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 4.1 mtp180 -52.32 -36.61 53.74 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.126 -0.488 . . . . 74.019999999999996 110.88 179.957 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -63.5 -34.14 77.12 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.188 -0.46 . . . . 64.439999999999998 110.837 -179.777 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . 0.763 HD13 ' CE1' ' A' ' 115' ' ' PHE . 3.3 mt -82.73 -43.52 18.8 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.145 -0.48 . . . . 71.109999999999999 111.155 179.922 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 26.6 m-85 -108.82 46.62 0.96 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.156 -0.475 . . . . 75.040000000000006 110.929 -179.972 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 1.2 mtm -46.02 -58.35 3.66 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.099 -0.5 . . . . 73.129999999999995 110.846 179.948 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 20.2 m-20 -92.06 -5.65 52.47 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.259 -0.428 . . . . 74.109999999999999 110.881 179.952 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . 0.448 ' O ' HG23 ' A' ' 50' ' ' ILE . 1.7 m-20 -102.96 30.28 4.9 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.213 -0.449 . . . . 72.329999999999998 110.865 179.991 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' PHE . . . . . 0.556 ' CE2' ' HB2' ' A' ' 48' ' ' PHE . 8.8 t80 -117.72 144.09 45.6 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.216 -0.447 . . . . 65.400000000000006 110.901 -179.93 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 21.9 m -123.52 133.07 54.05 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.152 -0.477 . . . . 71.439999999999998 111.115 -179.905 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -94.36 114.23 26.25 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.197 -0.456 . . . . 73.129999999999995 110.879 179.907 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.8 HD21 HG12 ' A' ' 47' ' ' ILE . 1.7 pt? -113.52 -14.49 12.69 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.231 -0.44 . . . . 74.430000000000007 110.92 -179.947 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . 0.477 HG22 ' H ' ' A' ' 35' ' ' LYS . 0.2 OUTLIER -49.11 -179.35 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.148 -0.478 . . . . 42.439999999999998 111.147 179.966 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . 0.477 ' H ' HG22 ' A' ' 34' ' ' THR . 0.0 OUTLIER -78.08 10.56 2.83 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.221 -0.445 . . . . 64.349999999999994 110.871 179.932 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 3.8 mtp85 -46.3 -58.93 3.25 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.239 -0.437 . . . . 75.120000000000005 110.843 179.982 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -75.43 152.22 38.0 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.148 -0.478 . . . . 73.310000000000002 110.868 -179.984 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER 58.89 174.69 0.07 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.183 -0.462 . . . . 64.209999999999994 110.869 -179.892 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 14.4 m -138.95 143.75 38.72 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.135 -0.484 . . . . 74.109999999999999 110.88 -179.853 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' TRP . . . . . . . . . . . . . 13.2 t-105 173.9 -39.64 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.141 -0.481 . . . . 72.230000000000004 110.894 179.976 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 25.8 t70 -138.99 143.11 38.36 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.274 -0.421 . . . . 75.409999999999997 110.905 179.919 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 3.9 mttt -121.16 72.16 0.98 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.21 -0.45 . . . . 74.349999999999994 110.872 -179.953 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -152.46 66.39 6.36 Favored Pre-proline 0 C--N 1.328 -0.342 0 CA-C-O 121.59 0.709 . . . . 75.430000000000007 110.93 179.937 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' PRO . . . . . 0.404 ' HB3' ' CD ' ' A' ' 35' ' ' LYS . 54.1 Cg_endo -69.77 151.51 69.05 Favored 'Trans proline' 0 N--CA 1.465 -0.162 0 C-N-CA 122.688 2.259 . . . . 52.43 112.385 179.981 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' GLN . . . . . 0.573 ' O ' HG22 ' A' ' 46' ' ' ILE . 32.6 tt0 -112.23 -3.65 14.56 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.219 -0.446 . . . . 75.450000000000003 110.918 179.998 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . 0.638 HG23 ' O ' ' A' ' 46' ' ' ILE . 0.0 OUTLIER 84.63 5.65 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.247 -0.433 . . . . 65.030000000000001 111.125 179.951 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . 0.8 HG12 HD21 ' A' ' 33' ' ' LEU . 0.2 OUTLIER -63.54 141.57 17.97 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.159 -0.473 . . . . 64.450000000000003 111.15 179.82 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 48' ' ' PHE . . . . . 0.556 ' HB2' ' CE2' ' A' ' 30' ' ' PHE . 8.5 p90 -147.44 150.53 34.8 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.126 -0.488 . . . . 64.519999999999996 110.882 179.964 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . 0.537 ' CG ' HD13 ' A' ' 33' ' ' LEU . 11.5 mt-10 -108.46 157.15 18.7 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.15 -0.477 . . . . 71.430000000000007 110.866 -179.903 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . 0.538 HD13 ' HA ' ' A' ' 30' ' ' PHE . 26.0 mm -136.15 141.87 40.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.159 -0.473 . . . . 74.430000000000007 111.126 179.969 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 52.8 m -89.39 126.36 35.51 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.197 -0.456 . . . . 71.019999999999996 111.125 179.949 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . 0.661 HD12 HD12 ' A' ' 66' ' ' LEU . 23.7 mt -130.34 162.05 29.93 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.212 -0.449 . . . . 73.109999999999999 110.921 179.95 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -179.26 173.88 1.08 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.207 -0.452 . . . . 72.239999999999995 110.859 179.919 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -64.69 166.66 8.42 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.207 -0.451 . . . . 73.319999999999993 110.857 -179.78 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 16.4 m -77.73 -28.56 15.74 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.11 -0.495 . . . . 74.120000000000005 111.099 179.988 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 3.1 t0 -118.78 -168.16 1.5 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.191 -0.459 . . . . 71.510000000000005 110.88 179.878 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 1.3 mmmp? -118.04 -16.81 9.79 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.208 -0.451 . . . . 73.409999999999997 110.877 -179.953 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . 0.563 ' HA ' ' C ' ' A' ' 59' ' ' PRO . 43.0 mt-10 -118.27 143.05 32.26 Favored Pre-proline 0 C--N 1.329 -0.31 0 CA-C-O 121.597 0.713 . . . . 71.129999999999995 110.921 179.969 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 59' ' ' PRO . . . . . 0.563 ' C ' ' HA ' ' A' ' 58' ' ' GLU . 53.6 Cg_endo -69.83 -10.89 11.87 Favored 'Cis proline' 0 C--O 1.232 0.191 0 C-N-CA 122.701 -1.791 . . . . 60.25 112.324 0.095 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 60' ' ' VAL . . . . . 0.483 HG22 ' CG ' ' A' ' 129' ' ' GLN . 9.4 m -149.41 172.11 1.68 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.236 -0.438 . . . . 65.219999999999999 111.128 179.91 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . 0.447 ' O ' ' C ' ' A' ' 62' ' ' SER . 1.0 OUTLIER -109.23 -16.64 14.02 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.155 -0.475 . . . . 54.020000000000003 110.879 -179.929 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . 0.484 ' HB3' HD11 ' A' ' 125' ' ' LEU . 0.3 OUTLIER 34.2 88.54 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.137 -0.483 . . . . 61.240000000000002 110.888 -179.802 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 15.6 t -105.93 123.44 47.99 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.131 -0.486 . . . . 70.019999999999996 110.842 -179.799 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 64' ' ' ILE . . . . . 0.529 HD13 HD11 ' A' ' 94' ' ' LEU . 50.3 mt -141.01 137.88 34.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.124 -0.489 . . . . 73.510000000000005 111.172 179.937 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 62.5 m -97.68 114.75 26.78 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.173 -0.467 . . . . 71.430000000000007 111.206 179.918 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . 0.661 HD12 HD12 ' A' ' 52' ' ' LEU . 11.0 mt -91.46 111.85 23.52 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.221 -0.445 . . . . 44.310000000000002 110.96 179.951 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 1.1 t60 -107.72 112.29 24.9 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.209 -0.451 . . . . 73.319999999999993 110.839 179.899 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 68' ' ' PHE . . . . . 0.593 ' CZ ' HG23 ' A' ' 114' ' ' ILE . 0.0 OUTLIER -103.19 141.06 36.52 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.18 -0.464 . . . . 72.109999999999999 110.857 -179.91 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -122.43 128.72 51.26 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.161 -0.472 . . . . 74.329999999999998 111.101 179.893 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 70' ' ' MET . . . . . 0.427 ' CB ' ' HG2' ' A' ' 15' ' ' GLN . 0.1 OUTLIER -94.6 110.08 21.93 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.222 -0.445 . . . . 75.120000000000005 110.905 179.959 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -62.38 157.98 51.37 Favored Pre-proline 0 C--N 1.33 -0.257 0 CA-C-O 121.61 0.719 . . . . 62.329999999999998 111.157 -179.931 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 72' ' ' PRO . . . . . 0.636 ' O ' HD13 ' A' ' 8' ' ' LEU . 53.8 Cg_endo -69.78 2.52 3.47 Favored 'Trans proline' 0 C--N 1.342 0.2 0 C-N-CA 122.695 2.264 . . . . 71.030000000000001 112.318 179.989 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 73' ' ' MET . . . . . 0.507 ' O ' ' CB ' ' A' ' 76' ' ' TYR . 1.3 mtp -120.01 -25.39 5.8 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.23 -0.441 . . . . 52.229999999999997 110.854 179.952 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 74' ' ' TYR . . . . . 0.648 ' CD1' ' C ' ' A' ' 74' ' ' TYR . 0.1 OUTLIER -47.89 148.65 2.72 Favored Pre-proline 0 C--N 1.329 -0.325 0 CA-C-O 121.699 0.762 . . . . 62.420000000000002 110.885 -179.84 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 75' ' ' PRO . . . . . 0.553 ' C ' ' HA ' ' A' ' 74' ' ' TYR . 53.7 Cg_endo -69.8 -14.41 12.56 Favored 'Cis proline' 0 C--N 1.342 0.207 0 C-N-CA 122.631 -1.82 . . . . 75.319999999999993 112.348 -0.051 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 76' ' ' TYR . . . . . 0.507 ' CB ' ' O ' ' A' ' 73' ' ' MET . 10.3 t80 -33.36 -45.14 0.15 Allowed 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.215 -0.448 . . . . 75.409999999999997 110.928 -179.926 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 77' ' ' THR . . . . . 0.482 HG23 ' CB ' ' A' ' 73' ' ' MET . 59.7 p -110.82 178.12 4.46 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.077 -0.51 . . . . 73.019999999999996 111.147 -179.957 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -94.81 133.22 26.9 Favored Pre-proline 0 C--N 1.329 -0.301 0 CA-C-O 121.571 0.7 . . . . 54.200000000000003 111.091 179.856 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 79' ' ' PRO . . . . . 0.488 ' HG3' ' CD1' ' A' ' 113' ' ' ILE . 53.9 Cg_endo -69.74 -163.74 0.11 Allowed 'Trans proline' 0 C--N 1.341 0.138 0 C-N-CA 122.687 2.258 . . . . 54.439999999999998 112.32 -179.985 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . 0.4 ' O ' HG13 ' A' ' 81' ' ' ILE . 3.3 tt0 -148.52 136.61 21.0 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.192 -0.458 . . . . 24.329999999999998 110.884 -179.996 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 81' ' ' ILE . . . . . 0.533 HD13 HD13 ' A' ' 117' ' ' ILE . 12.4 mt -143.51 150.53 17.3 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.147 -0.479 . . . . 63.130000000000003 111.101 179.995 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . 0.494 ' HG3' ' CD ' ' A' ' 84' ' ' LYS . 10.1 pt-20 -147.69 148.25 30.83 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.156 -0.474 . . . . 72.409999999999997 110.871 179.956 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 83' ' ' PHE . . . . . 0.508 ' CZ ' ' HD3' ' A' ' 98' ' ' LYS . 8.0 m-85 -88.28 140.84 29.06 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.149 -0.478 . . . . 75.019999999999996 110.871 -179.92 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 84' ' ' LYS . . . . . 0.494 ' CD ' ' HG3' ' A' ' 82' ' ' GLU . 7.8 mmmt -125.68 174.57 8.2 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.179 -0.464 . . . . 72.329999999999998 110.91 179.927 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . 0.449 HD22 ' N ' ' A' ' 85' ' ' ASN . 1.7 m-80 61.99 -74.32 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.214 -0.448 . . . . 64.409999999999997 110.882 179.938 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 86' ' ' VAL . . . . . 0.867 HG11 HD21 ' A' ' 94' ' ' LEU . 3.5 m 41.42 90.53 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.227 -0.442 . . . . 63.030000000000001 111.132 179.924 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -102.89 -67.8 0.86 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.141 -0.481 . . . . 73.209999999999994 110.962 -179.992 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 88' ' ' ASN . . . . . 0.445 ' CG ' ' HB ' ' A' ' 60' ' ' VAL . 13.3 m120 -88.24 55.46 3.44 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.212 -0.449 . . . . 74.129999999999995 110.857 -179.958 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 89' ' ' VAL . . . . . 0.723 HG21 HD13 ' A' ' 94' ' ' LEU . 1.6 p -156.21 138.48 6.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.171 -0.468 . . . . 73.340000000000003 111.102 179.891 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 90' ' ' MET . . . . . . . . . . . . . 11.2 mtm -83.95 -71.17 0.52 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.146 -0.479 . . . . 73.019999999999996 110.863 179.949 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 1.1 p30 176.9 -28.67 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.2 -0.454 . . . . 52.340000000000003 110.874 179.923 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -53.85 -44.11 70.07 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.228 -0.442 . . . . 74.140000000000001 110.824 -179.791 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 93' ' ' GLN . . . . . 0.527 ' HG3' ' CE2' ' A' ' 128' ' ' PHE . 0.1 OUTLIER -70.55 -38.55 74.17 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.129 -0.487 . . . . 73.140000000000001 110.892 -179.922 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . 0.867 HD21 HG11 ' A' ' 86' ' ' VAL . 0.1 OUTLIER -58.99 -49.2 78.78 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.192 -0.458 . . . . 73.400000000000006 110.891 -179.972 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 43.8 mt-30 -62.84 -34.69 77.86 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.203 -0.453 . . . . 65.25 110.938 179.911 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 96' ' ' MET . . . . . . . . . . . . . 24.2 ttp -61.12 -37.7 83.74 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.2 -0.454 . . . . 53.509999999999998 110.861 179.949 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 97' ' ' LEU . . . . . 0.945 HD22 HG22 ' A' ' 121' ' ' THR . 83.5 mt -65.33 -43.13 91.93 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.264 -0.425 . . . . 75.109999999999999 110.94 179.992 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 98' ' ' LYS . . . . . 0.508 ' HD3' ' CZ ' ' A' ' 83' ' ' PHE . 6.7 mmtp -58.67 -36.68 74.54 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.164 -0.471 . . . . 54.409999999999997 110.922 179.853 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -64.2 -44.93 90.46 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.187 -0.46 . . . . 75.230000000000004 110.817 -179.899 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 100' ' ' GLU . . . . . 0.511 ' HG2' ' CE1' ' A' ' 120' ' ' PHE . 2.5 mp0 -69.62 -25.39 63.92 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.137 -0.483 . . . . 71.540000000000006 110.868 -179.9 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 101' ' ' PHE . . . . . 0.793 ' CG ' HD11 ' A' ' 117' ' ' ILE . 11.9 m-30 -60.06 -34.98 74.16 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.185 -0.461 . . . . 74.340000000000003 110.896 -179.927 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 4.2 tppp? -70.79 -38.78 73.39 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.187 -0.461 . . . . 73.510000000000005 110.877 179.954 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 25.2 mtmm -70.39 -42.9 71.11 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.187 -0.461 . . . . 72.420000000000002 110.881 179.92 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 104' ' ' ILE . . . . . 0.491 HD12 ' O ' ' A' ' 100' ' ' GLU . 3.9 mt -62.19 -47.38 93.39 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.224 -0.444 . . . . 72.120000000000005 111.133 179.883 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 105' ' ' HIS . . . . . . . . . . . . . 7.7 t60 -62.65 -42.63 99.71 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.17 -0.468 . . . . 74.209999999999994 110.815 179.887 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 1.2 m-20 -59.4 -43.52 92.97 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.195 -0.457 . . . . 75.549999999999997 110.888 -179.875 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 107' ' ' THR . . . . . 0.41 HG22 ' O ' ' A' ' 104' ' ' ILE . 8.9 t -76.84 -27.64 55.18 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.192 -0.458 . . . . 62.219999999999999 111.12 -179.995 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 108' ' ' SER . . . . . 0.502 ' HB3' HG22 ' A' ' 113' ' ' ILE . 0.4 OUTLIER -114.84 36.21 3.95 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.267 -0.424 . . . . 70.430000000000007 110.813 -179.83 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -78.38 75.38 4.9 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.185 -0.461 . . . . 73.239999999999995 110.877 -179.972 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 162.06 -27.34 0.26 Allowed Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.765 -0.731 . . . . 73.310000000000002 112.504 -179.986 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 111' ' ' GLN . . . . . . . . . . . . . 2.6 pt20 -120.06 -168.38 1.6 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.779 0.323 . . . . 73.209999999999994 110.94 -179.917 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 28.4 mt-10 -53.71 135.32 41.33 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.198 -0.456 . . . . 73.219999999999999 110.898 -179.961 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 113' ' ' ILE . . . . . 0.502 HG22 ' HB3' ' A' ' 108' ' ' SER . 1.2 pt -126.5 -25.74 1.48 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 116.125 -0.488 . . . . 74.049999999999997 111.11 179.981 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 114' ' ' ILE . . . . . 0.654 ' O ' HG23 ' A' ' 118' ' ' THR . 1.1 mp -57.07 -44.46 83.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.188 -0.46 . . . . 73.030000000000001 111.129 179.865 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 115' ' ' PHE . . . . . 0.763 ' CE1' HD13 ' A' ' 25' ' ' ILE . 39.8 t80 -64.35 -35.33 80.52 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.155 -0.475 . . . . 73.109999999999999 110.875 179.926 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 37.1 mm-40 -67.89 -44.87 76.0 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.13 -0.486 . . . . 75.519999999999996 110.903 -179.92 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 117' ' ' ILE . . . . . 0.793 HD11 ' CG ' ' A' ' 101' ' ' PHE . 0.3 OUTLIER -65.94 -40.83 88.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.153 -0.476 . . . . 61.119999999999997 111.114 179.987 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 118' ' ' THR . . . . . 0.654 HG23 ' O ' ' A' ' 114' ' ' ILE . 66.6 p -67.6 -43.86 79.46 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.177 -0.465 . . . . 73.530000000000001 111.175 179.911 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 45.2 t -68.32 -39.39 81.98 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.218 -0.446 . . . . 72.040000000000006 110.829 -179.814 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 120' ' ' PHE . . . . . 0.511 ' CE1' ' HG2' ' A' ' 100' ' ' GLU . 4.1 t80 -68.98 -48.13 63.9 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.115 -0.493 . . . . 63.109999999999999 110.904 -179.956 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 121' ' ' THR . . . . . 0.945 HG22 HD22 ' A' ' 97' ' ' LEU . 75.6 p -63.7 -39.98 95.66 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.129 -0.487 . . . . 74.129999999999995 111.108 -179.909 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 122' ' ' GLN . . . . . 0.456 ' NE2' ' O ' ' A' ' 122' ' ' GLN . 0.0 OUTLIER -64.63 -50.66 66.25 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.213 -0.449 . . . . 64.120000000000005 110.895 -179.981 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 123' ' ' GLU . . . . . 0.43 ' CG ' ' N ' ' A' ' 124' ' ' LYS . 5.7 pt-20 -65.87 -43.82 87.22 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.191 -0.459 . . . . 62.240000000000002 110.929 -179.97 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 124' ' ' LYS . . . . . 0.468 ' CE ' ' HA ' ' A' ' 124' ' ' LYS . 0.1 OUTLIER -68.77 -31.74 70.99 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.167 -0.47 . . . . 65.109999999999999 110.917 179.949 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 125' ' ' LEU . . . . . 0.846 ' O ' HD12 ' A' ' 125' ' ' LEU . 1.1 tp -71.47 -43.47 66.56 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.194 -0.457 . . . . 74.109999999999999 110.913 179.933 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 6.3 t0 -68.88 -46.6 68.0 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.168 -0.469 . . . . 75.439999999999998 110.881 179.843 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 127' ' ' GLU . . . . . 0.445 ' CG ' ' HA ' ' A' ' 124' ' ' LYS . 1.0 OUTLIER -60.26 -27.85 67.58 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.164 -0.471 . . . . 64.040000000000006 110.886 -179.901 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 128' ' ' PHE . . . . . 0.527 ' CE2' ' HG3' ' A' ' 93' ' ' GLN . 0.2 OUTLIER -78.99 -52.22 8.53 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.132 -0.485 . . . . 75.540000000000006 110.893 -179.909 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 129' ' ' GLN . . . . . 0.483 ' CG ' HG22 ' A' ' 60' ' ' VAL . 1.2 tm0? -54.69 -36.91 65.17 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.152 -0.476 . . . . 73.519999999999996 110.912 -179.946 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 130' ' ' ASN . . . . . . . . . . . . . 1.7 m-20 -79.82 -77.61 0.18 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.18 -0.464 . . . . 75.030000000000001 110.871 -179.958 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 2.7 p 179.4 -39.66 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.155 -0.475 . . . . 74.420000000000002 111.15 179.97 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 132' ' ' VAL . . . . . 0.505 HG13 ' O ' ' A' ' 132' ' ' VAL . 9.4 p -179.63 42.36 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.185 -0.461 . . . . 44.399999999999999 111.12 179.925 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 133' ' ' ASN . . . . . . . . . . . . . 1.7 m-20 -106.62 98.36 8.04 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.202 -0.454 . . . . 62.219999999999999 110.873 -179.978 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 134' ' ' THR . . . . . . . . . . . . . 32.4 p -98.62 96.68 8.11 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.171 -0.468 . . . . 54.240000000000002 111.178 179.966 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 24.4 pt20 -133.85 167.9 19.72 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.215 -0.448 . . . . 71.549999999999997 110.915 179.991 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 89.9 p -121.12 114.96 22.19 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.217 -0.447 . . . . 75.549999999999997 110.889 -179.856 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 137' ' ' LEU . . . . . . . . . . . . . 2.1 mm? -98.16 173.29 7.09 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.146 -0.479 . . . . 73.230000000000004 110.876 -179.939 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 6.4 mm-40 . . . . . 0 C--N 1.33 -0.277 0 CA-C-N 116.193 -0.458 . . . . 74.209999999999994 110.891 179.947 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.23 0.073 0 CA-C-O 120.815 0.34 . . . . 71.519999999999996 110.838 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -103.43 155.01 18.82 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.214 -0.448 . . . . 52.119999999999997 110.876 -179.83 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -131.17 -62.05 0.9 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.132 -0.486 . . . . 61.310000000000002 110.925 179.962 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER 175.07 89.11 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.181 -0.463 . . . . 54.450000000000003 110.893 -179.968 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 3.0 m170 56.07 164.32 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.182 -0.463 . . . . 72.150000000000006 110.843 -179.966 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER 41.91 86.27 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.179 -0.464 . . . . 50.149999999999999 110.889 -179.936 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . 0.445 ' OG1' ' N ' ' A' ' 8' ' ' LEU . 0.0 OUTLIER -178.72 171.63 1.46 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.2 -0.454 . . . . 73.230000000000004 111.137 179.964 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.623 HD13 ' O ' ' A' ' 72' ' ' PRO . 18.3 mt -52.94 -27.45 18.94 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.219 -0.446 . . . . 73.219999999999999 110.905 179.972 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 9.8 t70 -53.59 -28.47 32.43 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.157 -0.474 . . . . 42.439999999999998 110.891 179.823 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . 0.432 ' O ' ' HG2' ' A' ' 13' ' ' GLU . 6.1 mm-40 -68.13 -38.65 82.43 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.208 -0.451 . . . . 71.510000000000005 110.93 -179.944 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 25.9 m-85 -70.37 -21.85 62.83 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.189 -0.46 . . . . 71.439999999999998 110.893 -179.867 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -57.23 -41.17 79.01 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.133 -0.485 . . . . 75.430000000000007 110.939 -179.952 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . 0.493 ' HG2' HD12 ' A' ' 14' ' ' ILE . 4.1 pt-20 -66.32 -40.23 89.8 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.12 -0.491 . . . . 73.129999999999995 110.908 179.995 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . 0.493 HD12 ' HG2' ' A' ' 13' ' ' GLU . 3.4 mp -67.76 -39.86 82.76 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-N 116.12 -0.491 . . . . 73.420000000000002 111.136 179.961 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 93.5 mt-30 -64.09 -48.37 76.41 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.206 -0.452 . . . . 73.409999999999997 110.915 179.933 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -63.9 -36.86 85.33 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.144 -0.48 . . . . 62.329999999999998 110.862 -179.918 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -58.05 -33.92 69.53 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.159 -0.473 . . . . 75.310000000000002 110.906 -179.872 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 1.2 mp0 -66.04 -38.17 87.73 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.182 -0.463 . . . . 74.129999999999995 110.891 179.996 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.405 ' CD1' ' CE1' ' A' ' 48' ' ' PHE . 8.7 mp -65.6 -51.28 60.9 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.117 -0.492 . . . . 71.340000000000003 110.923 -179.954 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -68.64 -35.55 77.42 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.201 -0.454 . . . . 73.129999999999995 110.879 179.944 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -66.57 -50.53 62.79 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.182 -0.463 . . . . 51.420000000000002 111.127 179.884 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . 0.771 ' HA ' HD12 ' A' ' 25' ' ' ILE . 0.7 OUTLIER -73.84 -34.19 39.46 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.239 -0.437 . . . . 62.409999999999997 111.117 179.971 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 34.4 mtp180 -52.25 -35.58 50.16 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.178 -0.464 . . . . 74.0 110.865 179.973 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -67.18 -35.05 78.83 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.173 -0.467 . . . . 73.349999999999994 110.863 -179.78 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . 0.811 HD13 ' CE1' ' A' ' 115' ' ' PHE . 3.9 mt -78.11 -45.23 27.33 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.129 -0.487 . . . . 72.109999999999999 111.165 179.933 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 30.2 m-85 -109.9 43.32 1.36 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.148 -0.478 . . . . 73.230000000000004 110.924 -179.915 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 1.8 mtm -40.72 -55.63 2.35 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.094 -0.503 . . . . 75.439999999999998 110.877 179.926 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -86.85 -25.76 24.35 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.249 -0.432 . . . . 72.230000000000004 110.812 -179.979 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -92.77 31.21 1.42 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.183 -0.462 . . . . 73.510000000000005 110.882 179.989 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' PHE . . . . . 0.615 ' HA ' HD13 ' A' ' 50' ' ' ILE . 10.1 t80 -115.59 130.55 56.91 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.155 -0.475 . . . . 71.319999999999993 110.882 -179.913 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 53.8 m -117.46 126.39 52.54 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.131 -0.486 . . . . 61.219999999999999 111.133 -179.916 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 4.6 t0 -101.04 114.81 29.09 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.201 -0.454 . . . . 63.229999999999997 110.868 179.913 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.854 HD21 ' CE1' ' A' ' 67' ' ' HIS . 0.2 OUTLIER -119.24 5.88 11.23 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.209 -0.451 . . . . 75.409999999999997 110.912 -179.943 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . 0.698 HG22 ' H ' ' A' ' 35' ' ' LYS . 2.1 m -63.88 174.73 1.36 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.18 -0.463 . . . . 61.420000000000002 111.14 179.934 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . 0.698 ' H ' HG22 ' A' ' 34' ' ' THR . 0.0 OUTLIER -75.08 57.22 0.82 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.188 -0.46 . . . . 70.5 110.894 179.867 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -102.07 142.41 33.38 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.27 -0.423 . . . . 72.049999999999997 110.915 179.932 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . 0.487 ' O ' ' CB ' ' A' ' 38' ' ' SER . 2.8 mmtt 47.39 36.28 4.8 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.181 -0.463 . . . . 75.319999999999993 110.922 179.995 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . 0.487 ' CB ' ' O ' ' A' ' 37' ' ' LYS . 0.5 OUTLIER 161.07 57.48 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.189 -0.459 . . . . 65.540000000000006 110.827 -179.911 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 4.3 m -82.42 156.56 24.08 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.16 -0.473 . . . . 63.439999999999998 110.877 -179.821 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' TRP . . . . . . . . . . . . . 8.6 t-105 -102.39 -23.96 13.9 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.139 -0.482 . . . . 71.129999999999995 110.924 -179.996 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . 0.591 ' O ' ' C ' ' A' ' 42' ' ' LYS . 33.9 t70 -164.8 54.92 0.13 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.227 -0.442 . . . . 74.329999999999998 110.899 179.952 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . 0.591 ' C ' ' O ' ' A' ' 41' ' ' ASP . 0.0 OUTLIER 21.11 69.0 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.211 -0.45 . . . . 62.219999999999999 110.896 -179.972 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 7.8 mt-30 -159.08 61.78 1.94 Allowed Pre-proline 0 C--N 1.33 -0.282 0 CA-C-O 121.568 0.699 . . . . 74.25 110.878 179.95 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' PRO . . . . . 0.45 ' HA ' ' CD ' ' A' ' 35' ' ' LYS . 53.6 Cg_endo -69.77 111.86 2.92 Favored 'Trans proline' 0 C--N 1.341 0.154 0 C-N-CA 122.686 2.257 . . . . 73.319999999999993 112.332 179.958 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' GLN . . . . . 0.703 ' HB3' HD12 ' A' ' 47' ' ' ILE . 12.8 tt0 -67.72 -3.15 8.38 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.224 -0.443 . . . . 74.549999999999997 110.911 -179.98 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . 0.464 ' O ' ' C ' ' A' ' 47' ' ' ILE . 0.0 OUTLIER 81.89 -29.76 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.175 -0.466 . . . . 75.239999999999995 111.149 179.966 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . 0.703 HD12 ' HB3' ' A' ' 45' ' ' GLN . 0.2 OUTLIER -31.33 147.05 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 116.158 -0.474 . . . . 75.319999999999993 111.147 179.815 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 48' ' ' PHE . . . . . 0.478 ' HA ' ' CD1' ' A' ' 33' ' ' LEU . 2.0 p90 -158.9 166.35 32.05 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.207 -0.451 . . . . 74.109999999999999 110.843 179.968 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . 0.766 ' CD ' HD23 ' A' ' 33' ' ' LEU . 6.3 mt-10 -108.87 161.08 15.47 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.125 -0.489 . . . . 74.230000000000004 110.856 -179.926 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . 0.615 HD13 ' HA ' ' A' ' 30' ' ' PHE . 8.6 mm -142.92 138.32 27.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-N 116.138 -0.483 . . . . 70.209999999999994 111.103 179.972 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 78.2 m -91.05 128.99 37.08 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.201 -0.454 . . . . 73.540000000000006 111.137 179.963 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . 0.87 HD12 HD22 ' A' ' 66' ' ' LEU . 16.9 mt -130.32 166.02 21.27 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.254 -0.43 . . . . 74.349999999999994 110.934 179.946 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 53' ' ' ARG . . . . . 0.436 ' CB ' ' O ' ' A' ' 62' ' ' SER . 5.4 ptt180 -177.48 171.18 1.98 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.2 -0.454 . . . . 72.439999999999998 110.876 179.963 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . 0.492 ' H ' ' HG ' ' A' ' 62' ' ' SER . 6.4 p -63.23 -175.8 0.12 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.196 -0.456 . . . . 73.0 110.829 -179.822 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 22.0 m -91.51 -22.96 5.96 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.118 -0.492 . . . . 71.040000000000006 111.13 179.936 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 3.2 t0 -118.55 -172.96 2.38 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.164 -0.471 . . . . 72.430000000000007 110.873 179.904 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -118.83 -4.05 10.72 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.166 -0.47 . . . . 73.540000000000006 110.886 -179.999 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . 0.54 ' HA ' ' C ' ' A' ' 59' ' ' PRO . 5.1 mm-40 -136.33 150.29 70.31 Favored Pre-proline 0 C--N 1.329 -0.287 0 CA-C-O 121.649 0.738 . . . . 73.219999999999999 110.911 179.937 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 59' ' ' PRO . . . . . 0.54 ' C ' ' HA ' ' A' ' 58' ' ' GLU . 54.1 Cg_endo -69.73 -1.85 6.81 Favored 'Cis proline' 0 C--N 1.341 0.162 0 C-N-CA 122.707 -1.789 . . . . 65.219999999999999 112.361 -0.038 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 60' ' ' VAL . . . . . 0.476 ' CG2' ' CG ' ' A' ' 129' ' ' GLN . 34.5 m -144.86 168.6 9.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.231 -0.44 . . . . 42.109999999999999 111.162 179.883 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . 0.41 ' O ' ' O ' ' A' ' 62' ' ' SER . 22.3 tt0 -100.03 -29.14 12.7 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.168 -0.469 . . . . 65.420000000000002 110.909 -179.966 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . 0.492 ' HG ' ' H ' ' A' ' 54' ' ' SER . 20.1 p 50.69 102.86 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.155 -0.475 . . . . 74.340000000000003 110.852 -179.81 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 63' ' ' SER . . . . . 0.468 ' N ' HE21 ' A' ' 87' ' ' GLN . 49.7 p -129.55 122.93 30.18 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.133 -0.485 . . . . 72.230000000000004 110.831 -179.8 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 64' ' ' ILE . . . . . 1.027 HD11 HG21 ' A' ' 89' ' ' VAL . 52.8 mt -143.93 132.03 18.34 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.163 -0.472 . . . . 70.510000000000005 111.179 179.9 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 91.7 m -92.93 119.33 32.11 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.228 -0.442 . . . . 74.540000000000006 111.168 179.954 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . 0.87 HD22 HD12 ' A' ' 52' ' ' LEU . 1.5 mp -97.39 109.82 22.5 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.188 -0.46 . . . . 62.520000000000003 110.917 179.989 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 67' ' ' HIS . . . . . 0.854 ' CE1' HD21 ' A' ' 33' ' ' LEU . 39.9 t60 -102.05 109.69 21.47 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.152 -0.476 . . . . 73.409999999999997 110.841 179.873 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 68' ' ' PHE . . . . . 0.513 ' CE2' ' HB3' ' A' ' 66' ' ' LEU . 0.0 OUTLIER -104.08 139.91 38.51 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.184 -0.462 . . . . 73.239999999999995 110.873 -179.919 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . 0.443 ' O ' ' CB ' ' A' ' 79' ' ' PRO . . . -121.23 120.6 35.65 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.168 -0.469 . . . . 65.230000000000004 111.116 179.912 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 1.7 mmt -85.34 89.95 7.8 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.241 -0.436 . . . . 61.509999999999998 110.875 179.998 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -41.26 160.33 0.15 Allowed Pre-proline 0 C--N 1.33 -0.277 0 CA-C-O 121.595 0.712 . . . . 53.240000000000002 111.13 -179.913 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 72' ' ' PRO . . . . . 0.623 ' O ' HD13 ' A' ' 8' ' ' LEU . 53.4 Cg_endo -69.78 2.97 3.06 Favored 'Trans proline' 0 C--N 1.341 0.162 0 C-N-CA 122.704 2.269 . . . . 71.510000000000005 112.34 179.953 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 73' ' ' MET . . . . . 0.501 ' O ' ' CB ' ' A' ' 76' ' ' TYR . 0.1 OUTLIER -121.44 -25.24 5.21 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.216 -0.447 . . . . 73.150000000000006 110.911 179.869 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 74' ' ' TYR . . . . . 0.632 ' CD1' ' C ' ' A' ' 74' ' ' TYR . 0.0 OUTLIER -46.95 149.86 1.47 Allowed Pre-proline 0 C--N 1.329 -0.315 0 CA-C-O 121.684 0.754 . . . . 70.049999999999997 110.945 -179.904 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 75' ' ' PRO . . . . . 0.551 ' C ' ' HA ' ' A' ' 74' ' ' TYR . 53.7 Cg_endo -69.75 -10.79 11.65 Favored 'Cis proline' 0 C--O 1.232 0.186 0 C-N-CA 122.673 -1.803 . . . . 61.450000000000003 112.338 -0.103 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 76' ' ' TYR . . . . . 0.501 ' CB ' ' O ' ' A' ' 73' ' ' MET . 20.9 t80 -33.81 -45.46 0.19 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.262 -0.427 . . . . 74.219999999999999 110.937 -179.924 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 77' ' ' THR . . . . . 0.404 HG23 ' CB ' ' A' ' 73' ' ' MET . 16.8 p -114.86 -175.03 2.6 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.118 -0.492 . . . . 74.209999999999994 111.152 179.998 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -99.94 132.96 22.01 Favored Pre-proline 0 C--N 1.329 -0.291 0 CA-C-O 121.566 0.698 . . . . 72.310000000000002 111.123 179.863 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 79' ' ' PRO . . . . . 0.735 ' HG3' HD11 ' A' ' 113' ' ' ILE . 54.0 Cg_endo -69.75 -164.21 0.12 Allowed 'Trans proline' 0 C--N 1.341 0.175 0 C-N-CA 122.71 2.273 . . . . 73.099999999999994 112.336 180.0 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 9.4 tt0 -131.73 129.2 40.33 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.171 -0.468 . . . . 63.350000000000001 110.857 -179.944 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 81' ' ' ILE . . . . . 0.42 HD13 ' HA ' ' A' ' 68' ' ' PHE . 5.1 mm -120.64 145.58 26.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.157 -0.474 . . . . 74.319999999999993 111.085 179.994 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . 0.504 ' HG3' ' CD ' ' A' ' 84' ' ' LYS . 4.2 pt-20 -149.01 136.44 20.24 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.162 -0.472 . . . . 64.319999999999993 110.898 179.944 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 83' ' ' PHE . . . . . 0.613 ' CB ' HD22 ' A' ' 94' ' ' LEU . 38.5 m-85 -93.08 138.63 31.36 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.156 -0.474 . . . . 75.319999999999993 110.836 -179.888 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 84' ' ' LYS . . . . . 0.504 ' CD ' ' HG3' ' A' ' 82' ' ' GLU . 9.7 mmmt -124.93 171.88 9.84 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.113 -0.494 . . . . 63.130000000000003 110.915 179.942 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . 0.414 ' C ' ' CG2' ' A' ' 86' ' ' VAL . 7.8 m-80 61.24 -74.47 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.2 -0.455 . . . . 63.219999999999999 110.923 179.978 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 86' ' ' VAL . . . . . 0.737 HG11 HD11 ' A' ' 94' ' ' LEU . 2.8 m 41.61 84.59 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.179 -0.464 . . . . 61.25 111.092 179.864 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 87' ' ' GLN . . . . . 0.468 HE21 ' N ' ' A' ' 63' ' ' SER . 0.4 OUTLIER -93.06 -79.66 0.4 Allowed 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.18 -0.464 . . . . 65.129999999999995 110.923 -179.984 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -54.41 -44.16 72.12 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.194 -0.457 . . . . 71.0 110.887 -179.988 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 89' ' ' VAL . . . . . 1.027 HG21 HD11 ' A' ' 64' ' ' ILE . 1.7 t -62.21 151.74 7.36 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.163 -0.472 . . . . 42.549999999999997 111.136 179.932 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 90' ' ' MET . . . . . . . . . . . . . 14.8 mtm -102.25 -70.35 0.75 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.192 -0.458 . . . . 70.510000000000005 110.864 179.897 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 91' ' ' ASP . . . . . 0.432 ' HA ' HD12 ' A' ' 94' ' ' LEU . 3.0 p-10 -172.26 -36.95 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.255 -0.429 . . . . 70.409999999999997 110.898 179.989 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -54.28 -41.51 68.95 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.179 -0.464 . . . . 64.129999999999995 110.843 -179.802 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 93' ' ' GLN . . . . . 0.478 ' CD ' ' CD2' ' A' ' 128' ' ' PHE . 0.8 OUTLIER -69.03 -42.03 76.91 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.16 -0.473 . . . . 75.019999999999996 110.95 -179.965 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . 0.737 HD11 HG11 ' A' ' 86' ' ' VAL . 50.8 mt -59.36 -49.03 79.38 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.137 -0.483 . . . . 65.530000000000001 110.931 -179.993 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 1.8 mm100 -65.98 -36.13 82.48 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.148 -0.478 . . . . 74.150000000000006 110.905 179.921 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 96' ' ' MET . . . . . 0.453 ' SD ' ' CE1' ' A' ' 128' ' ' PHE . 49.8 ttp -60.89 -38.58 86.15 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.168 -0.469 . . . . 71.409999999999997 110.851 179.99 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 97' ' ' LEU . . . . . 0.978 HD22 HG22 ' A' ' 121' ' ' THR . 98.4 mt -60.62 -46.8 88.92 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.238 -0.437 . . . . 71.420000000000002 110.959 -179.984 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 12.8 mmtm -55.8 -34.66 65.53 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.148 -0.478 . . . . 61.409999999999997 110.878 179.822 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 67.1 m -68.7 -45.74 70.82 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.25 -0.432 . . . . 42.32 110.861 -179.87 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 100' ' ' GLU . . . . . 0.47 ' O ' HD12 ' A' ' 104' ' ' ILE . 8.6 pt-20 -75.16 -23.47 57.77 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.106 -0.497 . . . . 72.150000000000006 110.885 -179.958 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 101' ' ' PHE . . . . . 0.651 ' CD2' HD11 ' A' ' 117' ' ' ILE . 8.0 m-30 -59.09 -34.37 71.92 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.175 -0.466 . . . . 63.119999999999997 110.877 -179.933 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.34 -42.83 98.97 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.114 -0.494 . . . . 63.109999999999999 110.929 179.989 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 21.0 mtmm -64.91 -37.81 88.89 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.2 -0.455 . . . . 65.540000000000006 110.916 179.818 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 104' ' ' ILE . . . . . 0.621 HD11 ' CD2' ' A' ' 120' ' ' PHE . 3.0 mt -65.01 -47.55 87.58 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 116.236 -0.438 . . . . 51.340000000000003 111.132 179.853 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 105' ' ' HIS . . . . . . . . . . . . . 4.3 t60 -62.97 -41.49 99.55 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.172 -0.467 . . . . 74.329999999999998 110.868 179.901 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -60.63 -43.3 97.67 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.188 -0.46 . . . . 64.439999999999998 110.887 -179.952 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 9.2 t -78.95 -28.74 43.73 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.194 -0.457 . . . . 72.519999999999996 111.172 179.986 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 12.5 m -114.77 40.4 2.61 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.239 -0.437 . . . . 63.450000000000003 110.845 -179.839 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 34.5 ttt180 -84.8 90.32 7.73 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.14 -0.482 . . . . 74.420000000000002 110.837 -179.927 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 110' ' ' GLY . . . . . 0.444 ' HA2' ' CB ' ' A' ' 75' ' ' PRO . . . 110.59 45.33 0.91 Allowed Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.725 -0.75 . . . . 62.32 112.49 -179.973 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 111' ' ' GLN . . . . . 0.422 ' O ' ' CB ' ' A' ' 112' ' ' GLU . 5.1 pt20 -174.33 28.52 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.745 0.307 . . . . 72.420000000000002 110.897 -179.918 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 112' ' ' GLU . . . . . 0.422 ' CB ' ' O ' ' A' ' 111' ' ' GLN . 0.2 OUTLIER 78.07 135.73 0.06 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.207 -0.451 . . . . 62.399999999999999 110.87 -179.989 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 113' ' ' ILE . . . . . 0.735 HD11 ' HG3' ' A' ' 79' ' ' PRO . 31.9 pt -133.46 -0.31 1.43 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.183 -0.462 . . . . 73.109999999999999 111.136 179.968 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 114' ' ' ILE . . . . . 0.831 ' O ' HG23 ' A' ' 118' ' ' THR . 25.6 mm -63.34 -45.43 98.15 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.2 -0.454 . . . . 60.340000000000003 111.132 179.876 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 115' ' ' PHE . . . . . 0.811 ' CE1' HD13 ' A' ' 25' ' ' ILE . 26.6 t80 -72.65 -34.63 67.4 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.188 -0.46 . . . . 75.409999999999997 110.874 179.93 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 4.3 mm-40 -67.8 -47.63 68.57 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.144 -0.48 . . . . 62.229999999999997 110.893 -179.928 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 117' ' ' ILE . . . . . 0.651 HD11 ' CD2' ' A' ' 101' ' ' PHE . 0.9 OUTLIER -63.47 -40.61 89.69 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.14 -0.482 . . . . 73.530000000000001 111.103 179.976 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 118' ' ' THR . . . . . 0.831 HG23 ' O ' ' A' ' 114' ' ' ILE . 64.5 p -68.07 -42.77 79.91 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.169 -0.469 . . . . 53.409999999999997 111.108 -179.955 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 67.6 m -67.89 -44.25 77.43 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.225 -0.443 . . . . 71.329999999999998 110.853 -179.843 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 120' ' ' PHE . . . . . 0.621 ' CD2' HD11 ' A' ' 104' ' ' ILE . 0.2 OUTLIER -60.74 -50.27 74.15 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.139 -0.482 . . . . 74.329999999999998 110.888 -179.959 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 121' ' ' THR . . . . . 0.978 HG22 HD22 ' A' ' 97' ' ' LEU . 81.4 p -65.54 -40.71 93.22 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.171 -0.468 . . . . 65.230000000000004 111.146 -179.95 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 8.4 tm0? -64.23 -38.85 92.52 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.191 -0.459 . . . . 71.329999999999998 110.911 -179.985 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 4.4 pt-20 -77.5 -40.48 42.69 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.216 -0.447 . . . . 72.150000000000006 110.916 -179.976 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 124' ' ' LYS . . . . . 0.472 ' CE ' ' HA ' ' A' ' 124' ' ' LYS . 0.0 OUTLIER -68.57 -41.06 80.27 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.128 -0.487 . . . . 74.120000000000005 110.815 -179.982 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 125' ' ' LEU . . . . . 0.57 HD23 ' O ' ' A' ' 125' ' ' LEU . 0.5 OUTLIER -68.39 -38.26 81.15 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.253 -0.43 . . . . 74.209999999999994 110.926 179.945 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 126' ' ' ASP . . . . . 0.433 ' C ' ' OD1' ' A' ' 126' ' ' ASP . 1.2 t0 -61.78 -45.59 93.22 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.202 -0.454 . . . . 54.329999999999998 110.886 179.817 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 127' ' ' GLU . . . . . 0.447 ' HG3' ' N ' ' A' ' 128' ' ' PHE . 7.4 pt-20 -69.68 -31.17 69.06 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.202 -0.454 . . . . 72.450000000000003 110.899 -179.892 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 128' ' ' PHE . . . . . 0.478 ' CD2' ' CD ' ' A' ' 93' ' ' GLN . 0.3 OUTLIER -69.14 -44.23 72.73 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.138 -0.483 . . . . 74.420000000000002 110.836 -179.886 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 129' ' ' GLN . . . . . 0.476 ' CG ' ' CG2' ' A' ' 60' ' ' VAL . 1.4 tm0? -58.32 -44.74 88.77 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.154 -0.475 . . . . 75.519999999999996 110.923 -179.921 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 130' ' ' ASN . . . . . 0.702 ' O ' HG13 ' A' ' 131' ' ' VAL . 1.8 m-20 -75.48 -80.24 0.09 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.197 -0.456 . . . . 64.319999999999993 110.906 -179.985 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 131' ' ' VAL . . . . . 0.702 HG13 ' O ' ' A' ' 130' ' ' ASN . 0.0 OUTLIER -177.05 -58.93 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.151 -0.477 . . . . 71.519999999999996 111.134 179.908 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 132' ' ' VAL . . . . . . . . . . . . . 72.9 t -143.92 146.57 20.73 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.181 -0.463 . . . . 70.040000000000006 111.124 179.938 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 133' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -179.73 90.13 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.166 -0.47 . . . . 60.25 110.914 -179.955 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 134' ' ' THR . . . . . . . . . . . . . 4.1 m -100.92 147.29 26.31 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.169 -0.468 . . . . 40.420000000000002 111.125 -179.957 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 8.5 tp60 -150.59 129.5 12.51 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.205 -0.452 . . . . 73.230000000000004 110.891 -179.984 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 80.4 p -148.96 90.9 1.8 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.201 -0.454 . . . . 73.239999999999995 110.83 -179.827 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 137' ' ' LEU . . . . . 0.454 HD22 ' HA ' ' A' ' 137' ' ' LEU . 0.2 OUTLIER -70.62 111.62 6.25 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.151 -0.477 . . . . 64.5 110.922 179.972 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.33 -0.275 0 CA-C-N 116.192 -0.458 . . . . 31.210000000000001 110.893 179.927 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 48.7 mtm . . . . . 0 C--O 1.231 0.087 0 CA-C-O 120.79 0.329 . . . . 72.219999999999999 110.895 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER 49.93 46.59 24.17 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.226 -0.443 . . . . 74.239999999999995 110.88 -179.793 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . 0.588 HD23 ' H ' ' A' ' 5' ' ' HIS . 0.2 OUTLIER -45.15 141.23 2.46 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.159 -0.473 . . . . 51.450000000000003 110.923 179.999 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -134.69 27.19 3.67 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.228 -0.442 . . . . 73.209999999999994 110.862 -179.926 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' HIS . . . . . 0.588 ' H ' HD23 ' A' ' 3' ' ' LEU . 0.0 OUTLIER 66.57 10.14 7.15 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.131 -0.486 . . . . 72.540000000000006 110.834 179.941 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -153.04 111.24 3.65 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.18 -0.464 . . . . 54.5 110.955 179.995 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 5.3 t -179.88 154.66 0.58 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.217 -0.447 . . . . 74.530000000000001 111.094 179.964 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 76.0 mt -55.09 -23.41 20.48 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.147 -0.478 . . . . 74.420000000000002 110.955 179.938 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -51.62 -34.64 38.43 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.169 -0.469 . . . . 70.310000000000002 110.828 179.883 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . 0.408 ' O ' HD12 ' A' ' 14' ' ' ILE . 16.1 mm-40 -67.95 -35.11 77.83 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.212 -0.449 . . . . 74.349999999999994 110.883 -179.863 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' TYR . . . . . 0.441 ' CD1' ' HD2' ' A' ' 75' ' ' PRO . 15.1 m-85 -65.77 -25.06 67.09 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.2 -0.455 . . . . 64.150000000000006 110.916 -179.852 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -64.59 -37.85 88.99 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.105 -0.498 . . . . 72.329999999999998 110.911 -179.884 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 2.5 mm-40 -61.56 -44.15 97.56 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.144 -0.48 . . . . 73.120000000000005 110.885 179.985 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . 0.545 ' H ' HD12 ' A' ' 14' ' ' ILE . 5.2 mp -68.03 -40.12 82.63 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.125 -0.489 . . . . 71.129999999999995 111.135 179.971 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . 0.419 ' HB3' HG21 ' A' ' 46' ' ' ILE . 59.1 mt-30 -65.22 -46.33 81.09 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.159 -0.473 . . . . 60.340000000000003 110.881 179.946 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 7.0 t -63.19 -36.56 84.05 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.254 -0.43 . . . . 73.439999999999998 110.881 -179.946 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . 0.432 ' OD1' ' N ' ' A' ' 18' ' ' GLU . 0.2 OUTLIER -58.36 -33.72 69.89 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.154 -0.476 . . . . 73.239999999999995 110.889 -179.907 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . 0.432 ' N ' ' OD1' ' A' ' 17' ' ' ASN . 1.3 mp0 -66.33 -37.78 86.15 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.18 -0.464 . . . . 61.109999999999999 110.886 -179.985 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.459 ' CD2' HG13 ' A' ' 46' ' ' ILE . 8.8 mp -64.44 -51.51 62.75 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.18 -0.464 . . . . 75.049999999999997 110.908 -179.976 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 1.4 pt-20 -68.5 -35.86 78.1 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.202 -0.454 . . . . 73.430000000000007 110.933 179.918 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -66.66 -47.1 73.59 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.124 -0.489 . . . . 74.540000000000006 111.068 179.944 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . 0.621 ' HA ' HD12 ' A' ' 25' ' ' ILE . 0.7 OUTLIER -76.21 -34.27 25.66 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-N 116.261 -0.427 . . . . 52.32 111.167 179.955 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -52.32 -34.18 45.84 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.144 -0.48 . . . . 73.120000000000005 110.87 179.973 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -66.37 -32.15 73.36 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.219 -0.446 . . . . 70.430000000000007 110.879 -179.823 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . 0.854 HD13 ' CE1' ' A' ' 115' ' ' PHE . 3.3 mt -84.77 -43.84 17.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.118 -0.492 . . . . 62.329999999999998 111.121 179.95 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 19.5 m-85 -107.5 45.36 1.0 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.176 -0.465 . . . . 73.450000000000003 110.903 -179.95 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 4.1 mtm -46.26 -47.82 18.07 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.132 -0.485 . . . . 73.540000000000006 110.869 179.887 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 7.1 m-20 -98.74 -27.2 14.07 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.219 -0.446 . . . . 64.450000000000003 110.859 179.952 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 84.6 m-20 -86.11 34.4 0.62 Allowed 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.214 -0.448 . . . . 73.420000000000002 110.862 -179.995 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' PHE . . . . . 0.612 ' C ' ' CD1' ' A' ' 30' ' ' PHE . 0.1 OUTLIER -117.46 144.12 45.35 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.176 -0.465 . . . . 71.310000000000002 110.923 -179.935 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 24.4 m -127.08 135.07 50.25 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.141 -0.481 . . . . 55.439999999999998 111.18 -179.926 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -97.82 114.81 26.94 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.227 -0.442 . . . . 70.140000000000001 110.83 179.948 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.941 HD23 ' N ' ' A' ' 34' ' ' THR . 0.1 OUTLIER -121.81 -9.65 8.8 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.216 -0.447 . . . . 74.430000000000007 110.95 -179.979 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . 0.941 ' N ' HD23 ' A' ' 33' ' ' LEU . 0.2 OUTLIER -33.92 127.29 0.41 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.174 -0.466 . . . . 75.200000000000003 111.163 179.933 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 6.2 mtmm -56.52 84.48 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.207 -0.452 . . . . 61.530000000000001 110.898 179.888 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . 0.439 ' N ' ' O ' ' A' ' 34' ' ' THR . 0.2 OUTLIER -104.83 -69.74 0.8 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.239 -0.437 . . . . 73.5 110.824 -179.982 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 45.53 -172.03 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.189 -0.459 . . . . 73.129999999999995 110.9 179.982 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 89.5 p -97.91 -173.94 2.74 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.216 -0.447 . . . . 75.010000000000005 110.832 -179.897 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 1.4 m -48.85 99.85 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.085 -0.507 . . . . 72.230000000000004 110.849 -179.833 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' TRP . . . . . . . . . . . . . 1.5 t-105 -175.05 -68.96 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.097 -0.502 . . . . 74.319999999999993 110.904 -179.966 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 1.3 t0 -156.07 128.99 7.94 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.235 -0.439 . . . . 74.109999999999999 110.875 179.947 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . 0.46 ' C ' ' HD3' ' A' ' 44' ' ' PRO . 0.0 OUTLIER -150.79 85.08 1.35 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.224 -0.443 . . . . 72.349999999999994 110.907 179.949 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . 0.467 ' N ' ' CD ' ' A' ' 44' ' ' PRO . 15.6 tt0 -116.58 52.73 1.06 Allowed Pre-proline 0 C--N 1.329 -0.309 0 CA-C-O 121.587 0.708 . . . . 61.25 110.896 179.985 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' PRO . . . . . 0.467 ' CD ' ' N ' ' A' ' 43' ' ' GLN . 54.3 Cg_endo -69.77 -163.39 0.11 Allowed 'Trans proline' 0 C--N 1.341 0.168 0 C-N-CA 122.652 2.235 . . . . 72.140000000000001 112.39 179.971 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' GLN . . . . . 0.879 ' HG2' HG23 ' A' ' 47' ' ' ILE . 15.1 pt20 -175.4 34.46 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.281 -0.418 . . . . 74.049999999999997 110.929 -179.96 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . 0.643 HG22 ' O ' ' A' ' 45' ' ' GLN . 0.2 OUTLIER 87.16 -21.88 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.174 -0.466 . . . . 54.399999999999999 111.142 -180.0 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . 0.879 HG23 ' HG2' ' A' ' 45' ' ' GLN . 0.2 OUTLIER -36.5 144.54 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.205 -0.452 . . . . 65.329999999999998 111.171 179.849 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 48' ' ' PHE . . . . . 0.759 ' HA ' HD22 ' A' ' 33' ' ' LEU . 0.9 OUTLIER -161.59 158.37 26.15 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.183 -0.462 . . . . 74.239999999999995 110.896 -179.994 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . 0.914 ' CG ' HD13 ' A' ' 33' ' ' LEU . 20.4 mt-10 -108.76 160.99 15.52 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.137 -0.483 . . . . 72.530000000000001 110.866 -179.922 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . 0.547 HD13 ' HA ' ' A' ' 30' ' ' PHE . 15.4 mm -141.66 135.55 30.44 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.151 -0.477 . . . . 64.420000000000002 111.131 179.975 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 90.2 m -83.73 137.08 33.92 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.136 -0.484 . . . . 72.519999999999996 111.195 179.946 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . 0.45 HD12 HD12 ' A' ' 66' ' ' LEU . 14.2 mt -136.69 160.23 39.46 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.216 -0.447 . . . . 74.230000000000004 110.92 179.943 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 7.4 ptt85 -176.14 161.6 2.38 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.18 -0.464 . . . . 72.120000000000005 110.829 179.965 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -53.63 -176.68 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.154 -0.475 . . . . 75.019999999999996 110.886 -179.823 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 15.9 m -94.41 -25.69 4.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.169 -0.469 . . . . 72.430000000000007 111.084 179.984 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -124.47 -165.99 1.45 Allowed 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.179 -0.464 . . . . 74.310000000000002 110.881 179.92 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -114.76 -14.58 11.97 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.191 -0.458 . . . . 62.25 110.854 -179.954 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . 0.554 ' HA ' ' C ' ' A' ' 59' ' ' PRO . 7.5 pt-20 -119.49 143.22 34.15 Favored Pre-proline 0 C--N 1.329 -0.294 0 CA-C-O 121.644 0.735 . . . . 44.229999999999997 110.859 -179.995 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 59' ' ' PRO . . . . . 0.554 ' C ' ' HA ' ' A' ' 58' ' ' GLU . 54.3 Cg_endo -69.81 -9.2 10.99 Favored 'Cis proline' 0 C--O 1.232 0.188 0 C-N-CA 122.632 -1.82 . . . . 71.439999999999998 112.364 0.025 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 60' ' ' VAL . . . . . 0.581 HG22 ' HG2' ' A' ' 129' ' ' GLN . 12.0 m -153.89 176.54 0.48 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.242 -0.436 . . . . 42.329999999999998 111.164 179.903 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . 0.461 ' O ' ' C ' ' A' ' 62' ' ' SER . 6.0 tt0 -107.93 -18.0 13.91 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.203 -0.453 . . . . 72.519999999999996 110.917 179.963 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . 0.721 ' HB3' HD11 ' A' ' 125' ' ' LEU . 0.1 OUTLIER 33.7 90.05 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.191 -0.459 . . . . 73.519999999999996 110.845 -179.846 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -103.66 122.85 45.87 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.151 -0.477 . . . . 74.209999999999994 110.866 -179.801 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 64' ' ' ILE . . . . . 0.775 HD13 HD11 ' A' ' 94' ' ' LEU . 12.5 mt -141.37 150.42 19.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.156 -0.475 . . . . 71.219999999999999 111.113 179.972 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 84.0 m -118.96 117.34 28.55 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.153 -0.476 . . . . 64.340000000000003 111.135 179.972 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . 0.802 HD11 HG21 ' A' ' 121' ' ' THR . 11.4 mt -95.04 111.9 23.66 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.217 -0.447 . . . . 73.530000000000001 110.912 179.979 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 67' ' ' HIS . . . . . 0.552 ' CE1' HD11 ' A' ' 33' ' ' LEU . 0.9 OUTLIER -102.11 111.88 24.33 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.152 -0.476 . . . . 61.219999999999999 110.843 179.855 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 68' ' ' PHE . . . . . 0.536 ' CE1' HG23 ' A' ' 114' ' ' ILE . 0.0 OUTLIER -103.83 139.95 38.33 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.195 -0.457 . . . . 72.040000000000006 110.889 -179.959 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -119.67 118.4 30.83 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.123 -0.49 . . . . 63.229999999999997 111.096 179.897 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 70' ' ' MET . . . . . 0.445 ' CE ' HD11 ' A' ' 114' ' ' ILE . 2.3 mmt -84.08 99.13 10.27 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.238 -0.437 . . . . 70.209999999999994 110.883 179.942 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -53.25 159.86 1.94 Allowed Pre-proline 0 C--N 1.33 -0.275 0 CA-C-O 121.553 0.692 . . . . 71.040000000000006 111.14 -179.912 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.73 -2.22 9.79 Favored 'Trans proline' 0 C--N 1.341 0.167 0 C-N-CA 122.69 2.26 . . . . 71.219999999999999 112.376 179.887 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 73' ' ' MET . . . . . 0.496 ' O ' ' CB ' ' A' ' 76' ' ' TYR . 0.1 OUTLIER -115.83 -23.33 8.67 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.234 -0.439 . . . . 73.439999999999998 110.914 179.902 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 74' ' ' TYR . . . . . 0.665 ' CD1' ' C ' ' A' ' 74' ' ' TYR . 0.0 OUTLIER -48.49 151.53 1.93 Allowed Pre-proline 0 C--N 1.328 -0.353 0 CA-C-O 121.69 0.757 . . . . 73.129999999999995 110.924 -179.907 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 75' ' ' PRO . . . . . 0.544 ' HA ' ' CD2' ' A' ' 74' ' ' TYR . 53.7 Cg_endo -69.73 -9.99 11.23 Favored 'Cis proline' 0 C--N 1.341 0.184 0 C-N-CA 122.633 -1.819 . . . . 75.510000000000005 112.386 -0.109 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 76' ' ' TYR . . . . . 0.496 ' CB ' ' O ' ' A' ' 73' ' ' MET . 16.3 t80 -34.41 -52.3 0.48 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.172 -0.467 . . . . 70.420000000000002 110.916 -179.911 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 62.1 p -101.41 -171.56 2.01 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.094 -0.503 . . . . 71.439999999999998 111.158 -179.956 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -108.65 131.31 21.85 Favored Pre-proline 0 C--N 1.328 -0.335 0 CA-C-O 121.57 0.7 . . . . 70.439999999999998 111.142 179.842 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 79' ' ' PRO . . . . . 0.685 ' HG3' HD11 ' A' ' 113' ' ' ILE . 53.5 Cg_endo -69.82 -170.14 0.38 Allowed 'Trans proline' 0 C--N 1.342 0.192 0 C-N-CA 122.688 2.259 . . . . 71.129999999999995 112.344 -179.964 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . 0.428 ' O ' HD13 ' A' ' 81' ' ' ILE . 0.3 OUTLIER -127.37 127.36 44.08 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.242 -0.436 . . . . 60.200000000000003 110.854 -179.963 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 81' ' ' ILE . . . . . 0.722 ' CG2' HD22 ' A' ' 66' ' ' LEU . 10.2 mm -120.4 139.13 48.65 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.156 -0.475 . . . . 73.219999999999999 111.102 179.956 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . 0.487 ' HG3' ' CD ' ' A' ' 84' ' ' LYS . 7.2 pt-20 -148.34 144.04 27.28 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.144 -0.48 . . . . 63.43 110.866 179.948 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 83' ' ' PHE . . . . . 0.57 ' CG ' HD12 ' A' ' 94' ' ' LEU . 22.5 m-85 -93.76 141.14 28.84 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.132 -0.486 . . . . 74.349999999999994 110.895 -179.963 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 84' ' ' LYS . . . . . 0.487 ' CD ' ' HG3' ' A' ' 82' ' ' GLU . 9.6 mmmt -124.89 171.05 10.49 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.124 -0.489 . . . . 65.25 110.903 179.968 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . 0.413 ' O ' ' CG2' ' A' ' 86' ' ' VAL . 1.9 m-80 62.81 -74.22 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.216 -0.447 . . . . 72.0 110.918 179.977 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 86' ' ' VAL . . . . . 0.465 ' N ' ' O ' ' A' ' 84' ' ' LYS . 3.2 m 41.5 92.08 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.144 -0.48 . . . . 73.239999999999995 111.144 179.901 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -102.54 -69.59 0.78 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.21 -0.45 . . . . 73.0 110.868 -179.945 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 88' ' ' ASN . . . . . 0.459 ' CG ' ' HB ' ' A' ' 60' ' ' VAL . 14.6 m-80 -83.31 53.11 2.38 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.191 -0.459 . . . . 73.329999999999998 110.851 -179.909 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 89' ' ' VAL . . . . . 0.687 HG21 HD22 ' A' ' 94' ' ' LEU . 2.1 p -165.27 133.85 0.63 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.173 -0.467 . . . . 75.129999999999995 111.1 179.904 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 90' ' ' MET . . . . . . . . . . . . . 1.4 mtm -78.36 -70.43 0.49 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.123 -0.49 . . . . 62.210000000000001 110.885 179.888 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 91' ' ' ASP . . . . . 0.5 ' HA ' HD23 ' A' ' 94' ' ' LEU . 5.1 p-10 -176.34 -30.95 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.195 -0.457 . . . . 55.409999999999997 110.857 179.981 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -53.65 -37.65 63.32 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.185 -0.461 . . . . 70.319999999999993 110.906 -179.792 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 93' ' ' GLN . . . . . 0.534 ' HG2' ' CZ ' ' A' ' 128' ' ' PHE . 1.4 mp0 -71.03 -38.37 72.58 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.108 -0.496 . . . . 73.200000000000003 110.917 -179.945 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . 0.775 HD11 HD13 ' A' ' 64' ' ' ILE . 1.1 mm? -64.78 -47.21 78.95 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.166 -0.47 . . . . 72.230000000000004 110.907 -179.964 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 44.6 mt-30 -65.17 -34.0 77.35 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.16 -0.473 . . . . 72.340000000000003 110.905 179.952 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 96' ' ' MET . . . . . . . . . . . . . 32.0 ttp -59.85 -37.88 80.52 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.184 -0.462 . . . . 73.209999999999994 110.913 179.951 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 97' ' ' LEU . . . . . 0.477 ' O ' ' CD1' ' A' ' 101' ' ' PHE . 17.1 mt -71.97 -38.9 69.66 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.188 -0.46 . . . . 70.239999999999995 110.902 179.961 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 98' ' ' LYS . . . . . 0.449 ' HZ1' ' HA ' ' A' ' 82' ' ' GLU . 7.0 mmtt -54.64 -37.11 65.28 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.206 -0.452 . . . . 62.539999999999999 110.903 179.847 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -64.45 -38.69 91.9 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.217 -0.447 . . . . 73.329999999999998 110.864 -179.861 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 100' ' ' GLU . . . . . 0.498 ' O ' HD12 ' A' ' 104' ' ' ILE . 1.4 mp0 -72.94 -24.1 60.77 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.145 -0.48 . . . . 70.549999999999997 110.905 179.995 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 101' ' ' PHE . . . . . 0.477 ' CD1' ' O ' ' A' ' 97' ' ' LEU . 8.9 m-30 -59.75 -35.19 74.1 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.117 -0.492 . . . . 74.099999999999994 110.935 -179.951 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.51 -38.29 84.07 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.143 -0.48 . . . . 53.530000000000001 110.881 179.959 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 21.8 mtmt -70.04 -43.19 71.76 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.264 -0.426 . . . . 73.109999999999999 110.927 179.846 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 104' ' ' ILE . . . . . 0.498 HD12 ' O ' ' A' ' 100' ' ' GLU . 3.0 mt -62.16 -47.45 93.06 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.185 -0.461 . . . . 71.319999999999993 111.102 179.901 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 105' ' ' HIS . . . . . 0.465 ' O ' ' N ' ' A' ' 109' ' ' ARG . 1.8 t60 -62.87 -41.09 99.26 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.163 -0.471 . . . . 75.140000000000001 110.832 179.932 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 1.3 m-80 -58.14 -39.25 78.3 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.246 -0.434 . . . . 63.520000000000003 110.834 -179.901 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 9.4 t -90.12 -13.18 36.28 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.195 -0.457 . . . . 75.099999999999994 111.091 -179.921 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 108' ' ' SER . . . . . 0.578 ' HB3' HG22 ' A' ' 113' ' ' ILE . 58.8 m -116.78 17.5 15.12 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.241 -0.436 . . . . 72.019999999999996 110.863 -179.845 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 109' ' ' ARG . . . . . 0.465 ' N ' ' O ' ' A' ' 105' ' ' HIS . 21.4 ttp180 -67.17 76.16 0.14 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.098 -0.501 . . . . 71.010000000000005 110.884 -179.98 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 149.05 -21.63 1.25 Allowed Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.77 -0.728 . . . . 72.310000000000002 112.505 -179.954 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 111' ' ' GLN . . . . . . . . . . . . . 10.6 pt20 -116.84 -165.48 1.07 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.765 0.317 . . . . 72.109999999999999 110.894 -179.891 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 23.4 mt-10 -67.05 134.29 51.6 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.189 -0.46 . . . . 63.020000000000003 110.871 -179.943 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 113' ' ' ILE . . . . . 0.685 HD11 ' HG3' ' A' ' 79' ' ' PRO . 22.4 pt -124.5 -14.66 5.07 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 116.131 -0.486 . . . . 75.109999999999999 111.117 179.984 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 114' ' ' ILE . . . . . 0.716 ' O ' HG23 ' A' ' 118' ' ' THR . 14.5 mm -63.03 -43.83 99.26 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.157 -0.474 . . . . 74.329999999999998 111.15 179.81 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 115' ' ' PHE . . . . . 0.854 ' CE1' HD13 ' A' ' 25' ' ' ILE . 16.2 t80 -72.52 -35.97 68.21 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.145 -0.48 . . . . 72.349999999999994 110.91 179.944 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 5.2 mm-40 -66.02 -46.77 76.69 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.189 -0.459 . . . . 62.539999999999999 110.922 -179.954 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 117' ' ' ILE . . . . . 0.49 ' CG2' ' N ' ' A' ' 118' ' ' THR . 0.7 OUTLIER -64.37 -43.06 97.03 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.159 -0.473 . . . . 74.510000000000005 111.137 179.93 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 118' ' ' THR . . . . . 0.716 HG23 ' O ' ' A' ' 114' ' ' ILE . 72.7 p -67.83 -43.03 80.49 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.192 -0.458 . . . . 52.219999999999999 111.127 179.972 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 4.0 m -63.86 -44.48 92.99 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.245 -0.434 . . . . 61.219999999999999 110.843 -179.835 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 120' ' ' PHE . . . . . 0.405 ' O ' ' HG2' ' A' ' 123' ' ' GLU . 0.2 OUTLIER -65.41 -48.74 71.77 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.176 -0.465 . . . . 74.430000000000007 110.906 -179.984 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 121' ' ' THR . . . . . 0.802 HG21 HD11 ' A' ' 66' ' ' LEU . 25.3 p -63.7 -38.62 91.8 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.154 -0.475 . . . . 72.519999999999996 111.137 -179.912 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 27.7 tt0 -63.23 -41.44 99.11 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.202 -0.453 . . . . 64.439999999999998 110.903 -179.963 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 123' ' ' GLU . . . . . 0.497 ' O ' ' CG ' ' A' ' 127' ' ' GLU . 4.2 pt-20 -75.95 -35.61 59.64 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.245 -0.434 . . . . 74.349999999999994 110.861 -179.946 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 124' ' ' LYS . . . . . 0.491 ' HA ' ' CG ' ' A' ' 127' ' ' GLU . 0.0 OUTLIER -68.61 -35.22 77.03 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.14 -0.482 . . . . 74.420000000000002 110.901 179.966 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 125' ' ' LEU . . . . . 0.811 HD23 ' O ' ' A' ' 125' ' ' LEU . 4.0 tt -72.93 -43.67 62.1 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.274 -0.421 . . . . 73.430000000000007 110.925 179.912 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 4.5 t70 -65.7 -46.93 77.14 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.219 -0.446 . . . . 75.109999999999999 110.836 179.843 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 127' ' ' GLU . . . . . 0.497 ' CG ' ' O ' ' A' ' 123' ' ' GLU . 0.0 OUTLIER -59.52 -50.35 74.23 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.248 -0.433 . . . . 72.040000000000006 110.868 -179.908 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 128' ' ' PHE . . . . . 0.667 ' C ' ' CD1' ' A' ' 128' ' ' PHE . 0.0 OUTLIER -66.8 -46.05 76.46 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.161 -0.472 . . . . 74.450000000000003 110.865 -179.906 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 129' ' ' GLN . . . . . 0.581 ' HG2' HG22 ' A' ' 60' ' ' VAL . 0.9 OUTLIER -54.6 -38.8 67.18 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.19 -0.459 . . . . 73.409999999999997 110.9 -179.941 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 130' ' ' ASN . . . . . 0.591 ' O ' HG23 ' A' ' 131' ' ' VAL . 36.6 t-20 -49.16 -72.73 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.164 -0.471 . . . . 72.409999999999997 110.898 -179.971 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 131' ' ' VAL . . . . . 0.706 HG12 HG23 ' A' ' 132' ' ' VAL . 73.6 t -162.15 -50.64 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.189 -0.46 . . . . 54.109999999999999 111.138 179.938 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 132' ' ' VAL . . . . . 0.706 HG23 HG12 ' A' ' 131' ' ' VAL . 79.6 t -158.97 86.45 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 116.162 -0.472 . . . . 50.450000000000003 111.104 179.95 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 133' ' ' ASN . . . . . 0.46 ' C ' ' O ' ' A' ' 132' ' ' VAL . 0.4 OUTLIER 33.57 88.39 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.157 -0.474 . . . . 70.140000000000001 110.872 -179.998 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 134' ' ' THR . . . . . . . . . . . . . 99.3 m -128.83 128.49 44.0 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.205 -0.452 . . . . 74.230000000000004 111.157 -179.987 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 2.5 mm100 -93.57 159.53 15.18 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.242 -0.436 . . . . 75.540000000000006 110.939 179.979 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 21.2 t -169.36 134.42 1.49 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.233 -0.439 . . . . 75.140000000000001 110.846 -179.756 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 137' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER 59.42 -177.75 0.09 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.128 -0.487 . . . . 74.230000000000004 110.926 179.993 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 7.3 tm-20 . . . . . 0 C--N 1.33 -0.28 0 CA-C-N 116.171 -0.468 . . . . 62.340000000000003 110.846 179.969 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 87.3 mmm . . . . . 0 C--O 1.23 0.072 0 CA-C-O 120.803 0.335 . . . . 62.450000000000003 110.809 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 72.6 p -121.51 154.07 37.12 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.214 -0.448 . . . . 72.519999999999996 110.835 -179.775 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -117.19 86.7 2.56 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.113 -0.494 . . . . 62.219999999999999 110.937 -179.987 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -174.68 140.46 0.59 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.189 -0.459 . . . . 61.43 110.851 -179.929 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 89.8 m-70 56.6 102.27 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.112 -0.495 . . . . 61.0 110.835 179.981 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 5.0 mp 46.8 94.74 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.224 -0.444 . . . . 75.140000000000001 110.953 -179.983 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 14.9 t -88.81 168.95 12.03 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.205 -0.452 . . . . 73.299999999999997 111.148 179.951 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.614 HD13 ' O ' ' A' ' 72' ' ' PRO . 17.4 mt -66.98 -29.35 69.17 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.202 -0.454 . . . . 72.209999999999994 110.948 179.97 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . 0.411 ' OD1' ' N ' ' A' ' 9' ' ' ASP . 1.2 m-20 -53.38 -32.58 50.03 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.179 -0.464 . . . . 64.319999999999993 110.852 179.863 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 33.0 mm-40 -66.99 -38.93 86.93 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.205 -0.452 . . . . 73.329999999999998 110.922 -179.969 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' TYR . . . . . 0.53 ' CD1' ' HD2' ' A' ' 75' ' ' PRO . 18.9 m-85 -61.65 -25.08 67.15 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.187 -0.46 . . . . 64.140000000000001 110.92 -179.89 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -59.05 -41.69 88.47 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.164 -0.471 . . . . 74.319999999999993 110.962 -179.917 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 1.5 mm-40 -62.43 -45.23 94.04 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.085 -0.507 . . . . 74.430000000000007 110.897 179.952 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . 0.402 HD12 ' H ' ' A' ' 14' ' ' ILE . 4.4 mp -67.21 -39.89 83.95 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.146 -0.479 . . . . 50.509999999999998 111.148 -179.999 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . 0.521 ' O ' HD13 ' A' ' 19' ' ' LEU . 55.9 mt-30 -62.62 -49.43 75.24 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.171 -0.468 . . . . 64.209999999999994 110.889 179.913 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -63.45 -40.67 97.75 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.206 -0.452 . . . . 74.120000000000005 110.878 -179.924 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . 0.419 ' O ' ' HG3' ' A' ' 20' ' ' GLU . 0.8 OUTLIER -57.71 -33.28 68.23 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.197 -0.456 . . . . 34.409999999999997 110.916 -179.91 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . 0.527 ' OE1' ' HE1' ' A' ' 70' ' ' MET . 1.4 tt0 -68.42 -37.82 80.65 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.143 -0.481 . . . . 72.409999999999997 110.895 -179.992 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.521 HD13 ' O ' ' A' ' 15' ' ' GLN . 10.9 mp -56.65 -52.26 65.56 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.189 -0.459 . . . . 63.130000000000003 110.926 -179.98 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . 0.419 ' HG3' ' O ' ' A' ' 17' ' ' ASN . 3.6 pt-20 -68.92 -31.97 71.25 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.204 -0.453 . . . . 73.209999999999994 110.901 179.952 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -63.59 -48.66 76.45 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.15 -0.477 . . . . 71.409999999999997 111.086 179.898 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . 0.721 HD11 ' HB2' ' A' ' 115' ' ' PHE . 0.5 OUTLIER -77.22 -34.29 21.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.161 -0.472 . . . . 61.409999999999997 111.122 -179.995 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 42.5 mtt180 -52.52 -35.44 53.22 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.208 -0.451 . . . . 72.030000000000001 110.874 179.971 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 24.8 p -62.66 -31.19 72.02 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.199 -0.455 . . . . 73.430000000000007 110.9 -179.8 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . 0.75 HD13 ' CE1' ' A' ' 115' ' ' PHE . 3.9 mt -84.76 -45.44 17.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.08 -0.509 . . . . 75.340000000000003 111.154 179.952 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 24.2 m-85 -105.82 44.63 1.03 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.142 -0.481 . . . . 74.409999999999997 110.948 179.991 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 2.2 mtm -43.53 -52.38 6.21 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.104 -0.498 . . . . 62.399999999999999 110.853 179.918 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 -93.68 -27.32 16.62 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.224 -0.443 . . . . 74.310000000000002 110.889 179.93 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 10.5 m-20 -87.62 27.66 1.09 Allowed 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.177 -0.465 . . . . 64.439999999999998 110.884 -179.982 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' PHE . . . . . 0.539 ' HA ' HD13 ' A' ' 50' ' ' ILE . 5.4 t80 -106.21 138.7 41.93 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.161 -0.472 . . . . 75.150000000000006 110.888 -179.904 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 55.3 m -122.91 133.07 54.42 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.128 -0.487 . . . . 53.039999999999999 111.132 -179.909 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 2.8 t70 -105.04 114.9 29.37 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.21 -0.45 . . . . 75.319999999999993 110.875 179.911 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.754 HD21 ' CE1' ' A' ' 67' ' ' HIS . 0.2 OUTLIER -115.51 -7.15 12.25 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.147 -0.479 . . . . 63.299999999999997 110.935 -179.953 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . 0.686 ' N ' HD12 ' A' ' 33' ' ' LEU . 0.2 OUTLIER -44.09 143.6 1.12 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.231 -0.44 . . . . 64.439999999999998 111.164 179.933 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 2.4 mmtm -57.99 79.25 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.245 -0.434 . . . . 72.230000000000004 110.855 179.932 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . 0.498 ' N ' ' O ' ' A' ' 34' ' ' THR . 2.0 mmm180 -87.93 -173.7 4.39 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.206 -0.452 . . . . 64.400000000000006 110.907 179.945 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -73.1 65.1 0.77 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.209 -0.45 . . . . 74.430000000000007 110.889 179.978 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -169.38 -38.18 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.273 -0.421 . . . . 73.450000000000003 110.876 -179.839 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 69.1 m -55.7 -172.0 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.158 -0.473 . . . . 73.510000000000005 110.878 -179.81 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' TRP . . . . . . . . . . . . . 28.2 p90 -111.12 -8.59 14.41 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.158 -0.474 . . . . 74.540000000000006 110.896 -179.966 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . 0.434 ' C ' ' HG2' ' A' ' 42' ' ' LYS . 19.3 t0 -124.88 169.19 12.3 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.212 -0.449 . . . . 73.040000000000006 110.871 179.901 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . 0.434 ' HG2' ' C ' ' A' ' 41' ' ' ASP . 0.1 OUTLIER -139.07 55.63 1.7 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.174 -0.466 . . . . 70.239999999999995 110.866 -179.951 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . 0.459 ' N ' ' CD ' ' A' ' 44' ' ' PRO . 0.8 OUTLIER -139.37 53.14 4.59 Favored Pre-proline 0 C--N 1.329 -0.305 0 CA-C-O 121.584 0.707 . . . . 72.299999999999997 110.914 179.972 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' PRO . . . . . 0.459 ' CD ' ' N ' ' A' ' 43' ' ' GLN . 54.0 Cg_endo -69.73 -166.4 0.18 Allowed 'Trans proline' 0 N--CA 1.465 -0.162 0 C-N-CA 122.703 2.269 . . . . 63.219999999999999 112.38 179.97 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' GLN . . . . . 0.964 ' HG2' HG23 ' A' ' 47' ' ' ILE . 0.0 OUTLIER -174.47 28.88 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.25 -0.432 . . . . 65.040000000000006 110.881 -179.988 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . 0.68 HG22 ' O ' ' A' ' 45' ' ' GLN . 0.1 OUTLIER 86.87 -21.09 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.217 -0.447 . . . . 75.129999999999995 111.121 179.988 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . 0.964 HG23 ' HG2' ' A' ' 45' ' ' GLN . 0.1 OUTLIER -34.99 152.5 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 116.22 -0.445 . . . . 41.340000000000003 111.137 179.841 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 48' ' ' PHE . . . . . 0.713 ' HZ ' HG21 ' A' ' 114' ' ' ILE . 1.7 p90 -161.68 168.21 23.76 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.174 -0.466 . . . . 73.510000000000005 110.876 179.965 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . 0.457 ' CG ' ' HB2' ' A' ' 67' ' ' HIS . 7.6 mt-10 -121.19 160.98 22.68 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.114 -0.494 . . . . 61.109999999999999 110.809 -179.892 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . 0.539 HD13 ' HA ' ' A' ' 30' ' ' PHE . 11.5 mm -139.2 134.83 41.3 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.144 -0.48 . . . . 65.239999999999995 111.14 179.951 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 93.6 m -88.53 118.33 28.11 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.146 -0.479 . . . . 34.299999999999997 111.14 179.997 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . 0.927 HD12 HD12 ' A' ' 66' ' ' LEU . 21.2 mt -119.63 165.3 14.64 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.202 -0.453 . . . . 70.239999999999995 110.916 179.958 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -175.96 166.53 3.02 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.182 -0.463 . . . . 75.049999999999997 110.828 179.985 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -59.3 177.25 0.19 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.177 -0.465 . . . . 64.420000000000002 110.859 -179.801 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 16.2 m -90.89 -26.37 5.18 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.147 -0.479 . . . . 71.239999999999995 111.096 179.959 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -115.31 -169.79 1.64 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.205 -0.452 . . . . 71.439999999999998 110.894 179.924 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -116.27 -23.58 8.33 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.2 -0.455 . . . . 72.310000000000002 110.903 -179.996 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . 0.551 ' HA ' ' C ' ' A' ' 59' ' ' PRO . 7.9 pt-20 -114.51 146.32 35.67 Favored Pre-proline 0 C--N 1.329 -0.289 0 CA-C-O 121.574 0.702 . . . . 71.400000000000006 110.939 179.933 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 59' ' ' PRO . . . . . 0.551 ' C ' ' HA ' ' A' ' 58' ' ' GLU . 54.0 Cg_endo -69.75 -12.54 12.21 Favored 'Cis proline' 0 C--O 1.232 0.194 0 C-N-CA 122.69 -1.796 . . . . 64.319999999999993 112.334 -0.025 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 60' ' ' VAL . . . . . 0.938 HG22 ' OE1' ' A' ' 129' ' ' GLN . 12.2 m -147.44 167.61 5.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.25 -0.432 . . . . 63.399999999999999 111.138 179.902 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 5.9 tt0 -94.26 -22.64 18.26 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.138 -0.483 . . . . 73.040000000000006 110.873 -179.967 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . 0.626 ' CB ' HD21 ' A' ' 125' ' ' LEU . 1.7 m 42.68 94.66 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.166 -0.47 . . . . 70.329999999999998 110.834 -179.819 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 25.5 t -118.97 123.1 43.75 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.141 -0.481 . . . . 75.530000000000001 110.878 -179.85 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 64' ' ' ILE . . . . . 0.728 HD11 HG21 ' A' ' 89' ' ' VAL . 52.9 mt -138.08 147.14 26.05 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.092 -0.503 . . . . 44.329999999999998 111.126 179.956 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 29.0 m -111.62 113.79 26.42 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.189 -0.46 . . . . 74.430000000000007 111.124 179.987 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . 1.017 HD21 ' CE1' ' A' ' 83' ' ' PHE . 15.9 mt -91.97 109.95 21.3 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.247 -0.433 . . . . 33.329999999999998 110.927 179.928 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 67' ' ' HIS . . . . . 0.754 ' CE1' HD21 ' A' ' 33' ' ' LEU . 1.2 t60 -95.64 109.89 22.08 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.19 -0.459 . . . . 75.219999999999999 110.839 179.884 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 68' ' ' PHE . . . . . 0.498 ' HA ' HD13 ' A' ' 81' ' ' ILE . 0.0 OUTLIER -104.02 139.93 38.45 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.219 -0.446 . . . . 53.299999999999997 110.874 -179.917 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . 0.563 ' HA ' HG22 ' A' ' 47' ' ' ILE . . . -124.44 120.07 30.99 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.165 -0.47 . . . . 34.130000000000003 111.087 179.93 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 70' ' ' MET . . . . . 0.527 ' HE1' ' OE1' ' A' ' 18' ' ' GLU . 9.2 mmt -79.63 95.51 5.93 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.199 -0.455 . . . . 75.319999999999993 110.864 179.98 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -49.78 160.16 0.65 Allowed Pre-proline 0 C--N 1.33 -0.263 0 CA-C-O 121.639 0.733 . . . . 74.349999999999994 111.135 -179.923 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 72' ' ' PRO . . . . . 0.614 ' O ' HD13 ' A' ' 8' ' ' LEU . 53.9 Cg_endo -69.78 3.1 2.98 Favored 'Trans proline' 0 C--N 1.342 0.189 0 C-N-CA 122.691 2.261 . . . . 61.329999999999998 112.349 179.963 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 73' ' ' MET . . . . . 0.694 ' HB3' HG23 ' A' ' 77' ' ' THR . 0.0 OUTLIER -120.36 -25.55 5.61 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.194 -0.457 . . . . 74.230000000000004 110.881 179.908 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 74' ' ' TYR . . . . . 0.653 ' CD1' ' C ' ' A' ' 74' ' ' TYR . 0.0 OUTLIER -50.52 150.75 4.51 Favored Pre-proline 0 C--N 1.328 -0.337 0 CA-C-O 121.648 0.737 . . . . 74.549999999999997 110.916 -179.854 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 75' ' ' PRO . . . . . 0.542 ' C ' ' HA ' ' A' ' 74' ' ' TYR . 53.7 Cg_endo -69.76 -14.12 12.45 Favored 'Cis proline' 0 C--N 1.341 0.183 0 C-N-CA 122.65 -1.813 . . . . 75.430000000000007 112.325 -0.089 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 76' ' ' TYR . . . . . 0.502 ' CB ' ' O ' ' A' ' 73' ' ' MET . 6.2 t80 -33.93 -52.64 0.44 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.236 -0.438 . . . . 74.010000000000005 110.883 -179.912 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 77' ' ' THR . . . . . 0.694 HG23 ' HB3' ' A' ' 73' ' ' MET . 39.0 p -105.86 -178.88 3.78 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.141 -0.481 . . . . 63.149999999999999 111.179 -179.989 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -98.62 129.36 30.32 Favored Pre-proline 0 C--N 1.329 -0.287 0 CA-C-O 121.595 0.712 . . . . 55.25 111.135 179.859 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 79' ' ' PRO . . . . . 0.778 ' HG3' HD11 ' A' ' 113' ' ' ILE . 53.9 Cg_endo -69.74 -170.89 0.42 Allowed 'Trans proline' 0 C--O 1.231 0.152 0 C-N-CA 122.717 2.278 . . . . 51.039999999999999 112.366 -179.992 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . 0.402 ' O ' HD13 ' A' ' 81' ' ' ILE . 2.1 tt0 -119.77 125.17 47.94 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.224 -0.443 . . . . 73.340000000000003 110.878 -179.982 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 81' ' ' ILE . . . . . 0.498 HD13 ' HA ' ' A' ' 68' ' ' PHE . 13.0 mm -121.37 142.38 37.83 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.107 -0.497 . . . . 71.329999999999998 111.109 -179.985 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . 0.485 ' HG3' ' CD ' ' A' ' 84' ' ' LYS . 11.8 pt-20 -148.61 147.2 28.7 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.162 -0.472 . . . . 64.140000000000001 110.886 179.903 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 83' ' ' PHE . . . . . 1.017 ' CE1' HD21 ' A' ' 66' ' ' LEU . 91.2 m-85 -95.79 139.97 31.25 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.12 -0.491 . . . . 73.109999999999999 110.893 -179.934 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 84' ' ' LYS . . . . . 0.485 ' CD ' ' HG3' ' A' ' 82' ' ' GLU . 6.0 mmmt -126.25 170.8 11.49 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.159 -0.473 . . . . 74.319999999999993 110.918 -179.998 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . 0.627 HD22 ' N ' ' A' ' 85' ' ' ASN . 0.8 OUTLIER 63.53 -73.35 0.05 OUTLIER 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.258 -0.428 . . . . 72.200000000000003 110.892 179.946 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 86' ' ' VAL . . . . . 0.503 HG11 HD11 ' A' ' 94' ' ' LEU . 4.2 m 36.12 91.0 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 116.162 -0.472 . . . . 63.520000000000003 111.182 179.952 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -94.93 -72.49 0.62 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.18 -0.464 . . . . 74.010000000000005 110.881 -179.94 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 88' ' ' ASN . . . . . 0.427 ' CG ' ' HB ' ' A' ' 60' ' ' VAL . 24.5 m120 -81.28 47.1 0.99 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.184 -0.462 . . . . 72.519999999999996 110.897 -179.954 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 89' ' ' VAL . . . . . 0.728 HG21 HD11 ' A' ' 64' ' ' ILE . 48.1 t -141.71 145.27 24.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.138 -0.483 . . . . 72.340000000000003 111.118 179.897 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 90' ' ' MET . . . . . . . . . . . . . 21.3 mtm -92.04 -71.11 0.66 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.15 -0.477 . . . . 73.549999999999997 110.871 179.941 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER 178.28 -37.21 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.249 -0.432 . . . . 73.519999999999996 110.901 179.951 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -55.97 -45.78 78.82 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.196 -0.456 . . . . 54.109999999999999 110.891 -179.805 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 93' ' ' GLN . . . . . 0.581 ' HG2' ' CD2' ' A' ' 128' ' ' PHE . 2.4 mp0 -61.19 -44.38 97.38 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.152 -0.476 . . . . 73.430000000000007 110.874 -179.969 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . 0.503 HD11 HG11 ' A' ' 86' ' ' VAL . 78.6 mt -59.08 -48.85 80.1 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.188 -0.46 . . . . 64.140000000000001 110.92 -179.974 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 2.2 mm-40 -65.1 -33.7 76.64 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.166 -0.47 . . . . 54.420000000000002 110.877 179.959 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 96' ' ' MET . . . . . . . . . . . . . 30.5 ttp -59.9 -38.64 82.86 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.212 -0.449 . . . . 75.109999999999999 110.852 179.997 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 97' ' ' LEU . . . . . 0.581 ' HB3' ' CZ ' ' A' ' 101' ' ' PHE . 24.9 mt -65.64 -41.09 93.02 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.199 -0.455 . . . . 75.409999999999997 110.922 -179.997 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 98' ' ' LYS . . . . . 0.515 ' HA ' ' CD2' ' A' ' 101' ' ' PHE . 13.2 mmtm -55.47 -43.62 75.67 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.17 -0.468 . . . . 73.510000000000005 110.867 179.871 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 4.2 t -57.28 -38.2 73.56 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.246 -0.433 . . . . 75.549999999999997 110.87 -179.936 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 6.8 mt-10 -74.69 -29.97 61.4 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.12 -0.491 . . . . 73.540000000000006 110.887 -179.965 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 101' ' ' PHE . . . . . 0.647 ' CZ ' HD11 ' A' ' 117' ' ' ILE . 14.0 m-30 -61.74 -27.77 68.95 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.164 -0.471 . . . . 74.519999999999996 110.896 -179.93 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -65.37 -44.92 86.1 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.106 -0.497 . . . . 75.430000000000007 110.927 179.953 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.53 -37.51 74.11 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.199 -0.455 . . . . 62.009999999999998 110.912 179.846 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 104' ' ' ILE . . . . . 0.569 HD11 ' CD2' ' A' ' 120' ' ' PHE . 5.0 mt -61.93 -47.54 92.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.257 -0.429 . . . . 71.319999999999993 111.104 179.886 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 105' ' ' HIS . . . . . . . . . . . . . 1.6 t60 -62.86 -42.15 99.64 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.19 -0.459 . . . . 74.299999999999997 110.844 179.886 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -56.94 -43.37 81.44 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.242 -0.435 . . . . 64.450000000000003 110.924 -179.945 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 6.9 t -77.84 -30.71 51.14 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.127 -0.488 . . . . 65.420000000000002 111.136 -179.986 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 21.0 m -102.96 24.23 11.04 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.229 -0.441 . . . . 60.020000000000003 110.835 -179.866 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 17.9 ttt180 -67.16 77.69 0.14 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.142 -0.481 . . . . 71.209999999999994 110.901 -179.993 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 110' ' ' GLY . . . . . 0.472 ' HA2' ' CG ' ' A' ' 75' ' ' PRO . . . 145.64 -18.46 1.83 Allowed Glycine 0 N--CA 1.452 -0.266 0 C-N-CA 120.71 -0.757 . . . . 44.32 112.477 -179.949 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 111' ' ' GLN . . . . . . . . . . . . . 10.0 pt20 -117.49 -165.1 1.05 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.735 0.302 . . . . 72.310000000000002 110.928 -179.88 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 53.3 mt-10 -69.08 135.6 51.02 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.215 -0.448 . . . . 74.549999999999997 110.88 -179.944 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 113' ' ' ILE . . . . . 0.778 HD11 ' HG3' ' A' ' 79' ' ' PRO . 28.0 pt -123.8 -16.32 4.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.122 -0.49 . . . . 65.230000000000004 111.125 179.993 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 114' ' ' ILE . . . . . 0.883 ' O ' HG23 ' A' ' 118' ' ' THR . 29.7 mm -61.19 -38.7 80.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.155 -0.475 . . . . 33.340000000000003 111.115 179.878 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 115' ' ' PHE . . . . . 0.75 ' CE1' HD13 ' A' ' 25' ' ' ILE . 43.0 t80 -72.82 -36.16 67.46 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.183 -0.462 . . . . 75.430000000000007 110.883 179.969 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 8.3 mm-40 -68.3 -46.66 69.72 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.14 -0.482 . . . . 73.409999999999997 110.897 -179.958 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 117' ' ' ILE . . . . . 0.647 HD11 ' CZ ' ' A' ' 101' ' ' PHE . 0.0 OUTLIER -65.79 -41.94 91.29 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 116.161 -0.472 . . . . 74.310000000000002 111.111 179.984 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 118' ' ' THR . . . . . 0.883 HG23 ' O ' ' A' ' 114' ' ' ILE . 57.4 p -68.8 -42.95 76.63 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.179 -0.464 . . . . 54.109999999999999 111.15 179.943 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 36.6 t -65.13 -44.34 89.0 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.198 -0.455 . . . . 74.420000000000002 110.87 -179.867 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 120' ' ' PHE . . . . . 0.569 ' CD2' HD11 ' A' ' 104' ' ' ILE . 0.7 OUTLIER -60.87 -48.08 83.45 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.161 -0.472 . . . . 73.129999999999995 110.878 -179.963 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 121' ' ' THR . . . . . 0.957 HG21 HD11 ' A' ' 66' ' ' LEU . 18.9 p -58.77 -38.98 79.68 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.13 -0.486 . . . . 72.120000000000005 111.182 -179.94 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 9.1 tt0 -61.46 -40.89 96.14 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.197 -0.456 . . . . 75.450000000000003 110.929 179.972 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 123' ' ' GLU . . . . . 0.453 ' HG2' ' N ' ' A' ' 124' ' ' LYS . 1.0 OUTLIER -75.46 -45.0 41.21 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.231 -0.441 . . . . 74.430000000000007 110.901 -179.965 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 124' ' ' LYS . . . . . 0.453 ' N ' ' HG2' ' A' ' 123' ' ' GLU . 8.4 mmmt -64.43 -37.83 88.91 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.167 -0.469 . . . . 71.530000000000001 110.907 179.957 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 125' ' ' LEU . . . . . 0.789 HD23 ' O ' ' A' ' 125' ' ' LEU . 3.6 tt -69.65 -44.59 70.23 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.18 -0.464 . . . . 73.409999999999997 110.919 179.909 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 126' ' ' ASP . . . . . 0.424 ' OD1' ' C ' ' A' ' 126' ' ' ASP . 0.0 OUTLIER -68.61 -39.89 80.65 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.183 -0.462 . . . . 73.519999999999996 110.833 179.858 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 127' ' ' GLU . . . . . 0.491 ' HG3' ' N ' ' A' ' 128' ' ' PHE . 3.2 pt-20 -65.62 -42.77 91.17 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.225 -0.443 . . . . 63.399999999999999 110.882 -179.889 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 128' ' ' PHE . . . . . 0.659 ' C ' ' CD1' ' A' ' 128' ' ' PHE . 0.0 OUTLIER -75.16 -58.95 2.97 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.165 -0.47 . . . . 74.299999999999997 110.911 -179.926 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 129' ' ' GLN . . . . . 0.938 ' OE1' HG22 ' A' ' 60' ' ' VAL . 1.3 tm0? -46.75 -20.31 0.13 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.167 -0.469 . . . . 72.129999999999995 110.926 -179.934 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 130' ' ' ASN . . . . . . . . . . . . . 12.1 t-20 -62.52 -64.58 0.88 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.203 -0.453 . . . . 54.399999999999999 110.872 -179.951 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 18.7 m -147.75 -36.32 0.1 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.178 -0.464 . . . . 73.099999999999994 111.098 179.925 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 132' ' ' VAL . . . . . 0.638 ' O ' HG22 ' A' ' 132' ' ' VAL . 2.5 p 39.53 72.52 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.217 -0.447 . . . . 62.0 111.105 179.958 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 133' ' ' ASN . . . . . . . . . . . . . 4.6 t-20 71.65 -66.95 0.28 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.162 -0.472 . . . . 72.299999999999997 110.883 179.975 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 134' ' ' THR . . . . . . . . . . . . . 80.3 m -135.95 117.24 14.57 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.209 -0.45 . . . . 74.319999999999993 111.164 179.978 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 6.9 pt20 -72.47 126.4 29.76 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.223 -0.444 . . . . 73.219999999999999 110.933 -179.988 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -145.5 168.45 20.55 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.218 -0.446 . . . . 60.310000000000002 110.904 -179.789 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 137' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -126.55 150.36 48.87 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.162 -0.472 . . . . 72.310000000000002 110.914 -179.984 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 2.3 tt0 . . . . . 0 C--N 1.329 -0.29 0 CA-C-N 116.179 -0.464 . . . . 64.25 110.904 179.934 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 4.8 mmm . . . . . 0 C--O 1.231 0.085 0 CA-C-O 120.74 0.305 . . . . 62.329999999999998 110.916 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -60.18 89.72 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.24 -0.436 . . . . 75.420000000000002 110.807 -179.77 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -63.36 95.11 0.09 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.098 -0.501 . . . . 73.409999999999997 110.9 179.994 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -109.24 156.55 19.78 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.178 -0.464 . . . . 53.149999999999999 110.867 -179.954 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' HIS . . . . . 0.545 ' H ' ' CD2' ' A' ' 5' ' ' HIS . 6.3 p80 -76.52 149.98 36.64 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.118 -0.492 . . . . 75.109999999999999 110.839 179.978 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . 0.442 ' C ' ' O ' ' A' ' 5' ' ' HIS . 0.1 OUTLIER 35.2 81.09 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.202 -0.454 . . . . 74.349999999999994 110.938 -179.982 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 14.9 t -170.45 162.29 8.21 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.15 -0.477 . . . . 70.019999999999996 111.152 179.967 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.71 HD13 ' O ' ' A' ' 72' ' ' PRO . 20.1 mt -54.61 -27.94 43.01 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.247 -0.433 . . . . 71.219999999999999 110.926 179.939 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -51.52 -31.67 24.87 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.211 -0.45 . . . . 74.129999999999995 110.85 179.856 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 3.9 mm-40 -67.85 -35.49 78.66 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.178 -0.464 . . . . 73.450000000000003 110.88 -179.87 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' TYR . . . . . 0.402 ' CD1' ' HD2' ' A' ' 75' ' ' PRO . 13.6 m-85 -67.61 -24.98 65.53 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.208 -0.451 . . . . 74.109999999999999 110.933 -179.893 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -59.26 -38.08 79.18 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.146 -0.479 . . . . 64.099999999999994 110.925 -179.917 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 2.7 mm-40 -58.86 -46.0 88.8 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.126 -0.488 . . . . 44.340000000000003 110.903 179.979 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . 0.541 HG22 ' OE1' ' A' ' 18' ' ' GLU . 4.2 mp -68.05 -46.64 81.27 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.179 -0.464 . . . . 74.230000000000004 111.115 179.961 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 84.5 mt-30 -57.21 -48.22 79.33 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.202 -0.453 . . . . 74.319999999999993 110.89 179.966 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -62.22 -42.27 99.15 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.263 -0.426 . . . . 74.049999999999997 110.886 -179.945 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 2.5 m-20 -58.1 -33.64 69.33 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.168 -0.469 . . . . 74.409999999999997 110.876 -179.879 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . 0.541 ' OE1' HG22 ' A' ' 14' ' ' ILE . 2.4 mp0 -65.44 -38.85 91.1 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.163 -0.471 . . . . 74.230000000000004 110.93 179.986 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 8.5 mp -63.7 -51.7 63.84 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.103 -0.499 . . . . 74.120000000000005 110.909 -179.972 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 1.9 pt-20 -68.9 -32.72 72.55 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.163 -0.472 . . . . 73.319999999999993 110.888 179.925 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -62.06 -50.56 71.51 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.175 -0.466 . . . . 75.540000000000006 111.07 179.95 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . 0.716 ' HA ' HD12 ' A' ' 25' ' ' ILE . 0.6 OUTLIER -77.23 -34.36 21.2 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 116.249 -0.432 . . . . 72.540000000000006 111.112 179.985 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 44.4 mtp180 -52.54 -35.02 52.6 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.187 -0.46 . . . . 53.420000000000002 110.89 179.973 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -66.98 -31.43 72.0 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.191 -0.459 . . . . 51.420000000000002 110.828 -179.812 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . 0.722 HG21 ' HE1' ' A' ' 115' ' ' PHE . 3.9 mt -82.89 -44.41 18.96 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.159 -0.473 . . . . 74.5 111.137 179.967 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 26.6 m-85 -106.6 41.16 1.49 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.193 -0.458 . . . . 73.340000000000003 110.964 -179.994 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER -40.4 -49.38 2.82 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.099 -0.501 . . . . 71.420000000000002 110.895 179.91 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -98.39 -9.02 25.88 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.196 -0.456 . . . . 43.420000000000002 110.872 179.981 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -104.67 32.65 3.98 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.218 -0.446 . . . . 72.239999999999995 110.819 -179.999 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' PHE . . . . . 0.627 ' HA ' HD13 ' A' ' 50' ' ' ILE . 1.7 t80 -116.55 138.39 51.45 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.234 -0.439 . . . . 73.109999999999999 110.89 -179.95 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 52.3 m -111.71 129.79 55.99 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.147 -0.479 . . . . 71.340000000000003 111.089 -179.857 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . 0.452 ' O ' ' CG ' ' A' ' 32' ' ' ASP . 0.0 OUTLIER -99.36 115.62 29.64 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.215 -0.448 . . . . 53.100000000000001 110.864 179.861 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.854 HD21 HG12 ' A' ' 47' ' ' ILE . 0.4 OUTLIER -123.48 -17.04 6.62 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.138 -0.483 . . . . 63.340000000000003 110.943 -179.976 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . 0.81 ' N ' HD23 ' A' ' 33' ' ' LEU . 1.2 m -45.69 135.41 6.77 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.187 -0.46 . . . . 75.329999999999998 111.098 180.0 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -75.38 90.9 2.68 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.209 -0.45 . . . . 74.109999999999999 110.924 179.904 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -123.27 -155.75 0.67 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.242 -0.436 . . . . 71.239999999999995 110.871 -179.976 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . 0.418 ' O ' ' O ' ' A' ' 38' ' ' SER . 3.2 mmpt? 52.32 -172.42 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.188 -0.46 . . . . 72.420000000000002 110.905 179.987 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . 0.418 ' O ' ' O ' ' A' ' 37' ' ' LYS . 2.2 t -38.02 -93.07 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.175 -0.466 . . . . 71.140000000000001 110.915 -179.932 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . 0.401 ' N ' ' OG ' ' A' ' 38' ' ' SER . 73.3 m 55.65 -174.17 0.05 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.12 -0.491 . . . . 72.510000000000005 110.87 -179.86 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 40' ' ' TRP . . . . . . . . . . . . . 26.9 p90 -109.06 -25.63 10.58 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.156 -0.474 . . . . 74.439999999999998 110.881 -179.958 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 2.1 p30 -121.91 146.48 47.08 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.232 -0.44 . . . . 63.439999999999998 110.831 179.935 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -133.91 72.07 1.47 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.168 -0.469 . . . . 71.329999999999998 110.906 179.962 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 5.1 tt0 -124.46 63.67 36.17 Favored Pre-proline 0 C--N 1.329 -0.287 0 CA-C-O 121.579 0.704 . . . . 62.009999999999998 110.918 179.942 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.78 129.92 18.41 Favored 'Trans proline' 0 C--N 1.341 0.164 0 C-N-CA 122.671 2.247 . . . . 73.230000000000004 112.358 179.996 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 45' ' ' GLN . . . . . 0.559 ' O ' HG22 ' A' ' 46' ' ' ILE . 16.2 tt0 -106.42 8.47 31.58 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.235 -0.439 . . . . 73.439999999999998 110.931 -179.971 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . 0.559 HG22 ' O ' ' A' ' 45' ' ' GLN . 0.0 OUTLIER 82.02 -3.99 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.179 -0.464 . . . . 74.230000000000004 111.146 179.979 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . 0.854 HG12 HD21 ' A' ' 33' ' ' LEU . 0.2 OUTLIER -59.83 143.37 14.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.162 -0.472 . . . . 71.439999999999998 111.117 179.844 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 48' ' ' PHE . . . . . 0.767 ' HA ' HD22 ' A' ' 33' ' ' LEU . 4.2 p90 -155.54 154.73 32.19 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.218 -0.447 . . . . 73.510000000000005 110.884 179.955 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . 0.69 ' CG ' HD13 ' A' ' 33' ' ' LEU . 6.0 mt-10 -108.93 159.17 17.02 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.178 -0.465 . . . . 64.099999999999994 110.928 -179.971 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . 0.627 HD13 ' HA ' ' A' ' 30' ' ' PHE . 7.3 mm -133.95 140.6 46.0 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 116.174 -0.466 . . . . 71.430000000000007 111.179 179.962 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 88.9 m -85.21 118.58 24.84 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.208 -0.451 . . . . 73.109999999999999 111.153 179.99 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . 0.474 HD12 HD22 ' A' ' 66' ' ' LEU . 17.0 mt -123.3 163.23 21.13 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.286 -0.415 . . . . 74.120000000000005 110.925 179.962 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -178.43 175.54 1.14 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.211 -0.45 . . . . 73.219999999999999 110.905 179.979 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -70.12 -156.08 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.16 -0.473 . . . . 64.200000000000003 110.873 -179.811 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 18.0 m -117.72 -20.08 5.62 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.138 -0.483 . . . . 63.219999999999999 111.156 179.926 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -112.44 174.73 5.75 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.171 -0.468 . . . . 54.030000000000001 110.89 179.916 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -111.8 -22.38 11.16 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.173 -0.467 . . . . 73.120000000000005 110.895 179.989 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . 0.543 ' HA ' ' C ' ' A' ' 59' ' ' PRO . 3.4 pt-20 -126.32 148.91 65.6 Favored Pre-proline 0 C--N 1.33 -0.26 0 CA-C-O 121.692 0.758 . . . . 55.329999999999998 110.84 179.956 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 59' ' ' PRO . . . . . 0.543 ' C ' ' HA ' ' A' ' 58' ' ' GLU . 54.0 Cg_endo -69.72 -8.58 10.5 Favored 'Cis proline' 0 C--N 1.342 0.186 0 C-N-CA 122.737 -1.776 . . . . 74.340000000000003 112.33 0.012 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 60' ' ' VAL . . . . . 0.741 HG11 HD22 ' A' ' 88' ' ' ASN . 29.2 m -139.5 172.27 13.08 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.193 -0.458 . . . . 64.420000000000002 111.131 179.923 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 5.1 tt0 -108.35 -17.15 14.07 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.143 -0.48 . . . . 74.319999999999993 110.882 179.99 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . 0.805 ' CB ' HD11 ' A' ' 125' ' ' LEU . 0.3 OUTLIER 41.4 93.43 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.193 -0.458 . . . . 41.549999999999997 110.86 -179.773 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 63' ' ' SER . . . . . 0.423 ' N ' HE21 ' A' ' 87' ' ' GLN . 16.1 t -124.5 124.02 41.38 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.112 -0.495 . . . . 73.140000000000001 110.835 -179.831 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 64' ' ' ILE . . . . . . . . . . . . . 14.5 mt -138.34 146.06 27.37 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 116.124 -0.489 . . . . 73.0 111.155 179.889 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 62.1 m -110.32 113.69 26.55 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.162 -0.472 . . . . 73.439999999999998 111.159 179.996 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . 0.636 HD21 HG21 ' A' ' 121' ' ' THR . 0.4 OUTLIER -91.75 112.24 24.08 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.267 -0.424 . . . . 63.030000000000001 110.92 179.955 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 5.1 t60 -105.27 109.87 22.02 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.203 -0.453 . . . . 74.530000000000001 110.872 179.841 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 68' ' ' PHE . . . . . 0.501 ' HA ' HD13 ' A' ' 81' ' ' ILE . 0.0 OUTLIER -103.75 140.12 38.05 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.208 -0.451 . . . . 71.430000000000007 110.871 -179.916 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -119.3 129.36 54.84 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.159 -0.473 . . . . 43.32 111.093 179.921 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 70' ' ' MET . . . . . 0.794 ' HE3' HD11 ' A' ' 114' ' ' ILE . 17.8 mmt -91.35 95.7 10.14 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.22 -0.445 . . . . 61.43 110.845 -179.993 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -51.61 159.96 1.14 Allowed Pre-proline 0 C--N 1.329 -0.295 0 CA-C-O 121.578 0.704 . . . . 63.030000000000001 111.129 -179.91 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 72' ' ' PRO . . . . . 0.71 ' O ' HD13 ' A' ' 8' ' ' LEU . 53.8 Cg_endo -69.8 3.29 2.88 Favored 'Trans proline' 0 C--N 1.341 0.163 0 C-N-CA 122.705 2.27 . . . . 75.319999999999993 112.362 179.944 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 73' ' ' MET . . . . . 0.514 ' HB3' HG23 ' A' ' 77' ' ' THR . 0.1 OUTLIER -119.73 -25.78 5.83 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.182 -0.463 . . . . 72.439999999999998 110.921 179.911 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 74' ' ' TYR . . . . . 0.651 ' CD1' ' C ' ' A' ' 74' ' ' TYR . 0.0 OUTLIER -48.37 149.59 2.69 Favored Pre-proline 0 C--N 1.329 -0.305 0 CA-C-O 121.692 0.758 . . . . 65.439999999999998 110.987 -179.909 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 75' ' ' PRO . . . . . 0.536 ' C ' ' HA ' ' A' ' 74' ' ' TYR . 53.6 Cg_endo -69.84 -13.0 12.51 Favored 'Cis proline' 0 C--O 1.232 0.184 0 C-N-CA 122.688 -1.797 . . . . 43.539999999999999 112.341 0.059 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 76' ' ' TYR . . . . . 0.489 ' CB ' ' O ' ' A' ' 73' ' ' MET . 1.5 t80 -34.89 -48.48 0.4 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.232 -0.44 . . . . 73.409999999999997 110.91 -179.917 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 77' ' ' THR . . . . . 0.514 HG23 ' HB3' ' A' ' 73' ' ' MET . 69.6 p -108.2 169.92 8.33 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.119 -0.491 . . . . 75.120000000000005 111.168 -179.985 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -89.59 129.81 45.64 Favored Pre-proline 0 C--N 1.33 -0.282 0 CA-C-O 121.57 0.7 . . . . 44.539999999999999 111.121 179.858 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 79' ' ' PRO . . . . . 0.778 ' HG3' HD11 ' A' ' 113' ' ' ILE . 53.6 Cg_endo -69.77 179.38 3.74 Favored 'Trans proline' 0 C--N 1.341 0.163 0 C-N-CA 122.643 2.229 . . . . 63.109999999999999 112.355 -179.989 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -117.1 137.13 52.49 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.219 -0.446 . . . . 73.040000000000006 110.846 -179.921 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 81' ' ' ILE . . . . . 0.501 HD13 ' HA ' ' A' ' 68' ' ' PHE . 5.2 mm -125.45 144.21 36.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.164 -0.471 . . . . 74.310000000000002 111.139 179.964 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . 0.473 ' HG3' ' CD ' ' A' ' 84' ' ' LYS . 3.0 pt-20 -145.48 141.25 28.16 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.175 -0.466 . . . . 75.040000000000006 110.901 179.985 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 83' ' ' PHE . . . . . 0.636 ' CG ' HD22 ' A' ' 94' ' ' LEU . 7.5 m-85 -96.97 141.02 30.64 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.196 -0.456 . . . . 65.099999999999994 110.886 -179.916 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 84' ' ' LYS . . . . . 0.473 ' CD ' ' HG3' ' A' ' 82' ' ' GLU . 5.1 mmmt -125.45 172.22 9.84 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.124 -0.489 . . . . 72.109999999999999 110.9 179.952 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . 0.4 ' C ' ' CG2' ' A' ' 86' ' ' VAL . 2.4 m-80 61.48 -75.24 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.222 -0.445 . . . . 65.319999999999993 110.865 179.939 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 86' ' ' VAL . . . . . 1.012 HG11 HD11 ' A' ' 94' ' ' LEU . 2.4 m 39.96 92.63 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.233 -0.44 . . . . 74.409999999999997 111.125 179.916 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 87' ' ' GLN . . . . . 0.423 HE21 ' N ' ' A' ' 63' ' ' SER . 0.6 OUTLIER -97.06 -87.43 0.31 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.147 -0.478 . . . . 63.039999999999999 110.938 -179.992 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 88' ' ' ASN . . . . . 0.741 HD22 HG11 ' A' ' 60' ' ' VAL . 0.3 OUTLIER -47.93 -51.25 24.15 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.199 -0.455 . . . . 74.430000000000007 110.897 -179.985 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 89' ' ' VAL . . . . . 0.694 HG21 ' HG ' ' A' ' 94' ' ' LEU . 1.2 p -59.53 135.2 24.34 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.187 -0.461 . . . . 75.109999999999999 111.123 179.903 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 90' ' ' MET . . . . . . . . . . . . . 4.7 mtm -86.87 -60.82 1.88 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.168 -0.469 . . . . 73.219999999999999 110.882 179.925 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 3.5 p-10 179.41 -32.1 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.198 -0.455 . . . . 74.140000000000001 110.858 179.961 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 99.8 p -54.6 -45.35 73.63 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.2 -0.455 . . . . 75.329999999999998 110.832 -179.773 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 93' ' ' GLN . . . . . 0.645 ' CD ' ' CD1' ' A' ' 128' ' ' PHE . 1.2 mt-30 -70.2 -38.09 75.25 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.14 -0.482 . . . . 70.340000000000003 110.894 -179.947 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . 1.012 HD11 HG11 ' A' ' 86' ' ' VAL . 29.2 mt -58.84 -47.77 83.68 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.217 -0.447 . . . . 72.510000000000005 110.91 -179.986 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 28.4 mt-30 -62.78 -34.1 76.56 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.168 -0.469 . . . . 74.310000000000002 110.952 179.919 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 96' ' ' MET . . . . . . . . . . . . . 43.5 ttp -60.47 -37.27 80.48 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.199 -0.455 . . . . 63.43 110.86 179.941 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 97' ' ' LEU . . . . . 0.984 HD22 HG22 ' A' ' 121' ' ' THR . 80.4 mt -61.41 -46.57 89.57 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.223 -0.444 . . . . 73.230000000000004 110.891 -179.97 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 98' ' ' LYS . . . . . 0.528 ' HD3' ' CZ ' ' A' ' 83' ' ' PHE . 3.9 mmtp -58.12 -34.16 69.92 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.204 -0.453 . . . . 70.239999999999995 110.87 179.896 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 1.4 t -69.68 -46.29 66.4 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.207 -0.452 . . . . 71.0 110.822 -179.887 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 100' ' ' GLU . . . . . 0.67 ' O ' HD12 ' A' ' 104' ' ' ILE . 7.7 pt-20 -72.38 -23.88 61.18 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.145 -0.48 . . . . 71.319999999999993 110.926 -179.973 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 101' ' ' PHE . . . . . 0.611 ' CD1' ' O ' ' A' ' 97' ' ' LEU . 10.1 m-30 -59.42 -22.9 62.14 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.121 -0.49 . . . . 63.299999999999997 110.886 -179.93 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.46 -45.38 59.78 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.155 -0.475 . . . . 74.030000000000001 110.858 -179.999 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 24.6 mtmm -63.24 -38.8 92.57 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.189 -0.46 . . . . 55.130000000000003 110.869 179.922 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 104' ' ' ILE . . . . . 0.716 HD11 ' CD2' ' A' ' 120' ' ' PHE . 1.6 mp -63.08 -47.63 91.66 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.218 -0.446 . . . . 73.540000000000006 111.108 179.876 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 105' ' ' HIS . . . . . . . . . . . . . 9.3 t-80 -63.12 -41.88 99.43 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.201 -0.454 . . . . 73.439999999999998 110.866 179.867 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -56.73 -43.39 80.6 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.21 -0.45 . . . . 72.209999999999994 110.9 -179.929 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 107' ' ' THR . . . . . 0.411 HG22 ' O ' ' A' ' 104' ' ' ILE . 7.6 t -77.73 -22.39 50.44 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.185 -0.461 . . . . 71.010000000000005 111.162 -179.983 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 108' ' ' SER . . . . . 0.584 ' HB3' HG22 ' A' ' 113' ' ' ILE . 1.7 m -118.3 35.46 4.75 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.197 -0.456 . . . . 73.430000000000007 110.862 -179.851 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 14.4 ttt180 -75.87 88.41 2.88 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.163 -0.471 . . . . 70.099999999999994 110.85 -179.919 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 123.33 32.85 0.87 Allowed Glycine 0 N--CA 1.45 -0.369 0 C-N-CA 120.754 -0.736 . . . . 51.409999999999997 112.49 179.987 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 111' ' ' GLN . . . . . . . . . . . . . 3.4 pt20 -169.28 -162.98 0.38 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.794 0.331 . . . . 71.420000000000002 110.878 -179.888 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 35.3 mt-10 -65.9 127.1 30.7 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.162 -0.472 . . . . 74.129999999999995 110.833 -179.896 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 113' ' ' ILE . . . . . 0.778 HD11 ' HG3' ' A' ' 79' ' ' PRO . 7.4 pt -126.35 -8.35 5.1 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 116.122 -0.49 . . . . 61.240000000000002 111.13 179.947 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 114' ' ' ILE . . . . . 0.883 ' H ' HD12 ' A' ' 114' ' ' ILE . 3.6 mp -67.73 -46.77 81.92 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.174 -0.466 . . . . 73.230000000000004 111.114 179.873 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 115' ' ' PHE . . . . . 0.722 ' HE1' HG21 ' A' ' 25' ' ' ILE . 28.1 t80 -68.28 -36.42 79.37 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.157 -0.474 . . . . 72.420000000000002 110.852 -179.979 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 53.4 mm-40 -67.54 -45.79 74.68 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.139 -0.482 . . . . 71.540000000000006 110.911 -179.945 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 117' ' ' ILE . . . . . 0.532 HD11 ' CG ' ' A' ' 101' ' ' PHE . 0.4 OUTLIER -67.15 -40.41 85.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.111 -0.495 . . . . 74.200000000000003 111.141 179.983 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 118' ' ' THR . . . . . 0.802 HG23 ' O ' ' A' ' 114' ' ' ILE . 62.1 p -68.35 -43.43 77.49 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.156 -0.475 . . . . 44.140000000000001 111.114 179.956 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -64.9 -43.89 91.39 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.26 -0.427 . . . . 51.009999999999998 110.829 -179.824 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 120' ' ' PHE . . . . . 0.716 ' CD2' HD11 ' A' ' 104' ' ' ILE . 0.1 OUTLIER -60.86 -48.58 81.15 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.13 -0.486 . . . . 74.239999999999995 110.904 -179.961 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 121' ' ' THR . . . . . 0.984 HG22 HD22 ' A' ' 97' ' ' LEU . 29.5 p -64.52 -40.31 95.39 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.128 -0.487 . . . . 63.229999999999997 111.145 -179.949 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 16.1 tt0 -60.17 -38.14 82.28 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.211 -0.449 . . . . 71.230000000000004 110.955 179.985 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 123' ' ' GLU . . . . . 0.515 ' C ' ' CD ' ' A' ' 123' ' ' GLU . 0.1 OUTLIER -77.87 -46.38 21.55 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.156 -0.475 . . . . 74.319999999999993 110.947 179.986 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.4 -34.1 77.39 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.127 -0.488 . . . . 74.319999999999993 110.889 179.96 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 125' ' ' LEU . . . . . 0.805 HD11 ' CB ' ' A' ' 62' ' ' SER . 1.8 tp -68.96 -43.37 75.14 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.236 -0.438 . . . . 63.43 110.925 179.926 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -68.12 -36.95 80.55 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.139 -0.482 . . . . 74.530000000000001 110.885 179.863 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 127' ' ' GLU . . . . . 0.42 ' HG3' ' N ' ' A' ' 128' ' ' PHE . 0.0 OUTLIER -62.39 -28.76 70.0 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.155 -0.475 . . . . 70.140000000000001 110.906 -179.947 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 128' ' ' PHE . . . . . 0.645 ' CD1' ' CD ' ' A' ' 93' ' ' GLN . 0.2 OUTLIER -77.07 -31.26 55.92 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.143 -0.48 . . . . 65.540000000000006 110.907 -179.918 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 129' ' ' GLN . . . . . 0.538 ' CG ' ' CG2' ' A' ' 60' ' ' VAL . 0.3 OUTLIER -100.65 32.84 2.96 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.138 -0.483 . . . . 75.409999999999997 110.909 180.0 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 130' ' ' ASN . . . . . . . . . . . . . 1.7 t-20 -101.07 -39.61 7.62 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.208 -0.451 . . . . 73.430000000000007 110.902 -179.984 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 131' ' ' VAL . . . . . 0.625 ' O ' HG23 ' A' ' 131' ' ' VAL . 26.3 m -134.39 93.78 1.43 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.156 -0.475 . . . . 72.200000000000003 111.146 179.887 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 132' ' ' VAL . . . . . . . . . . . . . 94.8 t -92.74 127.2 45.02 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.14 -0.482 . . . . 73.340000000000003 111.137 179.911 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 133' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -139.91 30.2 2.05 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.212 -0.449 . . . . 72.239999999999995 110.864 179.961 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 134' ' ' THR . . . . . . . . . . . . . 34.7 p -126.45 156.0 41.33 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.207 -0.451 . . . . 44.0 111.143 -179.999 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -89.17 111.89 22.77 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.18 -0.463 . . . . 74.329999999999998 110.894 -179.967 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 3.4 m -137.23 124.45 21.76 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.214 -0.448 . . . . 64.030000000000001 110.808 -179.792 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 137' ' ' LEU . . . . . . . . . . . . . 15.4 tp -168.21 -49.15 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.125 -0.489 . . . . 75.409999999999997 110.927 -179.983 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.329 -0.283 0 CA-C-N 116.113 -0.494 . . . . 60.229999999999997 110.858 179.956 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.23 0.062 0 CA-C-O 120.798 0.332 . . . . 72.030000000000001 110.871 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -120.25 133.78 55.4 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.215 -0.448 . . . . 72.239999999999995 110.892 -179.815 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER 177.19 125.14 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.162 -0.472 . . . . 53.409999999999997 110.903 -179.97 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 12.4 p -108.7 51.18 0.75 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.166 -0.47 . . . . 74.310000000000002 110.806 -179.9 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 1.1 t-160 -140.06 82.55 1.87 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.157 -0.474 . . . . 73.439999999999998 110.867 179.986 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER 38.9 89.08 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.258 -0.428 . . . . 62.530000000000001 110.945 -179.967 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -134.79 169.39 17.43 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.22 -0.446 . . . . 74.430000000000007 111.115 179.945 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.416 HD13 ' O ' ' A' ' 72' ' ' PRO . 16.6 mt -58.34 -26.78 63.5 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.175 -0.466 . . . . 74.530000000000001 110.926 179.987 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -51.4 -32.02 24.8 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.181 -0.463 . . . . 73.540000000000006 110.885 179.802 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 11.4 mm-40 -68.4 -40.32 81.35 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.185 -0.462 . . . . 72.450000000000003 110.896 -179.906 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 10.4 m-85 -49.37 -23.32 1.42 Allowed 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.229 -0.441 . . . . 74.25 110.896 -179.85 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 9.1 m-85 -57.72 -36.34 71.88 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.158 -0.474 . . . . 73.120000000000005 110.958 -179.919 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . 0.601 ' CG ' HD12 ' A' ' 14' ' ' ILE . 11.9 pt-20 -60.97 -43.55 98.6 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.068 -0.514 . . . . 74.230000000000004 110.868 -179.965 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . 0.601 HD12 ' CG ' ' A' ' 13' ' ' GLU . 2.8 mp -68.15 -43.32 85.11 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.179 -0.464 . . . . 74.049999999999997 111.19 179.932 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . 0.473 ' HG2' ' CB ' ' A' ' 70' ' ' MET . 20.4 mt-30 -63.16 -45.74 90.44 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.118 -0.492 . . . . 54.340000000000003 110.931 179.928 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 16.1 t -58.86 -41.59 87.38 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.224 -0.444 . . . . 64.219999999999999 110.869 -179.934 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 4.8 m-20 -63.15 -34.02 76.71 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.191 -0.459 . . . . 73.040000000000006 110.87 -179.917 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . 0.415 ' N ' ' OE1' ' A' ' 18' ' ' GLU . 0.0 OUTLIER -66.22 -38.99 89.25 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.193 -0.458 . . . . 61.100000000000001 110.89 -179.994 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.726 HD11 HG13 ' A' ' 46' ' ' ILE . 6.0 mt -60.79 -51.64 68.48 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.18 -0.463 . . . . 61.130000000000003 110.883 -179.968 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 4.8 pt-20 -68.74 -38.15 79.93 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.227 -0.442 . . . . 52.420000000000002 110.863 179.943 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -58.63 -50.54 73.47 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.154 -0.475 . . . . 62.130000000000003 111.084 179.977 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . 0.577 ' HA ' HD12 ' A' ' 25' ' ' ILE . 0.7 OUTLIER -75.49 -35.83 33.45 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.218 -0.446 . . . . 74.209999999999994 111.115 179.984 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 7.2 mtp180 -52.55 -34.25 49.28 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.178 -0.464 . . . . 72.450000000000003 110.873 179.981 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -66.39 -34.55 78.21 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.183 -0.462 . . . . 74.049999999999997 110.831 -179.816 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . 0.9 HD13 ' CE1' ' A' ' 115' ' ' PHE . 3.7 mt -79.92 -45.34 22.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.178 -0.465 . . . . 61.109999999999999 111.117 179.977 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 34.9 m-85 -109.78 45.38 1.1 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.177 -0.465 . . . . 63.409999999999997 110.974 -179.989 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' MET . . . . . 0.417 ' HE2' ' H ' ' A' ' 27' ' ' MET . 0.4 OUTLIER -39.68 -55.6 1.86 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.103 -0.499 . . . . 72.319999999999993 110.882 179.921 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -95.28 -14.69 23.76 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.252 -0.431 . . . . 72.319999999999993 110.88 179.945 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 4.4 m-20 -92.75 31.01 1.44 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.185 -0.461 . . . . 72.409999999999997 110.897 179.997 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' PHE . . . . . 0.519 ' C ' ' CD1' ' A' ' 30' ' ' PHE . 2.0 t80 -120.39 142.26 49.35 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.163 -0.471 . . . . 74.510000000000005 110.846 -179.881 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . 0.45 ' N ' ' CD1' ' A' ' 30' ' ' PHE . 18.2 m -119.01 129.38 55.1 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.16 -0.473 . . . . 74.439999999999998 111.148 -179.925 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 10.2 t0 -89.27 113.6 24.87 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.206 -0.452 . . . . 70.120000000000005 110.883 179.902 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.991 HD21 HG12 ' A' ' 47' ' ' ILE . 0.4 OUTLIER -120.19 -28.92 4.98 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.159 -0.473 . . . . 63.340000000000003 110.891 -179.962 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . 0.934 ' N ' HD23 ' A' ' 33' ' ' LEU . 5.2 m -40.38 139.42 0.76 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.231 -0.441 . . . . 72.530000000000001 111.166 179.957 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -81.96 49.8 1.44 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.237 -0.438 . . . . 74.439999999999998 110.862 179.981 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . 0.533 ' HG2' HG22 ' A' ' 34' ' ' THR . 4.8 mmm180 -79.93 131.64 35.88 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.228 -0.442 . . . . 75.340000000000003 110.891 179.986 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER 38.41 66.2 0.53 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.176 -0.465 . . . . 65.140000000000001 110.901 179.975 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 1.2 m -135.85 156.35 48.92 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.219 -0.446 . . . . 75.310000000000002 110.827 -179.901 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . 0.441 ' O ' ' HB3' ' A' ' 40' ' ' TRP . 21.1 m -82.79 174.77 10.66 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.106 -0.497 . . . . 55.140000000000001 110.883 -179.838 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 40' ' ' TRP . . . . . 0.594 ' O ' ' CE3' ' A' ' 40' ' ' TRP . 0.0 OUTLIER 78.41 -32.48 0.16 Allowed 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.175 -0.466 . . . . 65.120000000000005 110.939 -179.978 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . 0.558 ' HB2' ' CD2' ' A' ' 40' ' ' TRP . 0.7 OUTLIER 173.54 154.54 0.1 Allowed 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.248 -0.433 . . . . 53.130000000000003 110.887 179.933 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 8.1 mttt -135.58 67.34 1.48 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.183 -0.462 . . . . 74.099999999999994 110.914 179.99 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -119.24 62.25 6.2 Favored Pre-proline 0 C--N 1.329 -0.283 0 CA-C-O 121.608 0.718 . . . . 62.229999999999997 110.888 -179.995 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.72 162.56 41.57 Favored 'Trans proline' 0 C--N 1.341 0.178 0 C-N-CA 122.698 2.266 . . . . 75.329999999999998 112.346 179.995 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 45' ' ' GLN . . . . . 0.519 ' O ' ' CG ' ' A' ' 45' ' ' GLN . 7.3 tt0 -140.26 11.56 2.36 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.219 -0.446 . . . . 62.149999999999999 110.921 -179.999 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . 0.726 HG13 HD11 ' A' ' 19' ' ' LEU . 0.0 OUTLIER 82.81 -28.1 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.215 -0.448 . . . . 72.049999999999997 111.118 179.952 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . 0.991 HG12 HD21 ' A' ' 33' ' ' LEU . 0.2 OUTLIER -37.97 150.42 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.147 -0.479 . . . . 54.210000000000001 111.129 179.877 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 48' ' ' PHE . . . . . 0.733 ' HA ' HD22 ' A' ' 33' ' ' LEU . 1.6 p90 -152.35 157.93 41.99 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.187 -0.46 . . . . 64.420000000000002 110.902 179.967 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . 0.678 ' HG3' HD13 ' A' ' 33' ' ' LEU . 7.1 mt-10 -108.76 147.43 32.03 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.164 -0.471 . . . . 55.439999999999998 110.886 -179.939 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . 0.417 HD13 ' HA ' ' A' ' 30' ' ' PHE . 10.8 mm -129.32 135.23 62.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.172 -0.467 . . . . 71.519999999999996 111.132 179.955 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 98.4 m -84.27 132.16 34.66 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.174 -0.466 . . . . 62.210000000000001 111.134 179.945 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . 0.717 HD12 HD12 ' A' ' 66' ' ' LEU . 19.8 mt -132.83 157.04 46.01 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.18 -0.464 . . . . 63.409999999999997 110.88 179.983 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 53' ' ' ARG . . . . . 0.741 ' C ' HD21 ' A' ' 125' ' ' LEU . 0.0 OUTLIER -178.64 166.02 1.71 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.219 -0.446 . . . . 74.510000000000005 110.921 179.952 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . 0.853 ' CA ' HD11 ' A' ' 125' ' ' LEU . 0.4 OUTLIER -62.63 -176.53 0.11 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.223 -0.444 . . . . 53.439999999999998 110.859 -179.765 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 18.5 m -99.08 -24.08 4.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.147 -0.479 . . . . 61.450000000000003 111.096 -179.991 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -112.92 -171.03 1.79 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.196 -0.456 . . . . 54.509999999999998 110.925 179.902 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 6.0 mmmm -119.33 -18.92 8.46 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.234 -0.439 . . . . 73.120000000000005 110.874 179.989 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . 0.56 ' HA ' ' C ' ' A' ' 59' ' ' PRO . 11.2 pt-20 -115.97 143.27 30.53 Favored Pre-proline 0 C--N 1.329 -0.315 0 CA-C-O 121.599 0.714 . . . . 73.409999999999997 110.898 179.939 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 59' ' ' PRO . . . . . 0.56 ' C ' ' HA ' ' A' ' 58' ' ' GLU . 54.0 Cg_endo -69.67 -9.23 10.74 Favored 'Cis proline' 0 C--O 1.232 0.205 0 C-N-CA 122.746 -1.772 . . . . 73.120000000000005 112.355 -0.051 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 60' ' ' VAL . . . . . 0.502 HG22 ' CG ' ' A' ' 129' ' ' GLN . 11.9 m -152.13 -176.29 0.25 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.215 -0.448 . . . . 51.030000000000001 111.129 179.945 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . 0.457 ' O ' ' C ' ' A' ' 62' ' ' SER . 11.7 tt0 -113.24 -11.95 13.16 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.166 -0.47 . . . . 74.439999999999998 110.898 -179.977 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . 0.836 ' HB3' HD13 ' A' ' 125' ' ' LEU . 0.1 OUTLIER 33.16 90.56 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.122 -0.49 . . . . 70.400000000000006 110.846 -179.794 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 32.3 t -109.53 124.73 51.58 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.11 -0.495 . . . . 63.25 110.876 -179.849 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 64' ' ' ILE . . . . . 0.513 HD11 HG21 ' A' ' 89' ' ' VAL . 14.5 mt -139.71 150.72 22.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.144 -0.48 . . . . 73.510000000000005 111.115 179.998 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 90.7 m -120.9 114.47 21.62 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.182 -0.463 . . . . 53.240000000000002 111.123 179.957 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . 0.992 HD11 HG21 ' A' ' 121' ' ' THR . 17.5 mt -93.81 116.49 28.96 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.224 -0.444 . . . . 72.349999999999994 110.923 179.914 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 7.2 t60 -103.98 115.44 30.45 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.223 -0.444 . . . . 73.540000000000006 110.817 179.883 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 68' ' ' PHE . . . . . 0.614 ' HA ' HD13 ' A' ' 81' ' ' ILE . 0.0 OUTLIER -103.86 139.75 38.62 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.183 -0.462 . . . . 74.439999999999998 110.889 -179.923 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . 0.597 ' HA ' HG22 ' A' ' 47' ' ' ILE . . . -120.44 114.93 22.53 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.125 -0.489 . . . . 62.439999999999998 111.108 179.906 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 70' ' ' MET . . . . . 0.473 ' CB ' ' HG2' ' A' ' 15' ' ' GLN . 1.0 OUTLIER -81.59 95.38 7.14 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.203 -0.453 . . . . 72.340000000000003 110.929 179.929 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -51.36 161.49 0.78 Allowed Pre-proline 0 C--N 1.329 -0.295 0 CA-C-O 121.602 0.715 . . . . 61.509999999999998 111.134 -179.89 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 72' ' ' PRO . . . . . 0.416 ' O ' HD13 ' A' ' 8' ' ' LEU . 53.0 Cg_endo -69.75 -15.09 36.97 Favored 'Trans proline' 0 C--N 1.341 0.158 0 C-N-CA 122.694 2.263 . . . . 63.350000000000001 112.316 179.991 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 73' ' ' MET . . . . . 0.57 ' HB3' HG23 ' A' ' 77' ' ' THR . 0.0 OUTLIER -101.38 -20.68 15.07 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.211 -0.45 . . . . 71.219999999999999 110.889 179.876 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 74' ' ' TYR . . . . . 0.668 ' CD1' ' C ' ' A' ' 74' ' ' TYR . 0.0 OUTLIER -50.72 152.42 3.5 Favored Pre-proline 0 C--N 1.328 -0.356 0 CA-C-O 121.654 0.74 . . . . 62.509999999999998 110.913 -179.899 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 75' ' ' PRO . . . . . 0.548 ' C ' ' HA ' ' A' ' 74' ' ' TYR . 54.1 Cg_endo -69.75 -11.37 11.87 Favored 'Cis proline' 0 C--O 1.231 0.169 0 C-N-CA 122.684 -1.798 . . . . 62.229999999999997 112.334 -0.033 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 76' ' ' TYR . . . . . 0.501 ' CB ' ' O ' ' A' ' 73' ' ' MET . 2.3 t80 -34.06 -56.77 0.48 Allowed 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.175 -0.466 . . . . 61.5 110.927 -179.895 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 77' ' ' THR . . . . . 0.57 HG23 ' HB3' ' A' ' 73' ' ' MET . 37.6 p -99.46 167.48 10.59 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.117 -0.492 . . . . 75.5 111.14 -179.969 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -89.03 129.93 46.36 Favored Pre-proline 0 C--N 1.329 -0.288 0 CA-C-O 121.576 0.703 . . . . 71.019999999999996 111.096 179.864 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 79' ' ' PRO . . . . . 0.765 ' HG3' HD11 ' A' ' 113' ' ' ILE . 53.4 Cg_endo -69.75 -176.59 1.53 Allowed 'Trans proline' 0 C--N 1.341 0.172 0 C-N-CA 122.695 2.263 . . . . 73.219999999999999 112.365 179.984 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . 0.585 ' O ' HD13 ' A' ' 81' ' ' ILE . 2.8 tt0 -114.55 141.16 48.1 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.223 -0.444 . . . . 51.409999999999997 110.912 -179.974 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 81' ' ' ILE . . . . . 0.614 HD13 ' HA ' ' A' ' 68' ' ' PHE . 17.4 mm -133.44 140.88 45.86 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.17 -0.468 . . . . 73.5 111.111 -179.979 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . 0.478 ' HG3' ' CD ' ' A' ' 84' ' ' LYS . 5.9 pt-20 -149.08 145.76 27.39 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.185 -0.461 . . . . 72.420000000000002 110.883 179.95 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 83' ' ' PHE . . . . . 0.917 ' CE1' HD21 ' A' ' 66' ' ' LEU . 26.5 m-85 -97.65 142.14 29.82 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.196 -0.457 . . . . 60.530000000000001 110.896 -179.946 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 84' ' ' LYS . . . . . 0.478 ' CD ' ' HG3' ' A' ' 82' ' ' GLU . 5.1 mmmt -126.92 173.65 9.44 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.167 -0.469 . . . . 75.510000000000005 110.872 179.975 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . 0.464 ' O ' ' C ' ' A' ' 86' ' ' VAL . 1.7 m-80 63.29 -72.67 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.175 -0.466 . . . . 72.200000000000003 110.857 179.942 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 86' ' ' VAL . . . . . 0.568 HG23 ' O ' ' A' ' 86' ' ' VAL . 16.6 m 32.13 90.99 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.192 -0.458 . . . . 71.109999999999999 111.125 179.924 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -95.51 -74.14 0.56 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.167 -0.469 . . . . 50.219999999999999 110.91 -179.988 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 88' ' ' ASN . . . . . 0.479 ' ND2' ' HB ' ' A' ' 60' ' ' VAL . 62.4 m-80 -78.61 45.48 0.59 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.204 -0.453 . . . . 53.149999999999999 110.881 -179.974 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 89' ' ' VAL . . . . . 0.716 HG11 ' HG ' ' A' ' 94' ' ' LEU . 42.2 t -135.28 140.12 45.55 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.17 -0.468 . . . . 74.140000000000001 111.134 179.914 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 90' ' ' MET . . . . . 0.457 ' O ' ' CB ' ' A' ' 91' ' ' ASP . 22.0 mtm -92.1 -62.0 1.5 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.167 -0.469 . . . . 41.119999999999997 110.839 179.968 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 91' ' ' ASP . . . . . 0.457 ' CB ' ' O ' ' A' ' 90' ' ' MET . 0.4 OUTLIER 163.0 -22.15 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.226 -0.443 . . . . 75.140000000000001 110.857 179.968 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -62.9 -47.18 84.42 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.199 -0.455 . . . . 74.230000000000004 110.887 -179.789 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 93' ' ' GLN . . . . . 0.516 ' CG ' HG13 ' A' ' 89' ' ' VAL . 3.8 pm0 -71.26 -36.41 71.75 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.132 -0.485 . . . . 65.129999999999995 110.896 -179.945 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . 0.716 ' HG ' HG11 ' A' ' 89' ' ' VAL . 31.7 mt -58.0 -48.96 78.47 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.191 -0.458 . . . . 74.219999999999999 110.887 -179.97 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 2.4 mm-40 -65.79 -33.57 76.16 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.204 -0.453 . . . . 74.049999999999997 110.871 179.972 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 96' ' ' MET . . . . . . . . . . . . . 6.1 ttp -59.61 -36.65 76.74 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.222 -0.444 . . . . 73.25 110.898 179.954 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 97' ' ' LEU . . . . . 0.997 HD13 HG22 ' A' ' 121' ' ' THR . 61.2 mt -66.5 -43.63 84.82 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.201 -0.454 . . . . 73.109999999999999 110.899 -179.99 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 98' ' ' LYS . . . . . 0.431 ' HA ' ' CD2' ' A' ' 101' ' ' PHE . 8.5 mmtp -55.44 -37.1 67.26 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.239 -0.437 . . . . 72.409999999999997 110.897 179.823 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 8.9 m -62.4 -43.61 98.41 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.198 -0.455 . . . . 75.109999999999999 110.872 -179.873 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 100' ' ' GLU . . . . . 0.559 ' O ' HD12 ' A' ' 104' ' ' ILE . 5.7 mm-40 -71.01 -24.95 62.47 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.11 -0.496 . . . . 63.119999999999997 110.863 -179.96 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 101' ' ' PHE . . . . . 0.593 ' CD1' ' O ' ' A' ' 97' ' ' LEU . 9.0 m-30 -59.62 -40.84 88.92 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.167 -0.469 . . . . 74.439999999999998 110.912 -179.909 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -63.11 -40.26 97.1 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.122 -0.49 . . . . 63.329999999999998 110.882 179.992 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 14.7 ttpt -67.94 -36.5 80.22 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.25 -0.432 . . . . 55.109999999999999 110.901 179.847 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 104' ' ' ILE . . . . . 0.559 HD12 ' O ' ' A' ' 100' ' ' GLU . 3.8 mt -67.35 -47.6 80.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.208 -0.451 . . . . 74.340000000000003 111.115 179.895 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 105' ' ' HIS . . . . . . . . . . . . . 14.8 t60 -62.92 -42.19 99.71 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.161 -0.472 . . . . 73.349999999999994 110.881 179.868 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -57.96 -38.28 75.71 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.206 -0.452 . . . . 72.129999999999995 110.94 -179.966 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 8.9 t -88.15 -23.25 23.69 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.161 -0.472 . . . . 70.420000000000002 111.166 -179.992 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 108' ' ' SER . . . . . 0.638 ' HB3' HG22 ' A' ' 113' ' ' ILE . 13.4 m -114.59 41.01 2.43 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.174 -0.466 . . . . 55.240000000000002 110.898 -179.897 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 13.7 ttt180 -88.8 90.73 8.54 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.124 -0.489 . . . . 72.319999999999993 110.856 -179.914 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 140.09 -6.16 2.8 Favored Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.754 -0.736 . . . . 74.230000000000004 112.495 -179.966 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 111' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -136.11 -152.59 0.46 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.757 0.313 . . . . 74.129999999999995 110.919 -179.944 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 112' ' ' GLU . . . . . 0.405 ' HG2' ' CD ' ' A' ' 18' ' ' GLU . 11.9 mt-10 -79.8 132.3 36.1 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.197 -0.456 . . . . 65.129999999999995 110.921 -179.956 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 113' ' ' ILE . . . . . 0.765 HD11 ' HG3' ' A' ' 79' ' ' PRO . 9.8 pt -126.27 -12.33 4.54 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 116.157 -0.474 . . . . 53.109999999999999 111.127 179.99 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 114' ' ' ILE . . . . . 0.778 ' O ' HG23 ' A' ' 118' ' ' THR . 1.3 mp -63.05 -39.66 86.06 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.195 -0.457 . . . . 74.140000000000001 111.14 179.85 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 115' ' ' PHE . . . . . 0.9 ' CE1' HD13 ' A' ' 25' ' ' ILE . 40.9 t80 -70.96 -38.72 72.81 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.179 -0.464 . . . . 75.310000000000002 110.848 179.976 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 54.9 mm-40 -65.41 -44.04 88.65 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.128 -0.487 . . . . 63.140000000000001 110.849 -179.867 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 117' ' ' ILE . . . . . 0.467 HD11 ' CG ' ' A' ' 101' ' ' PHE . 0.4 OUTLIER -65.14 -40.15 87.89 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.172 -0.467 . . . . 65.140000000000001 111.142 179.965 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 118' ' ' THR . . . . . 0.778 HG23 ' O ' ' A' ' 114' ' ' ILE . 58.7 p -67.62 -42.9 81.62 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.176 -0.465 . . . . 74.540000000000006 111.157 179.974 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 119' ' ' SER . . . . . 0.417 ' HA ' ' CG ' ' A' ' 122' ' ' GLN . 0.7 OUTLIER -67.44 -31.41 71.57 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.238 -0.437 . . . . 72.329999999999998 110.864 -179.891 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 120' ' ' PHE . . . . . 0.447 ' O ' ' HG2' ' A' ' 123' ' ' GLU . 0.3 OUTLIER -77.65 -38.74 47.12 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.128 -0.487 . . . . 64.510000000000005 110.888 -179.941 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 121' ' ' THR . . . . . 0.997 HG22 HD13 ' A' ' 97' ' ' LEU . 9.7 p -71.64 -42.21 67.86 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.154 -0.476 . . . . 72.150000000000006 111.173 -179.948 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 122' ' ' GLN . . . . . 0.417 ' CG ' ' HA ' ' A' ' 119' ' ' SER . 1.1 pp0? -66.21 -41.08 90.62 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.229 -0.441 . . . . 72.540000000000006 110.93 179.953 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 123' ' ' GLU . . . . . 0.447 ' HG2' ' O ' ' A' ' 120' ' ' PHE . 11.9 pt-20 -68.37 -35.33 77.55 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.214 -0.448 . . . . 74.120000000000005 110.895 -179.915 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 124' ' ' LYS . . . . . 0.44 ' CE ' ' HA ' ' A' ' 124' ' ' LYS . 0.0 OUTLIER -72.16 -44.35 63.2 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.141 -0.481 . . . . 61.439999999999998 110.908 179.958 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 125' ' ' LEU . . . . . 0.853 HD11 ' CA ' ' A' ' 54' ' ' SER . 0.2 OUTLIER -65.18 -40.41 94.24 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.248 -0.433 . . . . 62.340000000000003 110.886 179.918 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -63.63 -45.43 90.28 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.223 -0.444 . . . . 65.25 110.893 179.835 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 127' ' ' GLU . . . . . 0.442 ' HG3' ' N ' ' A' ' 128' ' ' PHE . 0.0 OUTLIER -66.17 -29.3 69.56 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.158 -0.474 . . . . 72.219999999999999 110.896 -179.905 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 128' ' ' PHE . . . . . 0.49 ' CE1' ' HB3' ' A' ' 93' ' ' GLN . 1.8 t80 -61.41 -58.14 9.4 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.131 -0.486 . . . . 75.25 110.889 -179.901 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 129' ' ' GLN . . . . . 0.502 ' CG ' HG22 ' A' ' 60' ' ' VAL . 1.7 mt-30 -49.02 -21.66 0.73 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.139 -0.482 . . . . 65.129999999999995 110.915 -179.982 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 130' ' ' ASN . . . . . . . . . . . . . 1.3 t-20 -82.52 -41.66 19.38 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.183 -0.462 . . . . 74.299999999999997 110.869 -179.926 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 131' ' ' VAL . . . . . 0.497 ' O ' HG23 ' A' ' 131' ' ' VAL . 2.9 m -108.01 24.65 2.88 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.154 -0.476 . . . . 75.530000000000001 111.1 179.944 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 132' ' ' VAL . . . . . 0.513 HG22 ' H ' ' A' ' 134' ' ' THR . 7.3 p -57.5 120.15 3.46 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.186 -0.461 . . . . 71.219999999999999 111.104 179.896 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 133' ' ' ASN . . . . . . . . . . . . . 30.2 m-80 -108.89 36.95 2.68 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.212 -0.449 . . . . 71.430000000000007 110.883 179.95 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 134' ' ' THR . . . . . 0.513 ' H ' HG22 ' A' ' 132' ' ' VAL . 70.1 p -145.87 121.61 10.54 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.191 -0.459 . . . . 73.019999999999996 111.13 -179.973 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 135' ' ' GLN . . . . . 0.412 ' C ' ' O ' ' A' ' 134' ' ' THR . 0.0 OUTLIER -37.08 -38.03 0.18 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.225 -0.443 . . . . 71.010000000000005 110.898 -179.991 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 53.5 p 42.67 48.54 4.79 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.225 -0.443 . . . . 73.010000000000005 110.835 -179.804 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 137' ' ' LEU . . . . . 0.409 ' O ' ' C ' ' A' ' 138' ' ' GLU . 0.0 OUTLIER -105.01 110.31 22.66 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.134 -0.485 . . . . 51.200000000000003 110.915 179.975 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 138' ' ' GLU . . . . . 0.409 ' C ' ' O ' ' A' ' 137' ' ' LEU . 25.4 tt0 . . . . . 0 C--N 1.33 -0.278 0 CA-C-N 116.199 -0.455 . . . . 72.230000000000004 110.903 179.961 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.7 mmm . . . . . 0 C--O 1.231 0.115 0 CA-C-O 120.8 0.333 . . . . 61.229999999999997 110.879 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 6.0 m -135.02 141.22 46.12 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.229 -0.441 . . . . 71.340000000000003 110.869 -179.78 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -110.99 -176.25 2.91 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.128 -0.487 . . . . 74.409999999999997 110.899 -179.985 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 61.1 m -46.59 -64.82 0.67 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.189 -0.46 . . . . 74.109999999999999 110.872 -179.972 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 32.6 m80 -134.79 -63.2 0.71 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.141 -0.481 . . . . 74.129999999999995 110.854 179.966 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 1.1 mp -77.38 121.25 23.52 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.216 -0.447 . . . . 62.240000000000002 110.934 -179.956 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 11.7 t -146.36 158.93 43.94 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.202 -0.454 . . . . 53.210000000000001 111.122 179.98 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.411 HD13 ' O ' ' A' ' 72' ' ' PRO . 20.2 mt -60.22 -30.49 69.43 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.157 -0.474 . . . . 71.209999999999994 110.888 179.974 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -51.25 -25.58 5.88 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.215 -0.448 . . . . 74.299999999999997 110.881 179.847 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . 0.417 ' O ' ' HG2' ' A' ' 13' ' ' GLU . 10.3 mm-40 -67.77 -38.99 84.16 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.221 -0.445 . . . . 75.409999999999997 110.913 -179.941 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 23.9 m-85 -64.51 -22.2 66.9 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.205 -0.452 . . . . 74.040000000000006 110.889 -179.834 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -57.43 -36.25 71.13 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.143 -0.48 . . . . 72.530000000000001 110.871 -179.842 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . 0.481 ' HG3' ' N ' ' A' ' 14' ' ' ILE . 5.6 pt-20 -59.82 -39.91 86.67 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.112 -0.494 . . . . 63.420000000000002 110.888 -179.981 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . 0.481 ' N ' ' HG3' ' A' ' 13' ' ' GLU . 3.7 mp -67.62 -47.47 80.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.178 -0.465 . . . . 73.450000000000003 111.109 179.967 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 46.4 mt-30 -64.56 -44.53 90.44 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.211 -0.45 . . . . 73.530000000000001 110.888 179.988 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 6.3 t -63.61 -41.47 98.3 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.218 -0.446 . . . . 73.310000000000002 110.865 -179.93 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 1.2 m-20 -57.98 -34.7 70.24 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.214 -0.448 . . . . 62.149999999999999 110.918 -179.936 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -67.23 -38.6 85.51 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.188 -0.46 . . . . 60.5 110.898 179.973 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.903 HD11 ' CG1' ' A' ' 46' ' ' ILE . 6.1 mt -60.91 -51.52 68.93 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.148 -0.478 . . . . 54.43 110.936 -179.994 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 4.7 pt-20 -68.62 -37.9 80.11 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.198 -0.455 . . . . 73.209999999999994 110.905 179.917 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -63.83 -50.64 68.09 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.126 -0.488 . . . . 54.039999999999999 111.089 179.924 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . 0.423 ' HA ' HD12 ' A' ' 25' ' ' ILE . 0.8 OUTLIER -71.4 -36.58 61.61 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 116.226 -0.443 . . . . 74.109999999999999 111.137 179.983 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -52.48 -34.45 49.32 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.177 -0.465 . . . . 71.120000000000005 110.889 179.963 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -67.23 -36.25 81.27 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.174 -0.466 . . . . 71.150000000000006 110.85 -179.77 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . 0.644 HD13 ' CE1' ' A' ' 115' ' ' PHE . 3.3 mt -79.33 -45.23 23.88 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.153 -0.476 . . . . 64.219999999999999 111.138 179.915 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 29.0 m-85 -109.04 46.35 0.98 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.155 -0.475 . . . . 74.219999999999999 110.936 -179.977 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 1.2 mtm -42.67 -57.4 2.74 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.081 -0.509 . . . . 72.129999999999995 110.9 179.903 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 6.2 p-10 -106.08 32.98 4.04 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.229 -0.441 . . . . 62.539999999999999 110.874 179.937 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -135.01 13.15 3.61 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.187 -0.46 . . . . 70.140000000000001 110.891 179.976 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' PHE . . . . . 0.611 ' C ' ' CD1' ' A' ' 30' ' ' PHE . 0.2 OUTLIER -111.89 139.92 46.98 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.195 -0.457 . . . . 71.230000000000004 110.854 -179.899 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 20.2 m -110.85 128.11 55.66 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.097 -0.501 . . . . 72.409999999999997 111.143 -179.928 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -87.61 113.71 23.55 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.218 -0.446 . . . . 63.119999999999997 110.891 179.918 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 1.065 HD23 ' N ' ' A' ' 34' ' ' THR . 0.1 OUTLIER -121.73 -16.68 7.63 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.193 -0.458 . . . . 71.040000000000006 110.899 -179.946 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . 1.065 ' N ' HD23 ' A' ' 33' ' ' LEU . 15.8 m -43.6 146.29 0.54 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.204 -0.453 . . . . 73.230000000000004 111.146 179.933 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . 0.476 ' CD ' ' HA ' ' A' ' 44' ' ' PRO . 0.3 OUTLIER -43.48 90.94 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.222 -0.445 . . . . 73.030000000000001 110.902 179.923 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . 0.492 ' N ' ' O ' ' A' ' 34' ' ' THR . 8.1 mmm180 -92.95 40.06 1.05 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.227 -0.442 . . . . 71.239999999999995 110.911 179.963 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . 0.591 ' HB3' ' CZ3' ' A' ' 40' ' ' TRP . 2.3 mmmt -41.81 151.99 0.08 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.147 -0.479 . . . . 72.25 110.871 179.989 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 5.9 t -57.98 -92.65 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.198 -0.455 . . . . 64.040000000000006 110.835 -179.894 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 1.6 m -154.75 87.12 1.14 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.153 -0.476 . . . . 31.100000000000001 110.854 -179.817 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 40' ' ' TRP . . . . . 0.591 ' CZ3' ' HB3' ' A' ' 37' ' ' LYS . 0.1 OUTLIER 177.58 -29.47 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.131 -0.486 . . . . 62.240000000000002 110.916 179.979 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 1.3 t70 -138.9 135.11 34.1 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.19 -0.459 . . . . 71.510000000000005 110.867 179.939 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 1.4 mttt -140.66 81.55 1.81 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.203 -0.453 . . . . 64.200000000000003 110.873 180.0 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . 0.496 ' N ' ' CD ' ' A' ' 44' ' ' PRO . 3.6 tt0 -121.43 50.89 2.37 Favored Pre-proline 0 C--N 1.329 -0.283 0 CA-C-O 121.556 0.693 . . . . 74.5 110.892 179.956 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 44' ' ' PRO . . . . . 0.496 ' CD ' ' N ' ' A' ' 43' ' ' GLN . 54.1 Cg_endo -69.69 -179.61 3.0 Favored 'Trans proline' 0 C--N 1.341 0.145 0 C-N-CA 122.721 2.28 . . . . 72.109999999999999 112.349 179.97 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 45' ' ' GLN . . . . . 0.469 ' O ' ' CG ' ' A' ' 45' ' ' GLN . 15.2 tt0 -139.87 8.52 2.33 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.247 -0.433 . . . . 62.310000000000002 110.912 179.995 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . 0.903 ' CG1' HD11 ' A' ' 19' ' ' LEU . 0.0 OUTLIER 81.86 -34.74 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.229 -0.441 . . . . 73.439999999999998 111.112 -179.995 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . 0.92 HG12 HD21 ' A' ' 33' ' ' LEU . 0.1 OUTLIER -32.97 141.02 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.209 -0.45 . . . . 72.510000000000005 111.12 179.878 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 48' ' ' PHE . . . . . 0.872 ' HA ' HD22 ' A' ' 33' ' ' LEU . 1.4 p90 -153.06 164.59 37.73 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.172 -0.467 . . . . 74.25 110.927 179.961 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . 0.801 ' CG ' HD13 ' A' ' 33' ' ' LEU . 12.5 mt-10 -108.86 152.31 25.08 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.183 -0.462 . . . . 71.519999999999996 110.893 -179.953 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . 0.479 HD13 ' HA ' ' A' ' 30' ' ' PHE . 3.8 mm -133.89 141.54 43.73 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.142 -0.481 . . . . 73.010000000000005 111.144 179.951 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 85.8 m -86.28 126.7 34.49 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.168 -0.469 . . . . 41.009999999999998 111.144 179.957 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . 0.729 HD12 HD12 ' A' ' 66' ' ' LEU . 16.2 mt -132.59 159.55 39.19 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.194 -0.457 . . . . 72.409999999999997 110.908 179.953 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -178.31 174.56 1.28 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.178 -0.465 . . . . 75.030000000000001 110.918 179.979 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . 0.462 ' HA ' ' CD1' ' A' ' 125' ' ' LEU . 7.3 p -63.16 -177.61 0.19 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.241 -0.436 . . . . 61.140000000000001 110.844 -179.792 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 30.2 m -91.18 -22.36 6.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.095 -0.502 . . . . 74.120000000000005 111.12 179.943 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -122.74 -170.13 2.04 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.208 -0.451 . . . . 52.549999999999997 110.862 179.95 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 1.7 mmmp? -118.11 -16.56 9.76 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.185 -0.462 . . . . 64.310000000000002 110.888 -179.97 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . 0.562 ' HA ' ' C ' ' A' ' 59' ' ' PRO . 56.8 mt-10 -120.22 146.69 43.14 Favored Pre-proline 0 C--N 1.329 -0.298 0 CA-C-O 121.675 0.75 . . . . 74.310000000000002 110.894 179.97 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 59' ' ' PRO . . . . . 0.562 ' C ' ' HA ' ' A' ' 58' ' ' GLU . 54.0 Cg_endo -69.75 -9.56 11.05 Favored 'Cis proline' 0 C--N 1.342 0.188 0 C-N-CA 122.695 -1.794 . . . . 52.299999999999997 112.334 0.034 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 60' ' ' VAL . . . . . 0.449 HG22 ' CG ' ' A' ' 129' ' ' GLN . 22.1 m -141.98 176.16 4.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.247 -0.433 . . . . 75.109999999999999 111.122 179.96 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . 0.447 ' O ' ' C ' ' A' ' 62' ' ' SER . 13.4 tt0 -106.97 -16.73 14.37 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.199 -0.455 . . . . 74.430000000000007 110.879 -180.0 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . 0.887 ' HB3' HD21 ' A' ' 125' ' ' LEU . 26.7 m 34.12 87.19 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.161 -0.472 . . . . 50.509999999999998 110.87 -179.776 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 7.9 t -112.29 127.56 56.02 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.136 -0.483 . . . . 73.420000000000002 110.842 -179.777 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 64' ' ' ILE . . . . . . . . . . . . . 22.5 mt -140.61 140.34 33.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.144 -0.48 . . . . 53.109999999999999 111.127 179.948 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 29.8 m -103.28 117.3 34.19 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.15 -0.477 . . . . 54.439999999999998 111.159 179.968 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . 0.828 HD11 HG21 ' A' ' 121' ' ' THR . 8.9 mt -98.05 115.17 27.68 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.216 -0.447 . . . . 60.039999999999999 110.95 179.942 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 67' ' ' HIS . . . . . 0.571 ' CE1' HD11 ' A' ' 33' ' ' LEU . 10.5 t60 -111.67 110.08 20.29 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.193 -0.458 . . . . 75.109999999999999 110.885 179.893 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 68' ' ' PHE . . . . . 0.549 ' HB3' HD11 ' A' ' 81' ' ' ILE . 0.0 OUTLIER -102.81 140.21 37.38 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.239 -0.437 . . . . 73.030000000000001 110.897 -179.893 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . 0.537 ' HA ' HG22 ' A' ' 47' ' ' ILE . . . -120.73 116.41 25.21 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.144 -0.48 . . . . 32.299999999999997 111.073 179.961 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 70' ' ' MET . . . . . 0.575 ' CE ' HD11 ' A' ' 114' ' ' ILE . 1.1 mtt -87.06 108.96 19.1 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.241 -0.436 . . . . 55.530000000000001 110.908 179.934 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -61.68 160.38 27.26 Favored Pre-proline 0 C--N 1.33 -0.277 0 CA-C-O 121.516 0.674 . . . . 74.129999999999995 111.174 -179.924 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 72' ' ' PRO . . . . . 0.411 ' O ' HD13 ' A' ' 8' ' ' LEU . 53.7 Cg_endo -69.83 -4.17 13.53 Favored 'Trans proline' 0 C--N 1.341 0.173 0 C-N-CA 122.636 2.224 . . . . 63.530000000000001 112.373 179.937 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 73' ' ' MET . . . . . 0.505 ' O ' ' CB ' ' A' ' 76' ' ' TYR . 0.0 OUTLIER -111.92 -24.58 9.88 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.183 -0.462 . . . . 74.420000000000002 110.868 179.909 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 74' ' ' TYR . . . . . 0.655 ' CD1' ' C ' ' A' ' 74' ' ' TYR . 0.0 OUTLIER -48.94 152.7 1.73 Allowed Pre-proline 0 C--N 1.329 -0.309 0 CA-C-O 121.666 0.746 . . . . 72.239999999999995 110.941 -179.861 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 75' ' ' PRO . . . . . 0.549 ' HA ' ' CD2' ' A' ' 74' ' ' TYR . 53.4 Cg_endo -69.75 -8.55 10.53 Favored 'Cis proline' 0 C--O 1.232 0.196 0 C-N-CA 122.714 -1.786 . . . . 65.540000000000006 112.319 -0.056 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 76' ' ' TYR . . . . . 0.505 ' CB ' ' O ' ' A' ' 73' ' ' MET . 31.1 t80 -33.0 -46.79 0.16 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.255 -0.43 . . . . 74.329999999999998 110.912 -179.902 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 13.8 p -106.83 -171.44 1.89 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.135 -0.484 . . . . 65.409999999999997 111.125 -179.961 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -104.8 130.41 23.22 Favored Pre-proline 0 C--N 1.329 -0.3 0 CA-C-O 121.577 0.703 . . . . 72.209999999999994 111.123 179.843 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 79' ' ' PRO . . . . . 0.531 ' HG3' HD11 ' A' ' 113' ' ' ILE . 53.3 Cg_endo -69.8 167.54 24.19 Favored 'Trans proline' 0 C--O 1.231 0.153 0 C-N-CA 122.648 2.232 . . . . 75.319999999999993 112.336 -179.975 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 1.7 tt0 -118.85 134.82 54.9 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.213 -0.449 . . . . 74.129999999999995 110.876 -179.962 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 81' ' ' ILE . . . . . 0.569 HG21 HD22 ' A' ' 66' ' ' LEU . 12.1 mt -142.8 150.83 17.8 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.152 -0.476 . . . . 63.399999999999999 111.129 179.973 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . 0.504 ' HG3' ' CD ' ' A' ' 84' ' ' LYS . 9.2 pt-20 -149.43 147.64 28.5 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.167 -0.47 . . . . 63.100000000000001 110.906 179.923 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 83' ' ' PHE . . . . . 0.512 ' CZ ' ' HD3' ' A' ' 98' ' ' LYS . 6.3 m-85 -89.03 140.58 29.29 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.161 -0.472 . . . . 72.329999999999998 110.861 -179.891 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 84' ' ' LYS . . . . . 0.51 ' O ' ' N ' ' A' ' 86' ' ' VAL . 8.7 mmmt -124.26 174.69 7.54 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.133 -0.485 . . . . 54.130000000000003 110.913 179.971 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . 0.413 ' C ' HG22 ' A' ' 86' ' ' VAL . 2.0 m-80 59.66 -76.06 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.265 -0.425 . . . . 63.310000000000002 110.852 179.937 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 86' ' ' VAL . . . . . 0.9 HG11 HD21 ' A' ' 94' ' ' LEU . 3.6 m 41.28 87.52 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.162 -0.472 . . . . 54.450000000000003 111.146 179.914 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -94.61 -78.39 0.44 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.187 -0.46 . . . . 61.310000000000002 110.934 -179.989 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 88' ' ' ASN . . . . . 0.433 ' CG ' ' HB ' ' A' ' 60' ' ' VAL . 33.6 m120 -83.96 55.02 3.11 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.173 -0.467 . . . . 71.219999999999999 110.871 -179.954 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 89' ' ' VAL . . . . . 0.579 HG21 HD13 ' A' ' 94' ' ' LEU . 1.3 p -152.75 145.79 15.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.192 -0.458 . . . . 73.439999999999998 111.145 179.921 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 90' ' ' MET . . . . . 0.633 ' O ' HD22 ' A' ' 94' ' ' LEU . 0.5 OUTLIER -95.18 -155.65 0.48 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.176 -0.465 . . . . 65.329999999999998 110.88 179.904 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 91' ' ' ASP . . . . . 0.477 ' O ' ' CG ' ' A' ' 95' ' ' GLN . 0.1 OUTLIER -98.61 -17.76 18.46 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.227 -0.442 . . . . 75.209999999999994 110.883 179.955 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 78.8 p -66.64 -47.11 73.61 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.192 -0.458 . . . . 60.420000000000002 110.911 -179.783 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 93' ' ' GLN . . . . . 0.549 ' CG ' ' CD2' ' A' ' 128' ' ' PHE . 5.0 mt-30 -68.69 -42.97 77.07 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.114 -0.494 . . . . 74.120000000000005 110.918 -179.987 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . 0.9 HD21 HG11 ' A' ' 86' ' ' VAL . 0.1 OUTLIER -59.04 -49.11 79.14 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.156 -0.475 . . . . 64.530000000000001 110.91 -179.998 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 95' ' ' GLN . . . . . 0.477 ' CG ' ' O ' ' A' ' 91' ' ' ASP . 7.3 mm-40 -66.06 -35.25 80.03 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.149 -0.478 . . . . 74.140000000000001 110.941 179.911 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 96' ' ' MET . . . . . 0.512 ' SD ' ' CE1' ' A' ' 128' ' ' PHE . 29.5 ttp -60.3 -44.85 95.04 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.187 -0.461 . . . . 63.140000000000001 110.873 179.961 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 97' ' ' LEU . . . . . 0.635 HD22 HG22 ' A' ' 121' ' ' THR . 33.7 mt -58.13 -39.8 79.67 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.227 -0.442 . . . . 64.409999999999997 110.906 -179.968 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 98' ' ' LYS . . . . . 0.512 ' HD3' ' CZ ' ' A' ' 83' ' ' PHE . 5.6 mmtp -57.39 -43.78 83.94 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.186 -0.461 . . . . 73.299999999999997 110.881 179.82 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -61.3 -39.0 88.83 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.229 -0.442 . . . . 51.340000000000003 110.853 -179.879 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 100' ' ' GLU . . . . . 0.507 ' HG2' ' CE1' ' A' ' 120' ' ' PHE . 0.3 OUTLIER -69.86 -28.6 65.79 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.168 -0.469 . . . . 65.129999999999995 110.916 -179.97 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 101' ' ' PHE . . . . . 0.657 ' CG ' HD11 ' A' ' 117' ' ' ILE . 9.2 m-30 -59.42 -39.17 82.62 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.143 -0.481 . . . . 72.450000000000003 110.843 -179.906 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.81 -39.5 94.38 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.143 -0.48 . . . . 64.040000000000006 110.904 -179.999 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 37.7 mtmt -68.77 -40.98 79.45 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.209 -0.451 . . . . 61.340000000000003 110.891 179.865 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 4.3 mt -65.09 -47.57 87.26 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 116.278 -0.419 . . . . 72.409999999999997 111.166 179.842 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 105' ' ' HIS . . . . . 0.495 ' O ' ' N ' ' A' ' 109' ' ' ARG . 4.6 t60 -62.76 -41.35 99.18 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.191 -0.459 . . . . 63.539999999999999 110.853 179.873 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -59.17 -42.35 90.56 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.224 -0.444 . . . . 74.25 110.89 -179.944 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 10.7 t -82.67 -28.12 30.85 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.191 -0.459 . . . . 74.019999999999996 111.126 -179.955 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 108' ' ' SER . . . . . 0.762 ' HB3' HG22 ' A' ' 113' ' ' ILE . 23.5 m -101.74 13.38 35.05 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.195 -0.457 . . . . 63.210000000000001 110.904 -179.874 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 109' ' ' ARG . . . . . 0.495 ' N ' ' O ' ' A' ' 105' ' ' HIS . 2.6 ttt-85 -61.57 77.88 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.114 -0.494 . . . . 72.230000000000004 110.882 -179.949 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 110' ' ' GLY . . . . . 0.448 ' N ' ' O ' ' A' ' 108' ' ' SER . . . 137.12 31.76 0.25 Allowed Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.739 -0.744 . . . . 61.43 112.52 -179.98 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 111' ' ' GLN . . . . . 0.407 ' NE2' ' HA ' ' A' ' 108' ' ' SER . 4.4 pt20 -173.2 -165.69 0.3 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.743 0.306 . . . . 52.340000000000003 110.958 -179.841 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 38.8 mt-10 -65.74 127.64 32.77 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.216 -0.447 . . . . 73.5 110.88 179.994 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 113' ' ' ILE . . . . . 0.762 HG22 ' HB3' ' A' ' 108' ' ' SER . 19.3 pt -126.5 -10.9 4.66 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.133 -0.485 . . . . 74.239999999999995 111.112 179.974 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 114' ' ' ILE . . . . . 0.744 ' O ' HG23 ' A' ' 118' ' ' THR . 13.6 mm -67.06 -44.9 87.92 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.221 -0.445 . . . . 75.200000000000003 111.079 179.887 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 115' ' ' PHE . . . . . 0.644 ' CE1' HD13 ' A' ' 25' ' ' ILE . 19.7 t80 -68.98 -34.5 75.41 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.19 -0.459 . . . . 60.530000000000001 110.894 179.962 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 4.9 mm-40 -67.47 -47.53 69.79 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.154 -0.475 . . . . 63.009999999999998 110.89 -179.909 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 117' ' ' ILE . . . . . 0.657 HD11 ' CG ' ' A' ' 101' ' ' PHE . 0.5 OUTLIER -64.31 -40.53 89.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.108 -0.496 . . . . 61.32 111.165 179.949 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 118' ' ' THR . . . . . 0.744 HG23 ' O ' ' A' ' 114' ' ' ILE . 58.3 p -67.03 -43.38 82.94 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.166 -0.47 . . . . 75.209999999999994 111.13 179.93 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -68.07 -39.24 83.01 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.24 -0.437 . . . . 72.439999999999998 110.876 -179.861 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 120' ' ' PHE . . . . . 0.507 ' CE1' ' HG2' ' A' ' 100' ' ' GLU . 0.4 OUTLIER -69.69 -45.21 68.81 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.12 -0.491 . . . . 73.0 110.92 -179.995 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 121' ' ' THR . . . . . 0.828 HG21 HD11 ' A' ' 66' ' ' LEU . 19.0 p -66.63 -42.17 87.18 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.142 -0.481 . . . . 55.32 111.144 -179.935 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 122' ' ' GLN . . . . . 0.442 ' NE2' ' O ' ' A' ' 122' ' ' GLN . 0.7 OUTLIER -65.06 -51.28 62.36 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.266 -0.425 . . . . 74.239999999999995 110.943 179.98 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 123' ' ' GLU . . . . . 0.474 ' CG ' ' N ' ' A' ' 124' ' ' LYS . 7.3 pt-20 -62.13 -46.2 90.08 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.188 -0.46 . . . . 74.540000000000006 110.869 -179.953 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 124' ' ' LYS . . . . . 0.474 ' N ' ' CG ' ' A' ' 123' ' ' GLU . 1.1 mmpt? -63.91 -40.07 95.64 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.189 -0.46 . . . . 70.349999999999994 110.874 179.986 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 125' ' ' LEU . . . . . 0.887 HD21 ' HB3' ' A' ' 62' ' ' SER . 0.1 OUTLIER -70.09 -38.97 75.83 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.231 -0.44 . . . . 73.510000000000005 110.9 179.92 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 126' ' ' ASP . . . . . 0.722 ' N ' HD13 ' A' ' 125' ' ' LEU . 1.6 t0 -66.72 -46.49 75.35 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.158 -0.474 . . . . 74.120000000000005 110.856 179.872 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -67.88 -28.63 67.69 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.215 -0.448 . . . . 73.109999999999999 110.914 -179.93 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 128' ' ' PHE . . . . . 0.549 ' CD2' ' CG ' ' A' ' 93' ' ' GLN . 0.5 OUTLIER -72.17 -55.65 6.9 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.17 -0.468 . . . . 61.119999999999997 110.906 -179.934 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 129' ' ' GLN . . . . . 0.453 ' C ' ' OE1' ' A' ' 129' ' ' GLN . 1.1 tm0? -42.65 -50.02 5.49 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.132 -0.485 . . . . 74.450000000000003 110.894 -179.952 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 130' ' ' ASN . . . . . 0.421 ' C ' HG12 ' A' ' 131' ' ' VAL . 1.5 t-20 -59.4 -74.57 0.07 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.221 -0.445 . . . . 63.32 110.832 -179.925 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 131' ' ' VAL . . . . . 0.879 HG22 HG23 ' A' ' 132' ' ' VAL . 1.4 p 169.23 -51.94 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.159 -0.473 . . . . 74.010000000000005 111.13 179.941 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 132' ' ' VAL . . . . . 0.879 HG23 HG22 ' A' ' 131' ' ' VAL . 61.6 t -143.5 136.58 24.72 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 116.143 -0.481 . . . . 72.310000000000002 111.125 179.948 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 133' ' ' ASN . . . . . . . . . . . . . 73.5 m-20 47.76 -174.06 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.164 -0.471 . . . . 51.32 110.896 179.977 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 134' ' ' THR . . . . . . . . . . . . . 8.6 t -119.3 153.97 34.24 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.214 -0.448 . . . . 64.549999999999997 111.119 -179.976 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -120.29 131.99 55.13 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.165 -0.47 . . . . 71.409999999999997 110.928 179.982 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 13.5 t 53.54 75.65 0.25 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.203 -0.453 . . . . 71.329999999999998 110.845 -179.799 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 137' ' ' LEU . . . . . . . . . . . . . 15.5 tp -42.91 -48.9 5.93 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.156 -0.475 . . . . 72.019999999999996 110.897 179.981 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--N 1.33 -0.273 0 CA-C-N 116.206 -0.452 . . . . 72.040000000000006 110.888 179.952 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.23 0.077 0 CA-C-O 120.786 0.327 . . . . 63.119999999999997 110.89 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 35.3 t -169.18 130.93 1.18 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.169 -0.469 . . . . 64.439999999999998 110.816 -179.76 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER 169.65 125.79 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.172 -0.467 . . . . 75.310000000000002 110.886 179.977 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 15.6 m 59.35 166.33 0.06 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.229 -0.441 . . . . 63.210000000000001 110.878 -179.929 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 1.2 m80 -108.57 -60.49 1.73 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.124 -0.489 . . . . 72.010000000000005 110.835 179.989 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -83.98 93.66 8.11 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.199 -0.455 . . . . 64.409999999999997 110.94 -179.977 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -162.58 169.16 20.67 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.239 -0.437 . . . . 55.219999999999999 111.12 179.971 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 44.1 mt -54.81 -24.48 23.0 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.166 -0.47 . . . . 75.040000000000006 110.904 179.987 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 17.2 t0 -54.19 -31.67 53.55 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.198 -0.455 . . . . 72.209999999999994 110.866 179.828 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . 0.41 ' O ' ' HG2' ' A' ' 13' ' ' GLU . 97.0 mm-40 -66.72 -40.53 88.44 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.218 -0.447 . . . . 60.130000000000003 110.918 -179.901 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 20.1 m-85 -56.09 -22.94 30.9 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.194 -0.457 . . . . 73.299999999999997 110.925 -179.859 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' TYR . . . . . 0.585 ' CZ ' HD11 ' A' ' 46' ' ' ILE . 0.3 OUTLIER -57.69 -36.34 71.82 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.145 -0.48 . . . . 75.010000000000005 110.869 -179.885 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . 0.483 ' HG3' ' N ' ' A' ' 14' ' ' ILE . 5.0 pt-20 -61.63 -41.11 97.04 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.173 -0.467 . . . . 64.030000000000001 110.874 -179.997 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . 0.483 ' N ' ' HG3' ' A' ' 13' ' ' GLU . 3.8 mp -68.28 -44.33 83.94 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-N 116.153 -0.476 . . . . 60.130000000000003 111.125 -179.99 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . 0.819 ' HB3' HG21 ' A' ' 46' ' ' ILE . 10.2 mt-30 -65.99 -47.22 75.27 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.15 -0.477 . . . . 73.230000000000004 110.91 179.944 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 2.5 t -61.4 -40.69 95.29 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.177 -0.465 . . . . 72.200000000000003 110.871 -179.946 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -58.21 -33.72 69.6 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.208 -0.451 . . . . 75.540000000000006 110.887 -179.866 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . 0.401 ' OE1' ' SD ' ' A' ' 70' ' ' MET . 32.6 mt-10 -65.81 -39.08 90.54 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.197 -0.456 . . . . 74.5 110.876 -179.997 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.433 HD12 ' CE1' ' A' ' 48' ' ' PHE . 6.8 mp -63.18 -51.8 64.93 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.144 -0.48 . . . . 73.120000000000005 110.903 -179.943 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 1.7 pt-20 -68.8 -37.22 79.12 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.203 -0.453 . . . . 73.120000000000005 110.895 179.941 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -64.27 -50.51 67.63 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.148 -0.478 . . . . 65.510000000000005 111.066 179.97 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . 0.833 ' HA ' HD12 ' A' ' 25' ' ' ILE . 0.9 OUTLIER -71.85 -35.31 54.35 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.272 -0.422 . . . . 73.340000000000003 111.117 179.971 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . 0.458 ' HG3' ' CD2' ' A' ' 30' ' ' PHE . 7.6 mtp180 -54.36 -37.99 65.59 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.174 -0.466 . . . . 64.439999999999998 110.887 179.936 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -65.38 -31.41 72.5 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.18 -0.464 . . . . 42.530000000000001 110.859 -179.786 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . 0.833 HD12 ' HA ' ' A' ' 22' ' ' ILE . 5.1 mt -80.35 -45.43 22.1 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.135 -0.484 . . . . 73.120000000000005 111.099 179.972 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' TYR . . . . . 0.422 ' O ' ' N ' ' A' ' 30' ' ' PHE . 25.1 m-85 -107.97 41.28 1.57 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.175 -0.466 . . . . 70.109999999999999 110.909 -179.94 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' MET . . . . . 0.406 ' C ' ' O ' ' A' ' 26' ' ' TYR . 1.9 mtm -38.08 -52.94 1.42 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.137 -0.483 . . . . 74.420000000000002 110.869 179.907 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -88.83 -33.2 17.47 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.206 -0.452 . . . . 71.109999999999999 110.848 179.979 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -84.5 21.67 1.43 Allowed 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.237 -0.438 . . . . 62.5 110.875 179.997 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' PHE . . . . . 0.532 ' HA ' HD13 ' A' ' 50' ' ' ILE . 0.4 OUTLIER -111.0 128.67 55.92 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.189 -0.46 . . . . 53.119999999999997 110.89 -179.889 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 83.2 m -114.2 133.88 55.3 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.157 -0.474 . . . . 65.010000000000005 111.143 -179.923 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 41.8 t0 -98.11 120.5 38.62 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.213 -0.449 . . . . 71.510000000000005 110.891 179.918 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.941 HD21 HG12 ' A' ' 47' ' ' ILE . 0.2 OUTLIER -121.58 0.73 9.97 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.204 -0.453 . . . . 63.310000000000002 110.89 -179.904 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . 0.787 ' N ' HD23 ' A' ' 33' ' ' LEU . 0.2 OUTLIER -53.39 -167.53 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.186 -0.461 . . . . 75.019999999999996 111.184 179.999 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . 0.756 ' H ' HG22 ' A' ' 34' ' ' THR . 0.2 OUTLIER -87.35 18.89 3.5 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.252 -0.431 . . . . 74.310000000000002 110.839 179.95 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.99 -94.44 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.242 -0.436 . . . . 74.310000000000002 110.867 179.992 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 5.5 mmpt? -87.27 57.53 4.51 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.206 -0.452 . . . . 73.310000000000002 110.916 179.95 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 52.9 p -142.41 78.83 1.64 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.252 -0.431 . . . . 71.409999999999997 110.887 -179.915 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 5.9 m -63.7 99.3 0.22 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.175 -0.466 . . . . 64.430000000000007 110.851 -179.789 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 40' ' ' TRP . . . . . . . . . . . . . 33.2 t-105 -171.59 -47.18 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.169 -0.469 . . . . 73.299999999999997 110.913 -179.963 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 34.1 t70 -143.74 152.19 40.96 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.265 -0.425 . . . . 55.43 110.904 179.949 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -123.65 65.22 1.02 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.228 -0.442 . . . . 75.430000000000007 110.911 179.987 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 23.6 mt-30 -159.12 75.01 3.34 Favored Pre-proline 0 C--N 1.329 -0.325 0 CA-C-O 121.574 0.702 . . . . 74.049999999999997 110.928 179.971 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 44' ' ' PRO . . . . . 0.459 ' CG ' ' HG2' ' A' ' 35' ' ' LYS . 53.4 Cg_endo -69.72 -177.84 2.05 Favored 'Trans proline' 0 C--N 1.341 0.161 0 C-N-CA 122.694 2.263 . . . . 62.399999999999999 112.35 179.992 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 45' ' ' GLN . . . . . 0.99 ' HG2' HD12 ' A' ' 47' ' ' ILE . 7.4 pt20 -157.13 18.19 0.29 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.225 -0.443 . . . . 75.010000000000005 110.913 -179.996 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . 0.819 HG21 ' HB3' ' A' ' 15' ' ' GLN . 15.4 mm 69.9 75.48 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.177 -0.465 . . . . 63.32 111.153 179.961 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . 0.99 HD12 ' HG2' ' A' ' 45' ' ' GLN . 0.2 OUTLIER -142.52 148.33 20.13 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.171 -0.468 . . . . 73.049999999999997 111.135 179.875 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 48' ' ' PHE . . . . . 0.841 ' HA ' HD22 ' A' ' 33' ' ' LEU . 22.3 p90 -162.14 155.4 20.58 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.146 -0.479 . . . . 63.350000000000001 110.903 179.919 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . 0.601 ' HG3' HD13 ' A' ' 33' ' ' LEU . 13.4 mt-10 -108.44 151.88 25.44 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.199 -0.455 . . . . 74.319999999999993 110.87 -179.901 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . 0.532 HD13 ' HA ' ' A' ' 30' ' ' PHE . 29.9 mm -130.38 135.71 60.06 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.132 -0.486 . . . . 73.010000000000005 111.155 179.958 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 84.8 m -87.19 116.97 25.63 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.208 -0.451 . . . . 60.210000000000001 111.163 179.954 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 18.3 mt -117.0 164.91 13.99 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.241 -0.436 . . . . 71.420000000000002 110.94 179.959 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -175.76 175.84 1.96 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.203 -0.453 . . . . 75.010000000000005 110.865 179.943 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 76.6 p -66.69 -154.3 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.156 -0.474 . . . . 73.340000000000003 110.843 -179.789 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 17.3 m -119.21 -19.64 5.42 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.135 -0.484 . . . . 63.210000000000001 111.123 179.976 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -114.23 178.66 4.2 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.186 -0.461 . . . . 73.430000000000007 110.866 179.911 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . 0.462 ' HD3' ' N ' ' A' ' 57' ' ' LYS . 0.0 OUTLIER -118.24 -5.63 10.88 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.168 -0.469 . . . . 73.310000000000002 110.917 179.974 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . 0.553 ' HA ' ' C ' ' A' ' 59' ' ' PRO . 2.9 pt-20 -135.57 145.65 54.24 Favored Pre-proline 0 C--N 1.329 -0.287 0 CA-C-O 121.654 0.74 . . . . 75.439999999999998 110.91 179.939 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 59' ' ' PRO . . . . . 0.553 ' C ' ' HA ' ' A' ' 58' ' ' GLU . 53.6 Cg_endo -69.78 -6.92 9.73 Favored 'Cis proline' 0 C--N 1.342 0.185 0 C-N-CA 122.654 -1.811 . . . . 33.43 112.332 0.011 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 60' ' ' VAL . . . . . 0.457 ' O ' ' C ' ' A' ' 57' ' ' LYS . 32.3 m -140.89 -174.25 0.75 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.205 -0.452 . . . . 61.219999999999999 111.115 179.954 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . 0.46 ' O ' ' C ' ' A' ' 62' ' ' SER . 7.2 tt0 -119.28 -12.2 9.45 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.182 -0.463 . . . . 73.219999999999999 110.879 -179.965 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . 0.827 ' CB ' HD11 ' A' ' 125' ' ' LEU . 0.2 OUTLIER 33.8 89.21 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.158 -0.474 . . . . 41.210000000000001 110.888 -179.79 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 5.0 p -119.06 123.63 44.94 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.158 -0.474 . . . . 74.0 110.839 -179.802 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 64' ' ' ILE . . . . . 0.794 HD11 HG21 ' A' ' 89' ' ' VAL . 33.6 mt -135.69 134.96 51.46 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.126 -0.488 . . . . 75.219999999999999 111.131 179.921 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 36.6 m -98.81 113.98 26.34 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.157 -0.474 . . . . 53.439999999999998 111.133 179.969 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . 0.681 HD21 HG21 ' A' ' 121' ' ' THR . 0.4 OUTLIER -94.74 111.37 23.15 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.236 -0.438 . . . . 61.329999999999998 110.899 179.984 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 5.1 t60 -103.38 112.02 24.72 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.217 -0.447 . . . . 72.129999999999995 110.873 179.843 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 68' ' ' PHE . . . . . 0.543 ' CE1' HG23 ' A' ' 114' ' ' ILE . 0.0 OUTLIER -103.76 139.91 38.35 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.227 -0.442 . . . . 74.209999999999994 110.861 -179.897 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . 0.777 ' HA ' HG22 ' A' ' 47' ' ' ILE . . . -123.66 116.22 22.73 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.171 -0.468 . . . . 75.540000000000006 111.058 179.94 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 70' ' ' MET . . . . . 0.449 ' HE1' ' CG1' ' A' ' 114' ' ' ILE . 0.0 OUTLIER -79.39 160.58 26.62 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.222 -0.445 . . . . 71.099999999999994 110.852 179.974 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -116.92 161.13 34.01 Favored Pre-proline 0 C--N 1.329 -0.295 0 CA-C-O 121.551 0.691 . . . . 60.32 111.145 -179.904 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.77 3.07 2.99 Favored 'Trans proline' 0 C--N 1.341 0.152 0 C-N-CA 122.702 2.268 . . . . 64.310000000000002 112.335 179.942 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 73' ' ' MET . . . . . 0.495 ' O ' ' CB ' ' A' ' 76' ' ' TYR . 0.5 OUTLIER -122.19 -24.98 4.97 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.201 -0.454 . . . . 73.099999999999994 110.901 179.889 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 74' ' ' TYR . . . . . 0.647 ' CD1' ' C ' ' A' ' 74' ' ' TYR . 0.0 OUTLIER -46.74 149.92 1.38 Allowed Pre-proline 0 C--N 1.329 -0.323 0 CA-C-O 121.698 0.761 . . . . 73.140000000000001 110.929 -179.875 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 75' ' ' PRO . . . . . 0.551 ' C ' ' HA ' ' A' ' 74' ' ' TYR . 53.5 Cg_endo -69.8 -10.31 11.51 Favored 'Cis proline' 0 C--O 1.232 0.198 0 C-N-CA 122.713 -1.786 . . . . 41.530000000000001 112.307 0.007 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 76' ' ' TYR . . . . . 0.495 ' CB ' ' O ' ' A' ' 73' ' ' MET . 24.3 t80 -34.08 -45.84 0.22 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.264 -0.426 . . . . 71.420000000000002 110.914 -179.91 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 77' ' ' THR . . . . . 0.464 HG23 ' HB2' ' A' ' 73' ' ' MET . 28.3 p -108.65 175.39 5.48 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.129 -0.487 . . . . 73.319999999999993 111.162 -179.969 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -100.55 127.69 32.07 Favored Pre-proline 0 C--N 1.329 -0.312 0 CA-C-O 121.541 0.686 . . . . 63.450000000000003 111.131 179.875 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 79' ' ' PRO . . . . . 0.762 ' HG3' HD11 ' A' ' 113' ' ' ILE . 53.8 Cg_endo -69.85 -168.82 0.3 Allowed 'Trans proline' 0 C--N 1.341 0.158 0 C-N-CA 122.656 2.237 . . . . 62.329999999999998 112.304 -179.947 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . 0.475 ' HG3' ' N ' ' A' ' 81' ' ' ILE . 0.3 OUTLIER -129.24 140.92 51.28 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.19 -0.459 . . . . 75.430000000000007 110.91 -179.976 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 81' ' ' ILE . . . . . 0.475 ' N ' ' HG3' ' A' ' 80' ' ' GLU . 3.1 mm -129.03 148.34 33.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.131 -0.486 . . . . 71.140000000000001 111.117 179.985 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . 0.507 ' HG3' ' CD ' ' A' ' 84' ' ' LYS . 4.1 pt-20 -147.83 142.85 27.0 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.195 -0.457 . . . . 62.039999999999999 110.908 179.966 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 83' ' ' PHE . . . . . 0.576 ' CD1' HD11 ' A' ' 66' ' ' LEU . 8.9 m-85 -99.39 138.64 36.19 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.171 -0.468 . . . . 64.439999999999998 110.899 -179.937 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 84' ' ' LYS . . . . . 0.507 ' CD ' ' HG3' ' A' ' 82' ' ' GLU . 7.7 mmmt -125.95 170.48 11.64 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.198 -0.455 . . . . 72.299999999999997 110.893 179.925 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . 0.63 HD22 ' N ' ' A' ' 85' ' ' ASN . 0.8 OUTLIER 63.86 -72.97 0.05 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.232 -0.44 . . . . 63.020000000000003 110.889 179.97 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 86' ' ' VAL . . . . . 0.614 ' CG1' HD21 ' A' ' 94' ' ' LEU . 4.7 m 35.62 89.96 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.18 -0.464 . . . . 75.519999999999996 111.098 179.906 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -95.09 -68.14 0.82 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.173 -0.467 . . . . 61.149999999999999 110.862 -179.991 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 88' ' ' ASN . . . . . 0.438 ' ND2' HG11 ' A' ' 60' ' ' VAL . 19.9 t-20 -82.16 40.92 0.65 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.23 -0.441 . . . . 72.420000000000002 110.868 -179.943 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 89' ' ' VAL . . . . . 0.794 HG21 HD11 ' A' ' 64' ' ' ILE . 6.6 t -132.95 149.19 31.54 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.223 -0.444 . . . . 73.030000000000001 111.142 179.902 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 90' ' ' MET . . . . . 0.724 ' SD ' HG21 ' A' ' 134' ' ' THR . 0.2 OUTLIER -101.86 -69.52 0.78 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.175 -0.466 . . . . 74.230000000000004 110.843 179.936 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 2.7 p30 -177.31 -43.44 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.208 -0.451 . . . . 72.340000000000003 110.848 -179.975 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -54.22 -38.93 66.23 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.173 -0.467 . . . . 73.0 110.886 -179.794 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 93' ' ' GLN . . . . . 0.54 ' OE1' ' CG ' ' A' ' 128' ' ' PHE . 4.0 tt0 -65.94 -45.18 82.75 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.083 -0.508 . . . . 73.319999999999993 110.932 -179.954 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . 0.614 HD21 ' CG1' ' A' ' 86' ' ' VAL . 80.9 mt -60.51 -48.58 81.14 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.194 -0.457 . . . . 72.239999999999995 110.922 -179.994 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 2.7 mm-40 -63.66 -33.83 76.5 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.215 -0.448 . . . . 63.420000000000002 110.933 179.904 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 96' ' ' MET . . . . . 0.42 ' HE3' ' HG2' ' A' ' 124' ' ' LYS . 11.9 ttp -59.71 -39.49 84.8 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.191 -0.459 . . . . 54.420000000000002 110.901 179.946 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 97' ' ' LEU . . . . . 0.871 HD22 HG22 ' A' ' 121' ' ' THR . 29.1 mt -66.35 -39.13 88.98 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.193 -0.458 . . . . 63.32 110.934 -179.987 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 98' ' ' LYS . . . . . 0.434 ' HD3' ' CZ ' ' A' ' 83' ' ' PHE . 3.0 mmtp -61.62 -34.38 75.57 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.188 -0.46 . . . . 74.299999999999997 110.893 179.796 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 3.1 m -70.34 -45.88 65.28 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.233 -0.439 . . . . 62.240000000000002 110.872 -179.894 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 100' ' ' GLU . . . . . 0.719 ' O ' HD12 ' A' ' 104' ' ' ILE . 11.2 pt-20 -72.56 -23.79 61.03 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.159 -0.473 . . . . 62.520000000000003 110.906 -179.957 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 101' ' ' PHE . . . . . 0.616 ' CD1' ' O ' ' A' ' 97' ' ' LEU . 8.3 m-30 -59.87 -38.02 80.98 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.124 -0.489 . . . . 72.030000000000001 110.856 -179.918 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -62.33 -40.11 95.29 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.16 -0.473 . . . . 73.310000000000002 110.868 179.998 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 103' ' ' LYS . . . . . 0.415 ' O ' HG22 ' A' ' 107' ' ' THR . 4.1 tmmt? -67.57 -39.81 84.89 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.31 -0.405 . . . . 54.140000000000001 110.873 179.877 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 104' ' ' ILE . . . . . 0.719 HD12 ' O ' ' A' ' 100' ' ' GLU . 1.8 mt -62.9 -47.15 94.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.217 -0.447 . . . . 44.420000000000002 111.16 179.861 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 105' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -62.84 -43.07 99.78 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.126 -0.488 . . . . 74.099999999999994 110.868 179.862 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -59.98 -31.04 69.53 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.198 -0.455 . . . . 64.409999999999997 110.907 -179.944 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 107' ' ' THR . . . . . 0.415 HG22 ' O ' ' A' ' 103' ' ' LYS . 10.7 t -97.77 -9.66 26.18 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.15 -0.477 . . . . 73.420000000000002 111.152 -179.957 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 37.5 m -124.58 36.96 4.51 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.193 -0.458 . . . . 54.350000000000001 110.843 -179.827 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -97.18 93.83 6.77 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.155 -0.475 . . . . 75.140000000000001 110.878 -179.941 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 151.67 -13.88 0.79 Allowed Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.713 -0.756 . . . . 74.340000000000003 112.503 -179.954 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 111' ' ' GLN . . . . . . . . . . . . . 1.3 pt20 -132.09 -95.5 0.34 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.769 0.319 . . . . 75.230000000000004 110.884 -179.855 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 26.6 mt-10 -137.47 141.58 41.55 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.181 -0.463 . . . . 52.43 110.918 -179.942 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 113' ' ' ILE . . . . . 0.762 HD11 ' HG3' ' A' ' 79' ' ' PRO . 19.1 pt -124.17 -7.77 7.01 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.134 -0.484 . . . . 73.219999999999999 111.086 -179.977 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 114' ' ' ILE . . . . . 0.659 ' O ' HG23 ' A' ' 118' ' ' THR . 38.6 mm -67.07 -42.17 88.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.178 -0.464 . . . . 74.430000000000007 111.151 179.881 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 115' ' ' PHE . . . . . 0.811 ' HE1' HG21 ' A' ' 25' ' ' ILE . 29.2 t80 -72.53 -40.96 66.35 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.149 -0.478 . . . . 54.109999999999999 110.871 179.938 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 19.5 mm-40 -63.91 -42.57 97.37 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.16 -0.473 . . . . 64.420000000000002 110.923 -179.938 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 117' ' ' ILE . . . . . 0.596 HD11 ' CD2' ' A' ' 101' ' ' PHE . 0.4 OUTLIER -67.22 -41.97 87.37 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.116 -0.493 . . . . 73.329999999999998 111.179 179.952 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 118' ' ' THR . . . . . 0.659 HG23 ' O ' ' A' ' 114' ' ' ILE . 69.0 p -68.33 -43.12 78.26 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.158 -0.474 . . . . 61.539999999999999 111.141 179.903 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -64.51 -43.96 92.43 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.24 -0.436 . . . . 62.420000000000002 110.855 -179.809 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 120' ' ' PHE . . . . . 0.572 ' CD2' HD11 ' A' ' 104' ' ' ILE . 0.1 OUTLIER -63.1 -45.44 92.04 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.097 -0.501 . . . . 65.120000000000005 110.925 -179.986 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 121' ' ' THR . . . . . 0.871 HG22 HD22 ' A' ' 97' ' ' LEU . 25.0 p -69.17 -38.83 78.91 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.15 -0.477 . . . . 74.400000000000006 111.158 -179.982 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -64.21 -38.81 92.37 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.229 -0.441 . . . . 73.120000000000005 110.901 -179.999 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 123' ' ' GLU . . . . . 0.48 ' HG3' ' N ' ' A' ' 124' ' ' LYS . 6.4 pt-20 -77.65 -39.0 46.56 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.232 -0.44 . . . . 62.009999999999998 110.881 -179.925 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 124' ' ' LYS . . . . . 0.48 ' N ' ' HG3' ' A' ' 123' ' ' GLU . 0.1 OUTLIER -70.33 -39.64 74.63 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.214 -0.448 . . . . 73.340000000000003 110.865 179.982 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 125' ' ' LEU . . . . . 0.827 HD11 ' CB ' ' A' ' 62' ' ' SER . 1.3 tp -61.74 -50.43 72.45 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.253 -0.43 . . . . 65.409999999999997 110.928 179.929 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 3.1 t0 -57.84 -39.19 77.11 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.175 -0.466 . . . . 75.310000000000002 110.893 179.8 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 127' ' ' GLU . . . . . 0.463 ' HG3' ' N ' ' A' ' 128' ' ' PHE . 0.0 OUTLIER -63.96 -28.8 70.06 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.156 -0.474 . . . . 64.510000000000005 110.884 -179.879 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 128' ' ' PHE . . . . . 0.54 ' CG ' ' OE1' ' A' ' 93' ' ' GLN . 0.3 OUTLIER -71.45 -68.95 0.41 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.155 -0.475 . . . . 72.329999999999998 110.905 -179.949 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 129' ' ' GLN . . . . . 0.682 ' O ' HG12 ' A' ' 132' ' ' VAL . 1.7 tm0? -35.58 -38.71 0.12 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.124 -0.489 . . . . 74.140000000000001 110.901 -179.967 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 130' ' ' ASN . . . . . . . . . . . . . 1.5 m-20 -64.38 -45.66 86.73 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.207 -0.451 . . . . 73.549999999999997 110.862 -179.956 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 131' ' ' VAL . . . . . 0.569 ' O ' HG23 ' A' ' 131' ' ' VAL . 2.9 m -110.05 28.48 1.88 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.212 -0.449 . . . . 73.109999999999999 111.119 179.942 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 132' ' ' VAL . . . . . 0.682 HG12 ' O ' ' A' ' 129' ' ' GLN . 14.4 p -73.87 132.59 33.16 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.177 -0.465 . . . . 74.129999999999995 111.135 179.89 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 133' ' ' ASN . . . . . . . . . . . . . 10.0 p30 -125.68 43.23 3.11 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.217 -0.447 . . . . 52.240000000000002 110.851 179.996 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 134' ' ' THR . . . . . 0.724 HG21 ' SD ' ' A' ' 90' ' ' MET . 30.7 p -145.73 158.42 43.86 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.227 -0.442 . . . . 73.200000000000003 111.155 -179.991 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -143.59 133.89 24.56 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.241 -0.436 . . . . 62.299999999999997 110.895 -179.972 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 2.5 m -132.73 -49.87 0.9 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.217 -0.447 . . . . 73.140000000000001 110.845 -179.794 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 137' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -51.48 111.54 0.6 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.126 -0.488 . . . . 71.329999999999998 110.926 -179.992 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.329 -0.29 0 CA-C-N 116.185 -0.462 . . . . 71.549999999999997 110.897 179.929 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.458 -0.052 0 CA-C-O 120.819 0.342 . . . . 75.140000000000001 110.891 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 3.1 m -133.54 -45.16 0.82 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.16 -0.473 . . . . 71.450000000000003 110.865 -179.843 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER 66.42 98.98 0.05 OUTLIER 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.13 -0.486 . . . . 61.119999999999997 110.927 -179.993 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -173.58 174.76 3.12 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.164 -0.471 . . . . 74.510000000000005 110.809 -179.936 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 6.6 m-70 -72.85 81.48 1.17 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.068 -0.514 . . . . 74.030000000000001 110.857 179.982 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 2.6 tp -126.82 114.68 18.24 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.175 -0.466 . . . . 63.530000000000001 110.903 -179.986 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 7.7 t -161.66 178.28 9.17 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.222 -0.444 . . . . 73.120000000000005 111.113 179.954 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.675 HD21 ' HE3' ' A' ' 73' ' ' MET . 63.3 mt -70.01 -28.82 65.81 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.21 -0.45 . . . . 73.109999999999999 110.88 179.979 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 1.2 t70 -50.5 -33.93 23.26 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.208 -0.451 . . . . 62.329999999999998 110.874 179.84 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 59.0 mm-40 -67.65 -36.8 81.42 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.195 -0.457 . . . . 71.430000000000007 110.904 -179.934 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 16.8 m-85 -62.82 -27.67 69.48 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.206 -0.452 . . . . 65.310000000000002 110.916 -179.841 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 1.5 t80 -60.07 -37.77 80.88 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.111 -0.495 . . . . 74.319999999999993 110.955 -179.924 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 2.1 mm-40 -61.47 -45.65 93.35 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.107 -0.497 . . . . 65.329999999999998 110.872 180.0 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 3.7 mp -65.76 -40.73 88.58 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.196 -0.456 . . . . 73.230000000000004 111.145 179.974 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . 0.553 ' HB3' HG21 ' A' ' 46' ' ' ILE . 80.5 mt-30 -59.2 -47.03 86.83 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.197 -0.456 . . . . 61.539999999999999 110.902 179.954 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 4.6 t -63.86 -42.34 97.58 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.21 -0.45 . . . . 62.520000000000003 110.844 -179.924 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -57.8 -33.51 68.66 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.199 -0.455 . . . . 71.450000000000003 110.842 -179.844 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . 0.487 ' OE1' ' CD1' ' A' ' 114' ' ' ILE . 1.4 mm-40 -67.25 -38.72 85.61 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.193 -0.458 . . . . 65.019999999999996 110.908 -179.996 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.456 ' CD2' HG13 ' A' ' 46' ' ' ILE . 8.6 mp -62.63 -51.53 66.9 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.142 -0.481 . . . . 73.25 110.916 179.993 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 1.8 pt-20 -68.72 -31.77 71.08 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.165 -0.47 . . . . 51.340000000000003 110.889 179.964 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -63.93 -48.39 76.75 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.177 -0.465 . . . . 75.319999999999993 111.082 179.928 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . 0.403 HG23 ' CD2' ' A' ' 26' ' ' TYR . 0.7 OUTLIER -76.93 -37.1 26.53 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.234 -0.439 . . . . 72.299999999999997 111.122 179.981 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 2.7 mtt180 -52.55 -34.22 49.14 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.198 -0.456 . . . . 72.239999999999995 110.844 -179.985 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -66.18 -37.81 86.5 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.194 -0.457 . . . . 71.310000000000002 110.874 -179.809 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . 0.742 HG21 ' HE1' ' A' ' 115' ' ' PHE . 3.2 mt -78.81 -45.16 25.11 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.127 -0.488 . . . . 72.219999999999999 111.171 179.922 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' TYR . . . . . 0.403 ' CD2' HG23 ' A' ' 22' ' ' ILE . 17.5 m-85 -106.94 45.11 1.0 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.168 -0.469 . . . . 62.329999999999998 110.916 179.998 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 1.5 mtm -45.15 -61.25 1.72 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.11 -0.496 . . . . 55.119999999999997 110.902 179.871 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 15.6 m-20 -75.5 -28.55 59.22 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.2 -0.454 . . . . 73.030000000000001 110.892 179.95 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -94.2 37.84 1.1 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.153 -0.476 . . . . 53.25 110.871 -179.99 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' PHE . . . . . 0.571 ' HA ' HD13 ' A' ' 50' ' ' ILE . 9.3 t80 -117.71 129.06 55.48 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.191 -0.459 . . . . 74.219999999999999 110.889 -179.908 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 82.7 m -118.13 131.13 56.44 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.167 -0.47 . . . . 72.430000000000007 111.174 -179.962 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 9.4 t0 -105.12 114.46 28.67 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.244 -0.434 . . . . 71.219999999999999 110.833 179.959 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 1.139 HD21 ' CE1' ' A' ' 67' ' ' HIS . 0.2 OUTLIER -111.05 -6.3 14.66 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.208 -0.451 . . . . 65.019999999999996 110.913 -179.965 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . 0.683 ' N ' HD12 ' A' ' 33' ' ' LEU . 0.2 OUTLIER -45.95 123.49 4.57 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.198 -0.456 . . . . 72.450000000000003 111.148 179.968 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -51.48 86.35 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.207 -0.451 . . . . 73.329999999999998 110.863 179.915 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . 0.493 ' N ' ' O ' ' A' ' 34' ' ' THR . 0.7 OUTLIER -105.12 -63.92 1.18 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.242 -0.435 . . . . 74.200000000000003 110.924 179.906 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . 0.42 ' HE2' ' C ' ' A' ' 37' ' ' LYS . 0.0 OUTLIER -138.75 138.83 38.02 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.149 -0.478 . . . . 54.020000000000003 110.887 179.959 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 58.0 m 61.39 99.9 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.205 -0.452 . . . . 64.219999999999999 110.838 -179.873 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 68.9 m -167.97 -172.64 1.86 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.141 -0.481 . . . . 55.130000000000003 110.902 -179.83 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 40' ' ' TRP . . . . . . . . . . . . . 30.0 p90 -108.69 -20.84 12.94 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.138 -0.483 . . . . 72.010000000000005 110.943 179.965 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . 0.413 ' C ' ' HG2' ' A' ' 42' ' ' LYS . 0.8 OUTLIER -131.23 167.16 19.66 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.244 -0.434 . . . . 43.25 110.892 179.911 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . 0.413 ' HG2' ' C ' ' A' ' 41' ' ' ASP . 2.9 mttt -142.58 63.87 1.38 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.196 -0.456 . . . . 75.430000000000007 110.918 -179.978 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 1.4 pp0? -150.43 61.81 5.01 Favored Pre-proline 0 C--N 1.33 -0.257 0 CA-C-O 121.629 0.728 . . . . 74.319999999999993 110.949 179.941 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.76 -163.52 0.11 Allowed 'Trans proline' 0 C--N 1.341 0.176 0 C-N-CA 122.683 2.255 . . . . 62.340000000000003 112.338 -179.974 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 45' ' ' GLN . . . . . 0.958 ' HG2' HG23 ' A' ' 47' ' ' ILE . 0.1 OUTLIER -179.68 32.64 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.188 -0.46 . . . . 62.009999999999998 110.895 -179.976 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . 0.674 HG22 ' O ' ' A' ' 45' ' ' GLN . 0.1 OUTLIER 86.82 -16.67 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.222 -0.444 . . . . 50.350000000000001 111.126 179.974 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . 0.958 HG23 ' HG2' ' A' ' 45' ' ' GLN . 0.1 OUTLIER -45.62 149.63 0.31 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-N 116.16 -0.473 . . . . 74.430000000000007 111.105 179.872 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 48' ' ' PHE . . . . . 0.465 ' HA ' ' CD1' ' A' ' 33' ' ' LEU . 27.8 p90 -158.46 171.09 20.79 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.122 -0.49 . . . . 75.230000000000004 110.885 179.936 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . 0.764 ' OE2' HD23 ' A' ' 33' ' ' LEU . 5.8 mt-10 -119.35 161.16 20.94 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.168 -0.469 . . . . 74.230000000000004 110.884 -179.924 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . 0.571 HD13 ' HA ' ' A' ' 30' ' ' PHE . 8.2 mm -142.96 137.43 26.86 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.147 -0.478 . . . . 62.420000000000002 111.087 179.994 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 85.5 m -83.9 131.58 34.85 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.17 -0.468 . . . . 60.130000000000003 111.105 179.971 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . 0.881 HD12 HD12 ' A' ' 66' ' ' LEU . 17.4 mt -134.79 159.5 41.15 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.187 -0.461 . . . . 72.030000000000001 110.873 179.989 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 53' ' ' ARG . . . . . 0.428 ' HD2' ' C ' ' A' ' 52' ' ' LEU . 0.0 OUTLIER 178.82 166.21 0.89 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.156 -0.474 . . . . 75.239999999999995 110.885 179.977 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -57.38 167.3 1.0 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.153 -0.476 . . . . 75.430000000000007 110.841 -179.789 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 19.2 m -78.91 -21.52 12.81 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.111 -0.495 . . . . 73.049999999999997 111.096 179.965 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 2.4 t70 -118.54 -172.05 2.2 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.201 -0.454 . . . . 73.439999999999998 110.837 179.97 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 3.3 mmmm -119.04 -17.51 8.98 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.218 -0.446 . . . . 73.340000000000003 110.919 179.962 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . 0.551 ' HA ' ' C ' ' A' ' 59' ' ' PRO . 4.7 pt-20 -120.08 145.77 40.74 Favored Pre-proline 0 C--N 1.33 -0.28 0 CA-C-O 121.664 0.745 . . . . 63.43 110.868 179.944 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 59' ' ' PRO . . . . . 0.551 ' C ' ' HA ' ' A' ' 58' ' ' GLU . 52.9 Cg_endo -69.81 -14.67 12.59 Favored 'Cis proline' 0 C--N 1.342 0.217 0 C-N-CA 122.697 -1.793 . . . . 74.329999999999998 112.303 0.073 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 60' ' ' VAL . . . . . 0.458 HG22 ' CG ' ' A' ' 129' ' ' GLN . 13.3 m -142.37 166.86 15.68 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.261 -0.427 . . . . 73.329999999999998 111.154 179.925 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 26.0 tt0 -102.88 -22.05 13.91 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.191 -0.459 . . . . 71.519999999999996 110.88 -179.952 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . 0.545 ' HB3' HD11 ' A' ' 125' ' ' LEU . 2.5 m 40.77 92.31 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.205 -0.452 . . . . 73.349999999999994 110.821 -179.783 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 1.1 p -108.95 123.07 48.53 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.12 -0.491 . . . . 63.25 110.886 -179.863 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 64' ' ' ILE . . . . . 0.488 HD11 HG21 ' A' ' 89' ' ' VAL . 41.6 mt -136.98 137.4 46.94 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.115 -0.493 . . . . 70.010000000000005 111.155 179.958 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 16.3 m -101.24 115.69 31.09 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.206 -0.452 . . . . 74.230000000000004 111.17 179.951 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . 0.924 HD21 ' CE1' ' A' ' 83' ' ' PHE . 14.8 mt -95.93 109.24 21.64 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.202 -0.454 . . . . 63.149999999999999 110.909 179.989 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 67' ' ' HIS . . . . . 1.139 ' CE1' HD21 ' A' ' 33' ' ' LEU . 3.6 t60 -101.76 110.46 22.45 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.208 -0.451 . . . . 64.540000000000006 110.813 179.894 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 68' ' ' PHE . . . . . 0.469 ' HA ' ' CG1' ' A' ' 81' ' ' ILE . 0.0 OUTLIER -101.74 138.91 38.09 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.17 -0.468 . . . . 74.319999999999993 110.87 -179.938 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . 0.627 ' HA ' HG22 ' A' ' 47' ' ' ILE . . . -118.68 123.56 45.22 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.157 -0.474 . . . . 61.109999999999999 111.119 179.903 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 70' ' ' MET . . . . . 0.669 ' CE ' HD11 ' A' ' 114' ' ' ILE . 7.8 mmt -90.72 89.88 7.7 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.241 -0.436 . . . . 74.310000000000002 110.864 179.99 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -47.06 159.55 0.38 Allowed Pre-proline 0 C--N 1.33 -0.274 0 CA-C-O 121.589 0.709 . . . . 71.230000000000004 111.122 -179.957 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 72' ' ' PRO . . . . . 0.421 ' O ' HD22 ' A' ' 8' ' ' LEU . 53.7 Cg_endo -69.76 2.15 3.79 Favored 'Trans proline' 0 C--N 1.342 0.201 0 C-N-CA 122.66 2.24 . . . . 75.310000000000002 112.348 179.926 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 73' ' ' MET . . . . . 0.675 ' HE3' HD21 ' A' ' 8' ' ' LEU . 0.0 OUTLIER -116.86 -25.82 7.14 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.245 -0.434 . . . . 74.230000000000004 110.873 179.886 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 74' ' ' TYR . . . . . 0.662 ' CD1' ' C ' ' A' ' 74' ' ' TYR . 0.0 OUTLIER -52.24 153.75 4.73 Favored Pre-proline 0 C--N 1.328 -0.364 0 CA-C-O 121.693 0.759 . . . . 72.129999999999995 110.898 -179.846 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 75' ' ' PRO . . . . . 0.534 ' C ' ' HA ' ' A' ' 74' ' ' TYR . 53.6 Cg_endo -69.74 -11.11 11.77 Favored 'Cis proline' 0 C--N 1.341 0.182 0 C-N-CA 122.682 -1.799 . . . . 72.420000000000002 112.359 -0.114 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 76' ' ' TYR . . . . . 0.5 ' CB ' ' O ' ' A' ' 73' ' ' MET . 10.2 t80 -33.91 -57.01 0.47 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.241 -0.436 . . . . 72.150000000000006 110.947 -179.947 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 77' ' ' THR . . . . . 0.669 HG23 ' HB3' ' A' ' 73' ' ' MET . 30.4 p -97.72 -179.66 4.52 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.098 -0.501 . . . . 71.219999999999999 111.089 -179.955 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -94.88 129.25 36.45 Favored Pre-proline 0 C--N 1.329 -0.291 0 CA-C-O 121.623 0.725 . . . . 73.329999999999998 111.068 179.888 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 79' ' ' PRO . . . . . 0.596 ' HG3' HD11 ' A' ' 113' ' ' ILE . 53.4 Cg_endo -69.78 174.09 10.04 Favored 'Trans proline' 0 C--N 1.342 0.205 0 C-N-CA 122.666 2.244 . . . . 62.039999999999999 112.344 -179.988 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . 0.408 ' O ' HG13 ' A' ' 81' ' ' ILE . 3.1 tt0 -118.45 138.54 52.41 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.196 -0.456 . . . . 73.140000000000001 110.874 -179.975 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 81' ' ' ILE . . . . . 0.469 ' CG1' ' HA ' ' A' ' 68' ' ' PHE . 15.0 mt -144.56 148.93 17.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.131 -0.486 . . . . 71.530000000000001 111.118 179.983 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . 0.514 ' HG3' ' CD ' ' A' ' 84' ' ' LYS . 11.3 pt-20 -146.34 148.28 32.21 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.188 -0.46 . . . . 71.049999999999997 110.88 179.953 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 83' ' ' PHE . . . . . 0.924 ' CE1' HD21 ' A' ' 66' ' ' LEU . 49.6 m-85 -90.42 136.68 32.9 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.172 -0.467 . . . . 71.439999999999998 110.915 -179.975 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 84' ' ' LYS . . . . . 0.514 ' CD ' ' HG3' ' A' ' 82' ' ' GLU . 9.4 mmmt -125.82 169.95 12.1 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.12 -0.491 . . . . 74.030000000000001 110.893 -179.996 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . 0.469 ' O ' ' C ' ' A' ' 86' ' ' VAL . 5.7 m-80 62.63 -73.03 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.251 -0.431 . . . . 72.150000000000006 110.903 179.981 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 86' ' ' VAL . . . . . 0.654 HG23 ' O ' ' A' ' 86' ' ' VAL . 30.5 m 31.86 91.34 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.226 -0.443 . . . . 73.239999999999995 111.132 179.919 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -96.18 -72.99 0.61 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.172 -0.467 . . . . 64.510000000000005 110.932 -179.98 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 88' ' ' ASN . . . . . 0.439 ' CG ' ' HB ' ' A' ' 60' ' ' VAL . 70.2 m-80 -76.95 54.12 0.99 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.158 -0.473 . . . . 64.340000000000003 110.927 -179.995 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 89' ' ' VAL . . . . . 0.488 HG21 HD11 ' A' ' 64' ' ' ILE . 16.2 t -139.2 154.99 25.95 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.203 -0.453 . . . . 64.310000000000002 111.114 179.954 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 90' ' ' MET . . . . . . . . . . . . . 4.8 mtm -100.95 -69.59 0.77 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.177 -0.465 . . . . 64.120000000000005 110.866 179.938 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 4.3 p-10 173.62 -44.63 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.201 -0.454 . . . . 72.349999999999994 110.86 179.945 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -54.38 -38.69 66.43 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.222 -0.444 . . . . 53.509999999999998 110.857 -179.74 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 93' ' ' GLN . . . . . 0.596 ' OE1' ' CD2' ' A' ' 128' ' ' PHE . 0.0 OUTLIER -66.6 -42.69 86.52 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.169 -0.469 . . . . 43.549999999999997 110.91 -179.969 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 84.1 mt -62.26 -48.29 80.58 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.158 -0.474 . . . . 74.299999999999997 110.927 -179.983 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -65.45 -34.27 77.88 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.205 -0.452 . . . . 75.420000000000002 110.92 179.88 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 96' ' ' MET . . . . . . . . . . . . . 26.8 ttp -59.99 -39.36 85.45 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.194 -0.457 . . . . 44.109999999999999 110.878 179.939 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 97' ' ' LEU . . . . . 0.747 HD22 HG22 ' A' ' 121' ' ' THR . 17.3 mt -66.85 -39.65 87.65 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.243 -0.435 . . . . 55.210000000000001 110.908 -179.98 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 5.2 mmtm -56.29 -38.0 70.63 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.198 -0.455 . . . . 73.420000000000002 110.876 179.853 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 1.7 m -69.58 -39.64 77.2 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.237 -0.438 . . . . 74.329999999999998 110.85 -179.885 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 100' ' ' GLU . . . . . 0.68 ' O ' HD12 ' A' ' 104' ' ' ILE . 68.4 mm-40 -69.22 -24.53 64.03 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.137 -0.483 . . . . 75.209999999999994 110.876 -179.912 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 101' ' ' PHE . . . . . 0.649 ' CG ' HD11 ' A' ' 117' ' ' ILE . 6.9 m-30 -63.0 -32.39 73.74 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.155 -0.475 . . . . 72.010000000000005 110.886 -179.947 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 102' ' ' LYS . . . . . 0.437 ' HE2' ' C ' ' A' ' 102' ' ' LYS . 2.3 ttpt -70.5 -41.79 72.17 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.171 -0.468 . . . . 74.310000000000002 110.893 179.965 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 12.2 ttpt -66.87 -41.17 87.74 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.223 -0.444 . . . . 73.310000000000002 110.912 179.872 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 104' ' ' ILE . . . . . 0.68 HD12 ' O ' ' A' ' 100' ' ' GLU . 3.2 mt -64.84 -47.59 87.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.22 -0.445 . . . . 63.149999999999999 111.112 179.856 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 105' ' ' HIS . . . . . 0.429 ' O ' ' N ' ' A' ' 109' ' ' ARG . 10.1 t60 -62.91 -41.23 99.39 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.224 -0.444 . . . . 74.140000000000001 110.889 179.899 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 106' ' ' ASN . . . . . 0.403 ' ND2' ' HE3' ' A' ' 102' ' ' LYS . 0.4 OUTLIER -59.11 -42.59 90.9 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.217 -0.447 . . . . 65.219999999999999 110.904 -179.962 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 10.4 t -81.97 -27.14 33.38 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.184 -0.462 . . . . 75.420000000000002 111.152 -179.97 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 108' ' ' SER . . . . . 0.515 ' HB2' HG22 ' A' ' 113' ' ' ILE . 40.5 m -107.44 24.31 13.08 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.225 -0.443 . . . . 32.310000000000002 110.839 -179.869 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 109' ' ' ARG . . . . . 0.429 ' N ' ' O ' ' A' ' 105' ' ' HIS . 18.0 ttt180 -71.65 81.76 0.84 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.156 -0.475 . . . . 71.129999999999995 110.861 -179.924 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 155.51 -33.35 0.64 Allowed Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 120.774 -0.727 . . . . 25.420000000000002 112.54 -179.931 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 111' ' ' GLN . . . . . . . . . . . . . 10.5 pt20 -112.09 -158.72 0.66 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.746 0.308 . . . . 65.230000000000004 110.92 -179.862 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 4.0 mt-10 -69.85 136.65 50.97 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.242 -0.435 . . . . 61.549999999999997 110.871 -179.943 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 113' ' ' ILE . . . . . 0.596 HD11 ' HG3' ' A' ' 79' ' ' PRO . 2.3 pt -123.95 -6.73 7.21 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.108 -0.496 . . . . 74.230000000000004 111.095 179.998 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 114' ' ' ILE . . . . . 0.868 ' H ' HD12 ' A' ' 114' ' ' ILE . 3.5 mp -68.22 -46.66 80.74 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-N 116.194 -0.457 . . . . 65.439999999999998 111.155 179.834 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 115' ' ' PHE . . . . . 0.742 ' HE1' HG21 ' A' ' 25' ' ' ILE . 11.4 t80 -65.19 -37.46 87.42 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.142 -0.481 . . . . 72.219999999999999 110.916 179.91 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 6.6 mm-40 -67.87 -45.24 75.11 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.106 -0.497 . . . . 74.430000000000007 110.897 -179.947 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 117' ' ' ILE . . . . . 0.649 HD11 ' CG ' ' A' ' 101' ' ' PHE . 0.4 OUTLIER -67.55 -40.92 85.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.157 -0.474 . . . . 73.340000000000003 111.085 -179.981 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 118' ' ' THR . . . . . 0.69 HG23 ' O ' ' A' ' 114' ' ' ILE . 81.3 p -68.79 -43.49 75.59 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.204 -0.453 . . . . 73.340000000000003 111.134 179.978 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 3.3 t -68.1 -44.42 76.24 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.262 -0.427 . . . . 64.140000000000001 110.836 -179.832 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 4.6 t80 -62.9 -45.2 93.63 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.146 -0.479 . . . . 75.420000000000002 110.887 -179.939 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 121' ' ' THR . . . . . 0.747 HG22 HD22 ' A' ' 97' ' ' LEU . 17.1 p -66.23 -45.32 81.06 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.099 -0.5 . . . . 74.099999999999994 111.138 -179.892 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 40.8 tt0 -65.26 -43.81 90.08 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.266 -0.425 . . . . 73.510000000000005 110.902 -179.99 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 11.1 pt-20 -70.61 -28.8 65.12 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.178 -0.465 . . . . 62.310000000000002 110.895 -179.945 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 124' ' ' LYS . . . . . 0.463 ' CE ' ' HA ' ' A' ' 124' ' ' LYS . 0.2 OUTLIER -78.99 -40.86 30.46 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.173 -0.467 . . . . 74.120000000000005 110.894 179.921 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 125' ' ' LEU . . . . . 0.641 HD23 ' O ' ' A' ' 125' ' ' LEU . 0.7 OUTLIER -69.98 -38.1 75.93 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.236 -0.438 . . . . 61.350000000000001 110.949 179.906 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -66.7 -46.31 75.97 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.185 -0.461 . . . . 73.439999999999998 110.837 179.866 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 127' ' ' GLU . . . . . 0.443 ' OE1' ' C ' ' A' ' 127' ' ' GLU . 1.6 pp20? -65.88 -28.19 68.77 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.185 -0.461 . . . . 72.420000000000002 110.873 -179.885 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 128' ' ' PHE . . . . . 0.596 ' CD2' ' OE1' ' A' ' 93' ' ' GLN . 0.2 OUTLIER -78.83 -62.57 1.65 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.144 -0.48 . . . . 72.549999999999997 110.9 -179.913 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 129' ' ' GLN . . . . . 0.458 ' CG ' HG22 ' A' ' 60' ' ' VAL . 1.0 OUTLIER -34.73 -47.24 0.33 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.15 -0.477 . . . . 51.310000000000002 110.912 -179.938 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 130' ' ' ASN . . . . . . . . . . . . . 8.9 t-20 -49.34 -64.89 0.67 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.246 -0.434 . . . . 74.25 110.873 -179.963 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 131' ' ' VAL . . . . . 0.458 HG13 ' N ' ' A' ' 132' ' ' VAL . 5.7 p -176.58 -45.25 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.207 -0.451 . . . . 71.409999999999997 111.105 179.889 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 132' ' ' VAL . . . . . 0.603 HG22 ' N ' ' A' ' 133' ' ' ASN . 12.1 p -173.5 164.44 0.25 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.197 -0.456 . . . . 73.209999999999994 111.12 179.946 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 133' ' ' ASN . . . . . 0.603 ' N ' HG22 ' A' ' 132' ' ' VAL . 3.3 m120 -43.42 104.95 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.181 -0.463 . . . . 73.349999999999994 110.889 -179.982 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 134' ' ' THR . . . . . . . . . . . . . 34.2 m -108.62 -60.36 1.75 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.149 -0.478 . . . . 64.219999999999999 111.146 -179.974 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -67.99 165.56 17.61 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.222 -0.445 . . . . 73.0 110.892 -179.984 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -159.19 80.8 0.76 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.193 -0.458 . . . . 61.509999999999998 110.867 -179.84 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 137' ' ' LEU . . . . . . . . . . . . . 3.0 tt 54.4 88.23 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.148 -0.478 . . . . 71.230000000000004 110.934 179.988 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 2.9 mt-10 . . . . . 0 C--N 1.33 -0.276 0 CA-C-N 116.143 -0.48 . . . . 74.519999999999996 110.876 179.962 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 3.3 tpp . . . . . 0 C--O 1.231 0.088 0 CA-C-O 120.807 0.337 . . . . 74.349999999999994 110.857 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -144.08 143.89 31.36 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.194 -0.457 . . . . 74.209999999999994 110.887 -179.814 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -104.97 38.97 1.8 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.16 -0.473 . . . . 64.5 110.894 -179.966 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . 0.441 ' O ' ' C ' ' A' ' 5' ' ' HIS . 18.0 p -48.82 -80.43 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.184 -0.462 . . . . 73.239999999999995 110.877 -179.947 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 5' ' ' HIS . . . . . 0.441 ' C ' ' O ' ' A' ' 4' ' ' SER . 34.4 t60 35.11 88.64 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.147 -0.479 . . . . 73.030000000000001 110.821 179.976 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 5.2 tt 55.37 95.23 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.212 -0.449 . . . . 71.099999999999994 110.945 -179.976 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 5.5 t -161.84 172.19 16.52 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.214 -0.448 . . . . 53.549999999999997 111.141 179.98 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.585 HD21 ' CE ' ' A' ' 73' ' ' MET . 60.4 mt -69.18 -21.67 63.96 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.198 -0.455 . . . . 74.230000000000004 110.903 179.992 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . 0.437 ' O ' ' HB2' ' A' ' 12' ' ' TYR . 16.3 t70 -50.51 -33.38 21.28 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.21 -0.45 . . . . 51.530000000000001 110.841 179.831 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 2.3 mm-40 -70.11 -40.76 74.69 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.19 -0.459 . . . . 74.409999999999997 110.914 -179.865 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 12.7 m-85 -50.99 -24.72 3.92 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.199 -0.455 . . . . 72.409999999999997 110.929 -179.872 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' TYR . . . . . 0.437 ' HB2' ' O ' ' A' ' 9' ' ' ASP . 0.1 OUTLIER -59.17 -36.23 74.94 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.127 -0.488 . . . . 74.340000000000003 110.919 -179.947 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . 0.505 ' HG3' ' N ' ' A' ' 14' ' ' ILE . 6.5 pt-20 -60.28 -42.87 96.36 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.12 -0.491 . . . . 63.140000000000001 110.901 -179.938 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . 0.505 ' N ' ' HG3' ' A' ' 13' ' ' GLU . 3.9 mp -68.46 -39.95 81.46 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.144 -0.48 . . . . 71.099999999999994 111.149 179.927 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . 0.481 ' HG2' ' CE1' ' A' ' 74' ' ' TYR . 79.8 mt-30 -63.63 -48.28 77.91 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.175 -0.466 . . . . 50.409999999999997 110.888 179.941 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -64.84 -39.18 93.15 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.211 -0.449 . . . . 55.030000000000001 110.95 -179.958 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -59.08 -33.82 71.26 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.183 -0.462 . . . . 75.109999999999999 110.902 -179.927 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 2.1 mm-40 -66.61 -41.01 89.04 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.152 -0.477 . . . . 71.519999999999996 110.892 179.972 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.866 HD11 HG13 ' A' ' 46' ' ' ILE . 6.0 mt -59.96 -51.39 69.88 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.164 -0.471 . . . . 64.310000000000002 110.898 -179.941 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 5.0 pt-20 -68.34 -34.95 77.02 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.191 -0.459 . . . . 75.329999999999998 110.891 179.916 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -62.76 -50.6 70.41 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.157 -0.474 . . . . 74.340000000000003 111.099 179.923 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . 0.737 ' HA ' HD12 ' A' ' 25' ' ' ILE . 0.6 OUTLIER -77.65 -34.27 20.03 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.155 -0.475 . . . . 64.109999999999999 111.151 179.991 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 1.6 mtt180 -52.25 -35.23 49.23 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.202 -0.454 . . . . 64.340000000000003 110.887 179.94 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -67.23 -29.14 68.71 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.167 -0.47 . . . . 63.32 110.857 -179.743 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . 0.93 HD13 ' CE1' ' A' ' 115' ' ' PHE . 4.5 mt -84.49 -45.21 17.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.092 -0.504 . . . . 61.130000000000003 111.163 179.896 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 16.1 m-85 -110.38 46.69 1.02 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.196 -0.456 . . . . 75.140000000000001 110.904 -179.975 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 5.1 mtm -43.95 -61.83 1.32 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.114 -0.494 . . . . 64.5 110.9 179.897 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -82.7 -19.28 38.36 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.235 -0.438 . . . . 64.219999999999999 110.894 179.924 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 45.2 m-20 -100.55 37.15 1.75 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.209 -0.45 . . . . 74.200000000000003 110.885 179.967 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 30' ' ' PHE . . . . . 0.409 ' HA ' HD13 ' A' ' 50' ' ' ILE . 3.9 t80 -125.5 126.28 44.61 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.186 -0.461 . . . . 74.230000000000004 110.869 -179.898 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 52.7 m -118.1 133.27 56.06 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.167 -0.47 . . . . 74.129999999999995 111.116 -179.958 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 5.7 t0 -103.74 114.32 28.49 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.236 -0.438 . . . . 74.540000000000006 110.892 179.863 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.727 HD12 ' N ' ' A' ' 34' ' ' THR . 0.2 OUTLIER -103.34 -5.44 22.99 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.182 -0.463 . . . . 74.109999999999999 110.885 -179.91 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . 0.727 ' N ' HD12 ' A' ' 33' ' ' LEU . 0.3 OUTLIER -36.37 121.49 0.71 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.198 -0.456 . . . . 72.349999999999994 111.143 179.933 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . 0.488 ' HB3' ' CH2' ' A' ' 40' ' ' TRP . 6.7 mttm -44.15 92.9 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.266 -0.424 . . . . 73.439999999999998 110.89 179.886 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . 0.455 ' N ' ' O ' ' A' ' 34' ' ' THR . 29.9 mmt180 -88.32 179.25 6.38 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.236 -0.438 . . . . 71.140000000000001 110.838 -179.999 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -49.95 124.33 9.78 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.164 -0.471 . . . . 60.240000000000002 110.921 179.952 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . 0.486 ' HB3' ' CE3' ' A' ' 40' ' ' TRP . 0.2 OUTLIER 177.09 -168.62 0.06 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.227 -0.442 . . . . 73.439999999999998 110.905 -179.858 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 1.5 m -127.59 96.28 4.49 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.174 -0.467 . . . . 72.329999999999998 110.842 -179.847 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 40' ' ' TRP . . . . . 0.488 ' CH2' ' HB3' ' A' ' 35' ' ' LYS . 0.2 OUTLIER 179.84 -34.85 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.144 -0.48 . . . . 74.519999999999996 110.956 179.977 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER 178.28 146.66 0.15 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.217 -0.447 . . . . 73.349999999999994 110.852 179.918 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 3.3 mttt -141.72 72.01 1.37 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.176 -0.465 . . . . 63.130000000000003 110.935 179.969 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . 0.488 ' N ' ' CD ' ' A' ' 44' ' ' PRO . 5.7 mt-30 -149.0 51.25 0.93 Allowed Pre-proline 0 C--N 1.329 -0.298 0 CA-C-O 121.629 0.728 . . . . 73.299999999999997 110.891 179.981 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 44' ' ' PRO . . . . . 0.488 ' CD ' ' N ' ' A' ' 43' ' ' GLN . 53.6 Cg_endo -69.8 -164.51 0.13 Allowed 'Trans proline' 0 C--N 1.341 0.171 0 C-N-CA 122.713 2.275 . . . . 64.019999999999996 112.278 -179.99 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 45' ' ' GLN . . . . . 0.839 ' HG2' HG23 ' A' ' 47' ' ' ILE . 18.0 pt20 -179.13 38.24 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.199 -0.455 . . . . 51.340000000000003 110.906 -179.973 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . 0.866 HG13 HD11 ' A' ' 19' ' ' LEU . 0.0 OUTLIER 84.83 -24.46 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.236 -0.438 . . . . 74.310000000000002 111.089 179.946 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . 0.839 HG23 ' HG2' ' A' ' 45' ' ' GLN . 0.2 OUTLIER -32.7 143.66 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.181 -0.463 . . . . 75.540000000000006 111.154 179.864 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 11.8 p90 -156.92 174.43 15.52 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.216 -0.447 . . . . 64.409999999999997 110.873 179.958 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . 0.466 ' CG ' ' HB2' ' A' ' 67' ' ' HIS . 6.3 mt-10 -123.54 161.03 25.73 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.146 -0.479 . . . . 74.230000000000004 110.888 -179.908 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . 0.411 HD13 ' HA ' ' A' ' 50' ' ' ILE . 13.6 mm -138.04 129.34 38.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.171 -0.468 . . . . 71.450000000000003 111.084 -179.988 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 89.3 m -84.01 121.91 28.04 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.142 -0.481 . . . . 72.129999999999995 111.141 179.932 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . 0.725 HD12 HD12 ' A' ' 66' ' ' LEU . 27.4 mt -121.56 166.06 14.77 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.23 -0.441 . . . . 54.350000000000001 110.941 179.935 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 53' ' ' ARG . . . . . 0.508 ' C ' HD21 ' A' ' 125' ' ' LEU . 18.8 ptt180 -179.31 164.79 1.39 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.206 -0.452 . . . . 63.109999999999999 110.85 179.97 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . 0.735 ' N ' HD21 ' A' ' 125' ' ' LEU . 1.7 m -60.65 167.8 2.52 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.164 -0.471 . . . . 54.539999999999999 110.867 -179.809 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 27.5 m -76.9 -24.72 15.42 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.119 -0.491 . . . . 61.32 111.155 179.93 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 3.2 t0 -120.5 -171.97 2.28 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.147 -0.479 . . . . 73.329999999999998 110.845 179.936 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 7.4 mmmt -116.11 -20.53 9.83 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.141 -0.481 . . . . 74.120000000000005 110.888 179.969 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . 0.558 ' HA ' ' C ' ' A' ' 59' ' ' PRO . 6.3 pt-20 -115.15 144.38 32.05 Favored Pre-proline 0 C--N 1.329 -0.298 0 CA-C-O 121.674 0.749 . . . . 73.430000000000007 110.831 179.959 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 59' ' ' PRO . . . . . 0.558 ' C ' ' HA ' ' A' ' 58' ' ' GLU . 53.5 Cg_endo -69.79 -13.88 12.5 Favored 'Cis proline' 0 C--N 1.342 0.192 0 C-N-CA 122.683 -1.799 . . . . 74.530000000000001 112.308 -0.017 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 60' ' ' VAL . . . . . 0.476 HG22 ' CG ' ' A' ' 129' ' ' GLN . 10.2 m -147.32 171.3 3.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-N 116.266 -0.424 . . . . 65.409999999999997 111.148 179.892 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . 0.462 ' O ' ' C ' ' A' ' 62' ' ' SER . 1.4 pt-20 -107.1 -18.41 13.9 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.165 -0.47 . . . . 72.420000000000002 110.914 179.967 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . 0.738 ' HB2' HD11 ' A' ' 125' ' ' LEU . 71.1 m 32.72 90.55 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.143 -0.481 . . . . 52.119999999999997 110.915 -179.821 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 26.8 t -107.75 123.16 48.13 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.131 -0.486 . . . . 72.310000000000002 110.866 -179.802 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 64' ' ' ILE . . . . . 0.949 HD11 HG21 ' A' ' 89' ' ' VAL . 35.8 mt -134.77 135.39 53.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-N 116.125 -0.489 . . . . 74.540000000000006 111.161 179.921 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 53.1 m -104.98 114.58 28.88 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.171 -0.468 . . . . 63.549999999999997 111.078 -179.947 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . 0.725 HD12 HD12 ' A' ' 52' ' ' LEU . 19.9 mt -91.46 109.8 21.09 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.234 -0.439 . . . . 53.119999999999997 110.913 179.929 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 67' ' ' HIS . . . . . 0.617 ' CE1' HD21 ' A' ' 33' ' ' LEU . 0.8 OUTLIER -90.25 109.48 20.57 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.18 -0.464 . . . . 74.219999999999999 110.855 179.844 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 68' ' ' PHE . . . . . 0.672 ' HD2' HD12 ' A' ' 81' ' ' ILE . 0.0 OUTLIER -104.33 139.54 39.17 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.219 -0.446 . . . . 74.439999999999998 110.872 -179.904 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . 0.427 ' O ' ' CB ' ' A' ' 79' ' ' PRO . . . -121.84 129.33 52.52 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.149 -0.478 . . . . 62.439999999999998 111.085 179.942 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 70' ' ' MET . . . . . 0.521 ' CE ' HD11 ' A' ' 114' ' ' ILE . 1.0 OUTLIER -100.64 102.61 13.78 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.219 -0.446 . . . . 74.099999999999994 110.898 179.929 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -58.66 160.12 11.08 Favored Pre-proline 0 C--N 1.329 -0.283 0 CA-C-O 121.595 0.712 . . . . 71.230000000000004 111.137 -179.908 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.75 -2.2 9.76 Favored 'Trans proline' 0 C--N 1.341 0.162 0 C-N-CA 122.706 2.271 . . . . 73.430000000000007 112.333 179.992 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 73' ' ' MET . . . . . 0.954 ' HG2' HG23 ' A' ' 77' ' ' THR . 2.0 ttm -117.58 -18.28 9.77 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.232 -0.44 . . . . 71.540000000000006 110.889 179.886 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 74' ' ' TYR . . . . . 0.685 ' CD1' ' C ' ' A' ' 74' ' ' TYR . 0.0 OUTLIER -58.58 162.28 6.73 Favored Pre-proline 0 C--N 1.328 -0.354 0 CA-C-O 121.729 0.776 . . . . 71.129999999999995 110.875 -179.832 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 75' ' ' PRO . . . . . 0.552 ' HA ' ' CD2' ' A' ' 74' ' ' TYR . 53.3 Cg_endo -69.75 -4.83 8.52 Favored 'Cis proline' 0 C--N 1.341 0.156 0 C-N-CA 122.678 -1.801 . . . . 71.450000000000003 112.343 -0.087 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 76' ' ' TYR . . . . . 0.447 ' N ' ' HA ' ' A' ' 74' ' ' TYR . 0.3 OUTLIER -35.95 -60.49 0.54 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.199 -0.455 . . . . 74.430000000000007 110.877 -179.912 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 77' ' ' THR . . . . . 0.954 HG23 ' HG2' ' A' ' 73' ' ' MET . 33.6 p -88.08 -170.57 3.03 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.141 -0.481 . . . . 71.409999999999997 111.123 -179.973 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -105.01 123.1 40.93 Favored Pre-proline 0 C--N 1.33 -0.282 0 CA-C-O 121.593 0.711 . . . . 54.530000000000001 111.069 179.878 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 79' ' ' PRO . . . . . 0.634 ' HG3' HD11 ' A' ' 113' ' ' ILE . 53.8 Cg_endo -69.79 -165.46 0.16 Allowed 'Trans proline' 0 C--N 1.341 0.176 0 C-N-CA 122.696 2.264 . . . . 74.230000000000004 112.339 179.952 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . 0.463 ' HG3' ' N ' ' A' ' 81' ' ' ILE . 1.5 tt0 -128.0 141.7 51.44 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.19 -0.459 . . . . 73.150000000000006 110.846 -179.968 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 81' ' ' ILE . . . . . 0.672 HD12 ' HD2' ' A' ' 68' ' ' PHE . 9.1 mm -138.41 138.09 43.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.113 -0.494 . . . . 71.430000000000007 111.109 179.969 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . 0.492 ' HG3' ' CD ' ' A' ' 84' ' ' LYS . 4.4 pt-20 -147.7 144.69 28.5 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.144 -0.48 . . . . 63.240000000000002 110.885 179.958 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 83' ' ' PHE . . . . . 0.745 ' HD2' HG21 ' A' ' 64' ' ' ILE . 1.8 m-85 -95.16 139.82 30.95 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.156 -0.474 . . . . 71.25 110.922 -179.943 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 84' ' ' LYS . . . . . 0.492 ' CD ' ' HG3' ' A' ' 82' ' ' GLU . 10.6 mmmt -124.64 175.26 7.31 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.164 -0.471 . . . . 72.329999999999998 110.888 -179.998 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 3.9 m-80 61.63 -75.01 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.223 -0.444 . . . . 65.319999999999993 110.914 179.956 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 86' ' ' VAL . . . . . 0.472 ' N ' ' O ' ' A' ' 84' ' ' LYS . 4.2 m 37.4 87.04 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.178 -0.465 . . . . 64.310000000000002 111.141 179.878 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -98.74 -69.15 0.77 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.207 -0.452 . . . . 74.340000000000003 110.889 -179.98 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 88' ' ' ASN . . . . . 0.437 ' CG ' ' HB ' ' A' ' 60' ' ' VAL . 62.3 m-80 -83.28 42.24 0.81 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.248 -0.433 . . . . 54.409999999999997 110.889 -179.978 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 89' ' ' VAL . . . . . 0.949 HG21 HD11 ' A' ' 64' ' ' ILE . 38.7 t -134.48 146.75 30.51 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.191 -0.459 . . . . 75.349999999999994 111.143 179.923 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 90' ' ' MET . . . . . . . . . . . . . 16.5 mtm -96.51 -70.99 0.69 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.144 -0.48 . . . . 74.409999999999997 110.876 179.918 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER 171.29 -31.62 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.192 -0.458 . . . . 73.0 110.92 179.993 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -55.96 -46.66 78.53 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.157 -0.474 . . . . 63.340000000000003 110.879 -179.776 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 93' ' ' GLN . . . . . 0.657 ' CD ' HG13 ' A' ' 89' ' ' VAL . 3.4 pt20 -70.56 -40.75 73.16 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.155 -0.475 . . . . 74.540000000000006 110.935 179.991 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . 0.699 ' HG ' HG11 ' A' ' 89' ' ' VAL . 54.8 mt -57.81 -48.98 78.15 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.159 -0.473 . . . . 65.219999999999999 110.914 -179.963 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -65.86 -33.83 76.74 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.151 -0.477 . . . . 64.120000000000005 110.879 179.949 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 96' ' ' MET . . . . . 0.485 ' HG2' ' N ' ' A' ' 97' ' ' LEU . 0.0 OUTLIER -59.73 -36.49 76.68 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.213 -0.448 . . . . 75.230000000000004 110.867 179.98 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 97' ' ' LEU . . . . . 0.558 HD13 HG22 ' A' ' 121' ' ' THR . 17.0 mt -69.01 -41.68 77.42 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.194 -0.457 . . . . 73.140000000000001 110.925 -179.962 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -55.04 -36.65 65.76 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.159 -0.473 . . . . 73.439999999999998 110.895 179.864 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -67.46 -43.38 81.2 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.226 -0.443 . . . . 55.350000000000001 110.883 -179.948 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 100' ' ' GLU . . . . . 0.4 ' O ' HD12 ' A' ' 104' ' ' ILE . 1.9 mp0 -71.92 -25.22 61.82 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.119 -0.491 . . . . 72.140000000000001 110.87 -179.953 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 101' ' ' PHE . . . . . 0.645 ' CD2' HD11 ' A' ' 117' ' ' ILE . 10.8 m-30 -59.51 -26.84 65.64 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.188 -0.46 . . . . 71.049999999999997 110.897 -179.944 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 102' ' ' LYS . . . . . 0.428 ' HE2' ' C ' ' A' ' 102' ' ' LYS . 0.2 OUTLIER -72.18 -41.72 66.69 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.141 -0.482 . . . . 74.129999999999995 110.875 179.967 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.39 -40.48 73.92 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.244 -0.434 . . . . 72.25 110.869 179.895 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 104' ' ' ILE . . . . . 0.661 HD11 ' CD2' ' A' ' 120' ' ' PHE . 4.0 mt -62.46 -47.11 94.55 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-N 116.245 -0.434 . . . . 74.120000000000005 111.093 179.881 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 105' ' ' HIS . . . . . 0.48 ' CE1' ' HG3' ' A' ' 109' ' ' ARG . 16.8 t60 -62.97 -41.0 99.4 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.184 -0.462 . . . . 75.430000000000007 110.865 179.91 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 1.1 t-20 -59.51 -38.25 80.46 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.205 -0.452 . . . . 60.539999999999999 110.927 -179.945 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 107' ' ' THR . . . . . 0.405 HG22 ' O ' ' A' ' 104' ' ' ILE . 6.8 t -83.21 -27.95 29.62 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.155 -0.475 . . . . 75.430000000000007 111.096 179.995 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 1.6 m -112.89 46.7 1.18 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.278 -0.419 . . . . 72.109999999999999 110.85 -179.837 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 109' ' ' ARG . . . . . 0.48 ' HG3' ' CE1' ' A' ' 105' ' ' HIS . 2.7 ttp-105 -97.89 84.5 3.34 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.143 -0.481 . . . . 72.120000000000005 110.873 -179.976 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 110' ' ' GLY . . . . . 0.421 ' HA2' ' CG ' ' A' ' 75' ' ' PRO . . . 137.99 1.3 2.35 Favored Glycine 0 N--CA 1.452 -0.296 0 C-N-CA 120.768 -0.73 . . . . 71.530000000000001 112.488 -179.981 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 111' ' ' GLN . . . . . 0.505 ' O ' ' CG ' ' A' ' 112' ' ' GLU . 11.4 mm-40 -127.64 -75.11 0.57 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.732 0.301 . . . . 75.450000000000003 110.934 -179.923 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 112' ' ' GLU . . . . . 0.505 ' CG ' ' O ' ' A' ' 111' ' ' GLN . 31.0 mt-10 -163.6 141.74 7.68 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.223 -0.444 . . . . 63.420000000000002 110.875 -179.945 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 113' ' ' ILE . . . . . 0.634 HD11 ' HG3' ' A' ' 79' ' ' PRO . 21.7 pt -128.34 -10.93 3.4 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.118 -0.492 . . . . 71.150000000000006 111.16 179.963 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 114' ' ' ILE . . . . . 0.759 ' O ' HG23 ' A' ' 118' ' ' THR . 25.5 mm -66.87 -44.72 88.75 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.148 -0.478 . . . . 71.430000000000007 111.149 179.846 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 115' ' ' PHE . . . . . 0.93 ' CE1' HD13 ' A' ' 25' ' ' ILE . 11.3 t80 -72.55 -37.04 68.37 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.141 -0.481 . . . . 73.430000000000007 110.873 179.976 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 6.7 mm-40 -67.39 -45.51 76.0 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.141 -0.481 . . . . 73.549999999999997 110.901 -179.924 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 117' ' ' ILE . . . . . 0.645 HD11 ' CD2' ' A' ' 101' ' ' PHE . 1.0 OUTLIER -66.91 -42.12 88.48 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.101 -0.499 . . . . 73.340000000000003 111.137 179.97 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 118' ' ' THR . . . . . 0.759 HG23 ' O ' ' A' ' 114' ' ' ILE . 79.8 p -68.21 -40.16 82.19 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.172 -0.467 . . . . 70.510000000000005 111.132 179.953 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 4.5 t -68.03 -44.03 77.39 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.226 -0.443 . . . . 71.230000000000004 110.857 -179.82 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 120' ' ' PHE . . . . . 0.661 ' CD2' HD11 ' A' ' 104' ' ' ILE . 0.3 OUTLIER -60.5 -46.23 90.9 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.111 -0.495 . . . . 63.399999999999999 110.868 -179.928 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 121' ' ' THR . . . . . 0.713 HG21 HD11 ' A' ' 66' ' ' LEU . 44.4 p -69.34 -39.09 78.37 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.183 -0.462 . . . . 72.0 111.132 -179.921 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 2.4 tt0 -67.24 -39.68 86.21 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.251 -0.431 . . . . 75.299999999999997 110.946 179.958 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 123' ' ' GLU . . . . . 0.502 ' HG3' ' N ' ' A' ' 124' ' ' LYS . 10.1 pt-20 -73.83 -40.47 63.31 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.167 -0.47 . . . . 61.43 110.889 -179.946 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 124' ' ' LYS . . . . . 0.502 ' N ' ' HG3' ' A' ' 123' ' ' GLU . 2.0 mmpt? -78.73 -19.52 52.14 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.174 -0.466 . . . . 63.539999999999999 110.894 179.949 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 125' ' ' LEU . . . . . 0.738 HD11 ' HB2' ' A' ' 62' ' ' SER . 1.9 tp -69.49 -52.45 26.46 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.255 -0.429 . . . . 54.530000000000001 110.941 179.863 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 10.7 t70 -69.51 -36.86 76.84 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.199 -0.455 . . . . 63.210000000000001 110.826 179.854 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 127' ' ' GLU . . . . . 0.471 ' HG3' ' N ' ' A' ' 128' ' ' PHE . 0.4 OUTLIER -59.73 -36.22 76.14 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.221 -0.445 . . . . 71.140000000000001 110.858 -179.865 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 128' ' ' PHE . . . . . 0.601 ' CE2' ' OE1' ' A' ' 93' ' ' GLN . 0.0 OUTLIER -78.89 -42.26 27.69 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.15 -0.477 . . . . 62.130000000000003 110.894 -179.927 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 129' ' ' GLN . . . . . 0.476 ' CG ' HG22 ' A' ' 60' ' ' VAL . 1.3 tm0? -65.52 -29.52 70.17 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.165 -0.47 . . . . 70.409999999999997 110.908 -179.963 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 130' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -72.71 -35.36 67.58 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.176 -0.466 . . . . 63.009999999999998 110.887 -179.938 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 131' ' ' VAL . . . . . 0.425 ' O ' HG12 ' A' ' 131' ' ' VAL . 3.6 t -123.09 30.8 2.16 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.17 -0.468 . . . . 63.43 111.143 179.882 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 132' ' ' VAL . . . . . 0.582 HG22 ' H ' ' A' ' 134' ' ' THR . 3.6 p -59.55 131.41 24.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.187 -0.46 . . . . 44.539999999999999 111.123 179.9 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 133' ' ' ASN . . . . . . . . . . . . . 42.1 p-10 -103.46 43.15 1.1 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.156 -0.475 . . . . 73.019999999999996 110.904 179.96 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 134' ' ' THR . . . . . 0.582 ' H ' HG22 ' A' ' 132' ' ' VAL . 11.1 m -155.9 103.93 2.27 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.146 -0.479 . . . . 72.530000000000001 111.151 -179.997 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 2.7 tt0 -89.83 98.93 12.05 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.254 -0.43 . . . . 64.5 110.926 179.979 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 29.1 p -167.64 179.8 4.68 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.177 -0.465 . . . . 62.520000000000003 110.87 -179.819 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 137' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -161.68 163.15 29.97 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.165 -0.47 . . . . 64.239999999999995 110.936 -179.991 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 1.1 pt-20 . . . . . 0 C--N 1.329 -0.299 0 CA-C-N 116.2 -0.455 . . . . 72.140000000000001 110.905 179.945 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 4.2 mmt . . . . . 0 C--O 1.231 0.089 0 CA-C-O 120.826 0.346 . . . . 63.340000000000003 110.86 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 25.0 p 52.87 -175.14 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.228 -0.442 . . . . 60.43 110.872 -179.801 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER 61.37 112.13 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.135 -0.484 . . . . 72.340000000000003 110.929 180.0 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 29.1 t -62.72 96.63 0.09 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.155 -0.475 . . . . 74.319999999999993 110.875 -179.931 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 1.6 t-80 -144.71 36.54 1.17 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.17 -0.468 . . . . 72.519999999999996 110.87 -179.993 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER 56.17 108.5 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.229 -0.441 . . . . 73.400000000000006 110.899 -179.938 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . 0.466 HG23 ' HB3' ' A' ' 9' ' ' ASP . 5.9 t -166.6 172.28 10.85 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.192 -0.458 . . . . 73.329999999999998 111.131 179.894 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.618 HD13 ' O ' ' A' ' 72' ' ' PRO . 20.5 mt -64.72 -24.88 67.71 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.18 -0.464 . . . . 72.400000000000006 110.91 179.977 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . 0.466 ' HB3' HG23 ' A' ' 7' ' ' THR . 9.3 t0 -55.13 -34.97 64.2 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.202 -0.454 . . . . 74.299999999999997 110.862 179.856 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 94.2 mm-40 -63.59 -35.78 81.63 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.223 -0.444 . . . . 73.040000000000006 110.859 -179.891 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 21.6 m-85 -65.77 -24.97 67.05 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.236 -0.438 . . . . 74.439999999999998 110.897 -179.853 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -58.93 -41.05 86.43 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.167 -0.47 . . . . 74.010000000000005 110.893 -179.898 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 2.0 mm-40 -59.65 -45.94 90.51 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.142 -0.481 . . . . 72.400000000000006 110.904 -179.964 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . 0.528 HG22 ' OE2' ' A' ' 18' ' ' GLU . 4.2 mp -68.03 -41.08 84.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.138 -0.483 . . . . 70.329999999999998 111.145 179.955 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . 0.446 ' HB3' HG21 ' A' ' 46' ' ' ILE . 57.1 mt-30 -62.79 -48.06 80.77 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.192 -0.458 . . . . 72.340000000000003 110.944 179.922 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -61.84 -45.1 95.28 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.152 -0.477 . . . . 65.099999999999994 110.887 -179.981 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -57.84 -33.82 69.05 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.215 -0.448 . . . . 73.439999999999998 110.883 -179.907 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . 0.528 ' OE2' HG22 ' A' ' 14' ' ' ILE . 2.9 mt-10 -64.03 -38.62 91.72 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.197 -0.456 . . . . 64.340000000000003 110.887 -179.96 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 7.8 mp -66.06 -51.52 57.4 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.116 -0.493 . . . . 75.430000000000007 110.95 179.986 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 1.5 pt-20 -68.91 -33.77 74.3 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.145 -0.479 . . . . 70.109999999999999 110.869 179.948 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -65.98 -50.04 65.71 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.21 -0.45 . . . . 43.200000000000003 111.122 179.896 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . 0.781 ' HA ' HD12 ' A' ' 25' ' ' ILE . 0.7 OUTLIER -72.19 -34.16 48.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.22 -0.446 . . . . 60.100000000000001 111.166 179.975 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . 0.428 ' NH2' ' NH2' ' A' ' 36' ' ' ARG . 0.0 OUTLIER -52.39 -36.19 53.46 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.164 -0.471 . . . . 73.299999999999997 110.899 179.931 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -67.27 -30.23 70.06 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.165 -0.47 . . . . 52.340000000000003 110.799 -179.777 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . 0.919 HD13 ' CE1' ' A' ' 115' ' ' PHE . 4.3 mt -83.31 -45.21 18.8 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.141 -0.481 . . . . 61.420000000000002 111.112 179.976 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 25.7 m-85 -108.5 42.25 1.43 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.168 -0.469 . . . . 65.230000000000004 110.923 -179.96 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER -40.12 -59.07 1.32 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.128 -0.487 . . . . 75.200000000000003 110.887 179.884 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -86.14 -20.89 27.97 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.25 -0.432 . . . . 64.319999999999993 110.834 179.99 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 42.4 m-20 -96.29 34.79 1.54 Allowed 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.204 -0.453 . . . . 72.349999999999994 110.864 -179.996 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 16.1 t80 -118.67 138.48 52.59 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.215 -0.448 . . . . 74.310000000000002 110.899 -179.928 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 94.7 m -117.66 134.11 55.24 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.145 -0.48 . . . . 74.099999999999994 111.116 -179.894 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -101.23 118.51 37.13 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.249 -0.432 . . . . 74.219999999999999 110.901 179.923 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.981 HD21 HG12 ' A' ' 47' ' ' ILE . 0.4 OUTLIER -125.69 -5.68 6.95 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.235 -0.438 . . . . 74.310000000000002 110.916 -179.94 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . 0.609 ' N ' HD23 ' A' ' 33' ' ' LEU . 0.2 OUTLIER -59.72 -158.72 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.171 -0.468 . . . . 64.530000000000001 111.141 179.914 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . 0.6 ' H ' HG22 ' A' ' 34' ' ' THR . 0.4 OUTLIER -106.88 23.14 14.84 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.183 -0.462 . . . . 64.329999999999998 110.905 179.912 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . 0.428 ' NH2' ' NH2' ' A' ' 23' ' ' ARG . 0.0 OUTLIER -39.07 -71.08 0.09 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.205 -0.452 . . . . 72.310000000000002 110.898 179.99 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . 0.467 ' O ' ' CB ' ' A' ' 38' ' ' SER . 0.0 OUTLIER -175.45 125.81 0.24 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.187 -0.46 . . . . 54.539999999999999 110.847 179.96 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . 0.467 ' CB ' ' O ' ' A' ' 37' ' ' LYS . 1.0 OUTLIER 162.51 -69.94 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.254 -0.43 . . . . 43.009999999999998 110.823 -179.945 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 70.9 m -79.61 -171.41 2.79 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.163 -0.471 . . . . 71.219999999999999 110.867 -179.823 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 40' ' ' TRP . . . . . . . . . . . . . 75.7 t-105 -104.2 -35.59 7.96 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.14 -0.482 . . . . 75.349999999999994 110.91 179.984 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 33.2 t70 -136.63 138.44 41.16 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.272 -0.422 . . . . 63.420000000000002 110.879 179.946 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . 0.543 ' CB ' ' HD3' ' A' ' 44' ' ' PRO . 0.1 OUTLIER -145.22 -53.01 0.28 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.204 -0.453 . . . . 73.25 110.886 -179.975 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . 0.57 ' N ' ' CD ' ' A' ' 44' ' ' PRO . 12.3 mm100 56.73 46.54 2.24 Favored Pre-proline 0 C--N 1.329 -0.311 0 CA-C-O 121.619 0.723 . . . . 75.209999999999994 110.902 179.966 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 44' ' ' PRO . . . . . 0.57 ' CD ' ' N ' ' A' ' 43' ' ' GLN . 53.7 Cg_endo -69.79 -161.55 0.08 OUTLIER 'Trans proline' 0 C--N 1.341 0.164 0 C-N-CA 122.702 2.268 . . . . 74.010000000000005 112.307 -179.972 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 45' ' ' GLN . . . . . 0.733 ' HG2' HG23 ' A' ' 47' ' ' ILE . 26.3 pt20 -159.31 36.05 0.2 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.216 -0.447 . . . . 70.200000000000003 110.905 -179.975 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . 0.616 HG22 ' O ' ' A' ' 45' ' ' GLN . 0.1 OUTLIER 84.72 -1.27 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 116.235 -0.439 . . . . 62.109999999999999 111.144 179.963 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . 0.981 HG12 HD21 ' A' ' 33' ' ' LEU . 0.3 OUTLIER -62.61 146.83 12.27 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.167 -0.47 . . . . 73.209999999999994 111.137 179.846 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 48' ' ' PHE . . . . . 0.835 ' HA ' HD22 ' A' ' 33' ' ' LEU . 3.6 p90 -151.05 153.8 35.78 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.174 -0.466 . . . . 72.25 110.876 179.943 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . 0.705 ' HG3' HD13 ' A' ' 33' ' ' LEU . 10.7 mt-10 -108.52 143.85 36.98 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.117 -0.492 . . . . 73.140000000000001 110.864 -179.88 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 30.8 mm -125.94 131.74 71.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.176 -0.466 . . . . 73.200000000000003 111.155 179.95 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 85.2 m -85.1 125.6 32.91 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.187 -0.46 . . . . 72.400000000000006 111.137 179.975 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . 0.873 HD12 HD12 ' A' ' 66' ' ' LEU . 19.9 mt -122.52 164.89 17.29 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.184 -0.462 . . . . 62.009999999999998 110.889 179.988 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER 179.11 172.87 0.81 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.205 -0.452 . . . . 74.230000000000004 110.861 179.954 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -62.91 170.96 2.38 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.2 -0.454 . . . . 70.409999999999997 110.843 -179.799 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . 0.536 HG13 HE22 ' A' ' 122' ' ' GLN . 21.8 m -84.85 -24.2 7.21 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 116.14 -0.482 . . . . 55.109999999999999 111.143 179.964 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -117.83 -172.72 2.3 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.176 -0.466 . . . . 62.409999999999997 110.868 179.92 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -115.19 -12.58 11.85 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.222 -0.444 . . . . 74.340000000000003 110.914 -179.972 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . 0.545 ' HA ' ' C ' ' A' ' 59' ' ' PRO . 6.3 pm0 -126.79 149.45 68.67 Favored Pre-proline 0 C--N 1.33 -0.257 0 CA-C-O 121.674 0.75 . . . . 61.140000000000001 110.879 179.929 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 59' ' ' PRO . . . . . 0.545 ' C ' ' HA ' ' A' ' 58' ' ' GLU . 53.3 Cg_endo -69.8 -8.83 10.78 Favored 'Cis proline' 0 C--N 1.342 0.219 0 C-N-CA 122.674 -1.802 . . . . 72.230000000000004 112.303 0.076 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 60' ' ' VAL . . . . . 0.472 HG22 ' CG ' ' A' ' 129' ' ' GLN . 22.3 m -142.51 165.26 16.8 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.197 -0.456 . . . . 41.049999999999997 111.093 179.923 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . 0.405 ' O ' ' O ' ' A' ' 62' ' ' SER . 7.5 tt0 -93.58 -25.05 17.71 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.143 -0.481 . . . . 74.140000000000001 110.848 -179.918 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . 0.405 ' O ' ' O ' ' A' ' 61' ' ' GLU . 0.5 OUTLIER 41.63 94.15 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.185 -0.461 . . . . 74.200000000000003 110.836 -179.79 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 9.2 p -116.57 122.74 45.52 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.145 -0.48 . . . . 72.540000000000006 110.874 -179.854 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 64' ' ' ILE . . . . . 1.069 HD11 HG21 ' A' ' 89' ' ' VAL . 21.1 mt -137.89 138.61 43.79 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.132 -0.485 . . . . 60.009999999999998 111.097 179.992 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 20.1 m -104.49 113.87 27.72 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.2 -0.455 . . . . 71.299999999999997 111.126 179.939 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . 0.873 HD12 HD12 ' A' ' 52' ' ' LEU . 6.5 mt -99.17 112.19 24.39 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.174 -0.466 . . . . 71.230000000000004 110.927 179.964 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -109.6 114.32 27.84 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.217 -0.447 . . . . 75.310000000000002 110.826 179.897 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 68' ' ' PHE . . . . . 0.583 ' CE1' HG23 ' A' ' 114' ' ' ILE . 0.0 OUTLIER -103.31 140.43 37.42 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.213 -0.448 . . . . 63.020000000000003 110.865 -179.928 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -117.28 131.33 56.84 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.128 -0.487 . . . . 74.25 111.114 179.944 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 70' ' ' MET . . . . . 0.503 ' SD ' ' CZ ' ' A' ' 74' ' ' TYR . 3.1 mmt -93.49 98.82 11.44 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.224 -0.443 . . . . 73.010000000000005 110.858 179.998 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -55.49 163.49 1.84 Allowed Pre-proline 0 C--N 1.33 -0.262 0 CA-C-O 121.57 0.7 . . . . 54.43 111.125 -179.923 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 72' ' ' PRO . . . . . 0.618 ' O ' HD13 ' A' ' 8' ' ' LEU . 53.9 Cg_endo -69.77 3.14 2.95 Favored 'Trans proline' 0 C--N 1.341 0.168 0 C-N-CA 122.668 2.245 . . . . 60.229999999999997 112.348 179.935 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 73' ' ' MET . . . . . 0.509 ' HB3' HG23 ' A' ' 77' ' ' THR . 0.1 OUTLIER -126.31 -22.99 3.91 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.21 -0.45 . . . . 55.399999999999999 110.868 179.927 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 74' ' ' TYR . . . . . 0.643 ' CD1' ' C ' ' A' ' 74' ' ' TYR . 0.0 OUTLIER -49.56 150.04 3.77 Favored Pre-proline 0 C--N 1.329 -0.32 0 CA-C-O 121.67 0.748 . . . . 61.32 110.959 -179.872 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 75' ' ' PRO . . . . . 0.551 ' C ' ' HA ' ' A' ' 74' ' ' TYR . 53.8 Cg_endo -69.74 -14.06 12.42 Favored 'Cis proline' 0 C--O 1.231 0.157 0 C-N-CA 122.706 -1.789 . . . . 75.310000000000002 112.32 -0.006 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 76' ' ' TYR . . . . . 0.507 ' CB ' ' O ' ' A' ' 73' ' ' MET . 9.0 t80 -33.6 -45.75 0.18 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.239 -0.437 . . . . 75.109999999999999 110.949 -179.855 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 77' ' ' THR . . . . . 0.509 HG23 ' HB3' ' A' ' 73' ' ' MET . 45.6 p -108.79 164.86 12.01 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.147 -0.479 . . . . 54.409999999999997 111.165 -179.997 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -79.84 125.96 81.07 Favored Pre-proline 0 C--N 1.329 -0.292 0 CA-C-O 121.579 0.704 . . . . 51.329999999999998 111.119 179.839 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 79' ' ' PRO . . . . . 0.767 ' HG3' HD11 ' A' ' 113' ' ' ILE . 53.8 Cg_endo -69.74 176.43 6.76 Favored 'Trans proline' 0 C--N 1.341 0.147 0 C-N-CA 122.673 2.248 . . . . 72.120000000000005 112.343 -179.961 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -119.04 135.13 54.79 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.248 -0.433 . . . . 75.120000000000005 110.877 -179.983 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 81' ' ' ILE . . . . . 0.61 HD13 HD13 ' A' ' 117' ' ' ILE . 13.7 mt -143.27 151.29 17.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.156 -0.475 . . . . 71.040000000000006 111.135 179.949 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . 0.501 ' HG3' ' CD ' ' A' ' 84' ' ' LYS . 11.2 pt-20 -148.99 147.94 29.17 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.144 -0.48 . . . . 74.439999999999998 110.868 179.996 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 83' ' ' PHE . . . . . 0.451 ' CE1' HD21 ' A' ' 66' ' ' LEU . 64.6 m-85 -90.63 140.27 29.92 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.16 -0.473 . . . . 72.219999999999999 110.897 -179.937 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 84' ' ' LYS . . . . . 0.501 ' CD ' ' HG3' ' A' ' 82' ' ' GLU . 8.0 mmmt -126.4 165.58 18.78 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.201 -0.454 . . . . 73.019999999999996 110.877 179.964 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . 0.465 ' O ' ' C ' ' A' ' 86' ' ' VAL . 4.1 m-80 63.55 -71.82 0.06 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.235 -0.439 . . . . 73.099999999999994 110.893 179.97 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 86' ' ' VAL . . . . . 0.687 HG23 ' O ' ' A' ' 86' ' ' VAL . 28.0 m 30.81 91.21 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.156 -0.475 . . . . 73.219999999999999 111.106 179.924 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -94.28 -85.25 0.3 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.117 -0.492 . . . . 64.239999999999995 110.881 -179.988 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 88' ' ' ASN . . . . . 0.439 ' CG ' HG21 ' A' ' 60' ' ' VAL . 1.0 OUTLIER -45.52 -38.14 6.04 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.207 -0.451 . . . . 74.230000000000004 110.923 -179.933 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 89' ' ' VAL . . . . . 1.069 HG21 HD11 ' A' ' 64' ' ' ILE . 3.4 t -61.91 142.92 15.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.134 -0.485 . . . . 74.230000000000004 111.103 179.905 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 90' ' ' MET . . . . . . . . . . . . . 7.2 mtm -95.15 -56.46 2.72 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.134 -0.485 . . . . 74.530000000000001 110.899 179.91 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER 170.21 -41.87 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.197 -0.456 . . . . 64.530000000000001 110.9 179.98 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -54.27 -38.66 66.09 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.188 -0.46 . . . . 55.329999999999998 110.87 -179.781 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 93' ' ' GLN . . . . . 0.646 ' CD ' ' CD1' ' A' ' 128' ' ' PHE . 0.0 OUTLIER -68.25 -43.22 78.36 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.151 -0.477 . . . . 70.340000000000003 110.906 -179.977 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 62.8 mt -60.52 -48.34 82.21 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.228 -0.442 . . . . 72.409999999999997 110.912 -179.957 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -63.38 -34.14 77.07 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.163 -0.471 . . . . 64.120000000000005 110.934 179.934 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 96' ' ' MET . . . . . . . . . . . . . 35.3 ttp -60.65 -40.36 91.72 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.175 -0.466 . . . . 73.549999999999997 110.832 179.982 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 97' ' ' LEU . . . . . 0.791 HD22 HG22 ' A' ' 121' ' ' THR . 81.2 mt -65.91 -39.88 90.98 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.247 -0.433 . . . . 72.109999999999999 110.896 -179.997 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 11.3 mmtm -54.69 -47.19 73.98 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.213 -0.449 . . . . 73.030000000000001 110.892 179.831 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 15.7 m -60.3 -36.75 78.59 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.235 -0.438 . . . . 45.32 110.87 -179.888 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 78.2 mm-40 -71.13 -30.21 66.21 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.16 -0.473 . . . . 71.219999999999999 110.885 -179.951 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 101' ' ' PHE . . . . . 0.864 ' CD2' HD11 ' A' ' 117' ' ' ILE . 9.0 m-30 -59.33 -37.52 78.01 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.173 -0.467 . . . . 72.439999999999998 110.877 -179.98 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -64.8 -40.36 95.09 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.201 -0.454 . . . . 41.200000000000003 110.93 179.986 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 25.8 ttpp -70.16 -43.39 70.94 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.197 -0.456 . . . . 75.549999999999997 110.88 179.859 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 104' ' ' ILE . . . . . 0.408 ' O ' ' N ' ' A' ' 108' ' ' SER . 4.5 mt -62.14 -47.53 92.68 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 116.232 -0.44 . . . . 62.450000000000003 111.128 179.903 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 105' ' ' HIS . . . . . . . . . . . . . 3.2 t60 -62.98 -43.47 98.71 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.187 -0.46 . . . . 73.209999999999994 110.839 179.889 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -57.38 -40.26 77.79 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.229 -0.441 . . . . 72.340000000000003 110.92 -179.997 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 14.3 t -89.14 -21.22 23.45 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.167 -0.469 . . . . 64.5 111.146 -179.968 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 108' ' ' SER . . . . . 0.594 ' CB ' HG22 ' A' ' 113' ' ' ILE . 60.0 m -109.54 31.16 6.0 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.229 -0.441 . . . . 71.540000000000006 110.838 -179.846 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 6.6 ttp180 -79.5 88.1 5.08 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.14 -0.482 . . . . 62.109999999999999 110.855 -179.92 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 113.31 44.82 0.77 Allowed Glycine 0 N--CA 1.451 -0.339 0 C-N-CA 120.747 -0.74 . . . . 50.030000000000001 112.473 -179.981 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 111' ' ' GLN . . . . . . . . . . . . . 21.5 pt20 -174.77 28.31 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.775 0.321 . . . . 74.420000000000002 110.924 -179.886 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER 70.97 140.45 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.198 -0.455 . . . . 71.540000000000006 110.935 -179.901 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 113' ' ' ILE . . . . . 0.767 HD11 ' HG3' ' A' ' 79' ' ' PRO . 34.1 pt -134.78 0.1 1.15 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.167 -0.469 . . . . 72.230000000000004 111.158 179.987 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 114' ' ' ILE . . . . . 0.737 ' O ' HG23 ' A' ' 118' ' ' THR . 18.8 mm -63.29 -45.88 97.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.148 -0.478 . . . . 74.219999999999999 111.158 179.872 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 115' ' ' PHE . . . . . 0.919 ' CE1' HD13 ' A' ' 25' ' ' ILE . 22.2 t80 -72.66 -32.03 65.53 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.114 -0.494 . . . . 75.430000000000007 110.835 179.964 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 20.5 mm-40 -67.91 -45.97 72.9 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.187 -0.46 . . . . 74.030000000000001 110.915 -179.967 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 117' ' ' ILE . . . . . 0.864 HD11 ' CD2' ' A' ' 101' ' ' PHE . 0.9 OUTLIER -66.39 -43.7 91.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.194 -0.457 . . . . 71.209999999999994 111.105 179.989 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 118' ' ' THR . . . . . 0.737 HG23 ' O ' ' A' ' 114' ' ' ILE . 43.9 p -67.95 -41.78 81.95 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.145 -0.48 . . . . 53.229999999999997 111.122 179.979 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 43.2 t -68.06 -43.18 79.24 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.242 -0.435 . . . . 73.049999999999997 110.833 -179.839 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 3.7 t80 -67.83 -48.63 65.66 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.179 -0.464 . . . . 63.450000000000003 110.894 -179.965 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 121' ' ' THR . . . . . 0.791 HG22 HD22 ' A' ' 97' ' ' LEU . 29.0 p -61.88 -39.56 92.38 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.18 -0.464 . . . . 71.219999999999999 111.128 -179.919 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 122' ' ' GLN . . . . . 0.536 HE22 HG13 ' A' ' 55' ' ' VAL . 7.7 tm0? -66.68 -50.81 61.67 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.216 -0.447 . . . . 54.25 110.883 -179.968 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 123' ' ' GLU . . . . . 0.417 ' HG3' ' N ' ' A' ' 124' ' ' LYS . 5.5 pt-20 -63.01 -38.17 90.12 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.221 -0.445 . . . . 72.230000000000004 110.88 -179.96 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 124' ' ' LYS . . . . . 0.434 ' CE ' ' HA ' ' A' ' 124' ' ' LYS . 0.0 OUTLIER -75.82 -35.08 60.13 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.182 -0.463 . . . . 63.020000000000003 110.895 179.996 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 125' ' ' LEU . . . . . 0.69 ' C ' HD23 ' A' ' 125' ' ' LEU . 4.2 tt -70.57 -50.85 33.02 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.201 -0.454 . . . . 74.530000000000001 110.927 179.88 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 126' ' ' ASP . . . . . 0.81 ' OD1' HG22 ' A' ' 134' ' ' THR . 0.0 OUTLIER -57.56 -46.58 83.78 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.147 -0.478 . . . . 74.329999999999998 110.827 179.888 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 127' ' ' GLU . . . . . 0.472 ' HB2' ' N ' ' A' ' 133' ' ' ASN . 0.9 OUTLIER -65.08 -28.15 69.26 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.221 -0.445 . . . . 74.409999999999997 110.872 -179.896 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 128' ' ' PHE . . . . . 0.646 ' CD1' ' CD ' ' A' ' 93' ' ' GLN . 0.2 OUTLIER -73.5 -46.78 45.92 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.155 -0.475 . . . . 75.409999999999997 110.878 -179.908 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 129' ' ' GLN . . . . . 0.472 ' CG ' HG22 ' A' ' 60' ' ' VAL . 1.5 tm0? -60.17 -39.25 85.8 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.183 -0.462 . . . . 74.140000000000001 110.95 -179.956 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 130' ' ' ASN . . . . . 0.822 ' O ' HG13 ' A' ' 131' ' ' VAL . 2.3 m-20 -71.25 -79.73 0.06 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.186 -0.461 . . . . 65.430000000000007 110.916 -179.978 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 131' ' ' VAL . . . . . 0.822 HG13 ' O ' ' A' ' 130' ' ' ASN . 0.0 OUTLIER -173.82 -48.65 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.176 -0.465 . . . . 53.340000000000003 111.151 179.948 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 132' ' ' VAL . . . . . 0.402 HG23 ' C ' ' A' ' 131' ' ' VAL . 91.8 t -157.29 129.22 0.99 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.206 -0.452 . . . . 73.439999999999998 111.174 179.895 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 133' ' ' ASN . . . . . 0.472 ' N ' ' HB2' ' A' ' 127' ' ' GLU . 14.9 m-20 50.31 -179.57 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.17 -0.468 . . . . 72.530000000000001 110.855 -179.98 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 134' ' ' THR . . . . . 0.81 HG22 ' OD1' ' A' ' 126' ' ' ASP . 60.4 p -76.21 -179.19 4.89 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.134 -0.484 . . . . 71.120000000000005 111.131 -179.952 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 4.6 tp-100 -158.6 -39.41 0.06 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.211 -0.45 . . . . 72.349999999999994 110.91 -179.997 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 18.1 t -99.54 -42.03 7.1 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.217 -0.447 . . . . 74.219999999999999 110.863 -179.807 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 137' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER 71.54 -69.37 0.19 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.124 -0.489 . . . . 63.439999999999998 110.924 179.978 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--N 1.329 -0.286 0 CA-C-N 116.204 -0.453 . . . . 74.129999999999995 110.876 179.951 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.232 0.136 0 CA-C-O 120.754 0.311 . . . . 60.229999999999997 110.919 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 173.54 108.36 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.265 -0.425 . . . . 55.119999999999997 110.884 -179.771 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . 0.695 HD23 ' H ' ' A' ' 3' ' ' LEU . 1.2 pt? -90.16 177.82 6.33 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.145 -0.48 . . . . 75.25 110.959 179.958 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 13.3 p -102.16 92.62 4.83 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.188 -0.46 . . . . 43.450000000000003 110.879 -179.896 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 17.0 t-80 -161.2 172.94 15.83 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.121 -0.49 . . . . 64.409999999999997 110.863 -179.966 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -99.37 44.37 1.03 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.223 -0.444 . . . . 74.019999999999996 110.913 -179.962 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . 0.903 HG23 ' H ' ' A' ' 9' ' ' ASP . 14.2 t -95.07 -167.62 1.66 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.184 -0.462 . . . . 74.310000000000002 111.109 179.979 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 29.0 mt -69.07 -24.64 64.18 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.188 -0.46 . . . . 62.020000000000003 110.925 179.913 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . 0.903 ' H ' HG23 ' A' ' 7' ' ' THR . 0.3 OUTLIER -55.2 -30.18 59.42 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.201 -0.454 . . . . 73.099999999999994 110.835 179.867 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 77.5 mm-40 -67.2 -35.75 80.28 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.232 -0.44 . . . . 74.519999999999996 110.916 -179.852 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 11' ' ' TYR . . . . . 0.49 ' CD1' ' HD2' ' A' ' 75' ' ' PRO . 26.9 m-85 -66.6 -28.1 68.24 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.158 -0.474 . . . . 72.340000000000003 110.875 -179.876 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -59.3 -39.24 82.39 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.131 -0.486 . . . . 73.299999999999997 110.923 -179.865 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -59.04 -44.25 91.76 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.163 -0.471 . . . . 63.140000000000001 110.894 179.976 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . 0.618 HG22 ' OE1' ' A' ' 18' ' ' GLU . 3.8 mp -66.94 -48.01 80.77 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.156 -0.475 . . . . 63.009999999999998 111.108 179.976 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 57.6 mt-30 -57.85 -46.55 84.63 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.231 -0.44 . . . . 73.109999999999999 110.927 179.934 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 6.7 t -58.6 -44.93 90.03 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.226 -0.443 . . . . 71.120000000000005 110.91 -179.964 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 1.1 t30 -59.03 -33.88 71.27 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.152 -0.476 . . . . 74.310000000000002 110.918 -179.912 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . 0.618 ' OE1' HG22 ' A' ' 14' ' ' ILE . 2.2 mp0 -64.35 -39.09 93.2 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.174 -0.466 . . . . 73.400000000000006 110.91 179.961 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.846 HD11 HG13 ' A' ' 46' ' ' ILE . 5.7 mt -63.56 -51.27 66.12 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.165 -0.471 . . . . 71.329999999999998 110.92 -179.971 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 6.6 pt-20 -68.59 -35.02 76.78 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.163 -0.471 . . . . 73.5 110.894 179.914 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -62.7 -50.67 70.2 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.161 -0.472 . . . . 71.420000000000002 111.072 179.962 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . 0.796 ' HA ' HD12 ' A' ' 25' ' ' ILE . 0.6 OUTLIER -74.72 -34.98 35.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.234 -0.439 . . . . 64.239999999999995 111.163 179.96 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 16.4 mtt180 -52.6 -35.78 54.95 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.151 -0.477 . . . . 74.200000000000003 110.846 179.95 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -67.51 -31.2 71.16 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.212 -0.449 . . . . 60.240000000000002 110.88 -179.798 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . 0.796 HD12 ' HA ' ' A' ' 22' ' ' ILE . 4.8 mt -80.32 -45.22 22.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.114 -0.494 . . . . 71.549999999999997 111.102 -179.997 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 17.5 m-85 -109.84 44.02 1.26 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.17 -0.468 . . . . 74.230000000000004 110.925 -179.975 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 1.3 mtm -43.49 -40.81 4.04 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.124 -0.489 . . . . 73.409999999999997 110.843 179.929 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -104.72 -20.12 13.72 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.275 -0.42 . . . . 61.43 110.863 179.963 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 3.6 m-20 -95.17 22.9 6.21 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.238 -0.437 . . . . 75.129999999999995 110.852 179.996 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 30' ' ' PHE . . . . . 0.577 ' C ' ' CD1' ' A' ' 30' ' ' PHE . 0.1 OUTLIER -114.52 143.78 44.42 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.231 -0.441 . . . . 74.239999999999995 110.866 -179.912 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 23.7 m -123.99 130.94 53.4 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.11 -0.495 . . . . 73.5 111.147 -179.936 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 1.2 t70 -94.05 114.3 26.43 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.202 -0.454 . . . . 74.109999999999999 110.849 179.926 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.985 HD23 ' N ' ' A' ' 34' ' ' THR . 0.2 OUTLIER -117.89 -17.36 9.79 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.229 -0.441 . . . . 62.340000000000003 110.934 -179.967 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . 0.985 ' N ' HD23 ' A' ' 33' ' ' LEU . 4.7 m -50.22 137.27 18.32 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.181 -0.463 . . . . 65.239999999999995 111.123 179.952 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 11.6 mttm -56.5 89.9 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.167 -0.469 . . . . 74.450000000000003 110.91 179.925 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 1.4 mmt180 -126.02 54.49 1.53 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.205 -0.452 . . . . 74.409999999999997 110.918 179.978 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 2.8 mmpt? -78.72 170.23 16.98 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.171 -0.468 . . . . 73.540000000000006 110.88 179.996 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 5.4 t -85.02 -62.16 1.6 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.187 -0.46 . . . . 64.519999999999996 110.839 -179.88 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 4.6 m -141.95 95.5 2.82 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.142 -0.481 . . . . 62.119999999999997 110.891 -179.836 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 40' ' ' TRP . . . . . . . . . . . . . 12.4 t-105 -178.36 -48.05 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.136 -0.484 . . . . 74.129999999999995 110.932 -179.98 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 20.5 t0 -159.68 164.14 34.24 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.24 -0.436 . . . . 72.129999999999995 110.905 179.92 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . 0.412 ' C ' ' HD3' ' A' ' 44' ' ' PRO . 0.0 OUTLIER -154.23 68.28 0.74 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.216 -0.447 . . . . 71.219999999999999 110.897 179.987 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . 0.462 ' N ' ' CD ' ' A' ' 44' ' ' PRO . 12.7 mt-30 -118.71 53.47 1.92 Allowed Pre-proline 0 C--N 1.329 -0.3 0 CA-C-O 121.599 0.714 . . . . 74.409999999999997 110.937 179.942 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 44' ' ' PRO . . . . . 0.462 ' CD ' ' N ' ' A' ' 43' ' ' GLN . 53.9 Cg_endo -69.75 157.0 61.91 Favored 'Trans proline' 0 C--N 1.341 0.155 0 C-N-CA 122.694 2.262 . . . . 70.340000000000003 112.343 -179.985 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 45' ' ' GLN . . . . . 0.819 ' HB3' HD12 ' A' ' 47' ' ' ILE . 27.4 tt0 -139.71 12.81 2.5 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.238 -0.437 . . . . 72.420000000000002 110.917 -179.977 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . 0.846 HG13 HD11 ' A' ' 19' ' ' LEU . 0.0 OUTLIER 79.72 -42.35 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.24 -0.436 . . . . 65.219999999999999 111.13 179.991 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . 0.897 HG12 HD21 ' A' ' 33' ' ' LEU . 0.2 OUTLIER -34.03 143.27 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.206 -0.452 . . . . 73.319999999999993 111.156 179.87 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 48' ' ' PHE . . . . . 0.855 ' HA ' HD22 ' A' ' 33' ' ' LEU . 1.1 p90 -150.05 164.7 34.85 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.16 -0.473 . . . . 74.319999999999993 110.833 -179.989 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . 0.912 ' HG3' HD13 ' A' ' 33' ' ' LEU . 34.3 mt-10 -108.84 147.56 31.92 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.123 -0.489 . . . . 75.120000000000005 110.879 -179.945 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . 0.48 HD13 ' HA ' ' A' ' 30' ' ' PHE . 14.4 mm -128.31 135.89 61.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.185 -0.461 . . . . 74.019999999999996 111.157 179.951 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 25.9 m -93.73 125.19 38.22 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.168 -0.469 . . . . 71.140000000000001 111.14 179.974 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . 0.418 HD23 ' HA ' ' A' ' 52' ' ' LEU . 13.9 mt -119.72 165.02 15.06 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.206 -0.452 . . . . 64.150000000000006 110.869 179.979 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -166.41 154.35 10.16 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.178 -0.464 . . . . 71.530000000000001 110.894 179.985 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 1.9 m -56.8 -172.95 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.162 -0.472 . . . . 73.439999999999998 110.868 -179.797 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 34.5 m -87.75 -33.04 6.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.145 -0.48 . . . . 51.310000000000002 111.096 179.978 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 5.1 t0 -119.42 -166.55 1.28 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.23 -0.441 . . . . 63.439999999999998 110.875 179.922 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . 0.446 ' O ' ' C ' ' A' ' 60' ' ' VAL . 1.6 mmmp? -119.31 -25.9 5.99 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.215 -0.448 . . . . 73.219999999999999 110.866 -179.995 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . 0.555 ' HA ' ' C ' ' A' ' 59' ' ' PRO . 7.0 pt-20 -112.14 144.46 30.82 Favored Pre-proline 0 C--N 1.329 -0.286 0 CA-C-O 121.613 0.721 . . . . 73.310000000000002 110.877 179.982 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 59' ' ' PRO . . . . . 0.555 ' C ' ' HA ' ' A' ' 58' ' ' GLU . 53.4 Cg_endo -69.81 -14.44 12.57 Favored 'Cis proline' 0 C--O 1.231 0.171 0 C-N-CA 122.684 -1.798 . . . . 72.099999999999994 112.348 0.051 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 60' ' ' VAL . . . . . 0.725 HG11 ' OD1' ' A' ' 88' ' ' ASN . 15.5 m -140.95 -177.88 1.37 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.211 -0.45 . . . . 73.549999999999997 111.128 179.938 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . 0.441 ' O ' ' C ' ' A' ' 62' ' ' SER . 2.3 pt-20 -119.6 -12.91 9.22 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.177 -0.465 . . . . 61.439999999999998 110.891 -179.98 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . 0.757 ' CB ' HD11 ' A' ' 125' ' ' LEU . 3.6 m 34.26 90.02 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.162 -0.472 . . . . 73.030000000000001 110.869 -179.769 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 9.7 p -110.19 122.97 48.89 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.152 -0.476 . . . . 63.329999999999998 110.891 -179.865 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 64' ' ' ILE . . . . . 0.733 HD11 HG21 ' A' ' 89' ' ' VAL . 19.8 mt -135.69 142.0 40.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.127 -0.488 . . . . 53.119999999999997 111.124 179.944 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 99.6 m -109.71 116.2 31.26 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.194 -0.457 . . . . 74.329999999999998 111.115 179.94 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . 0.596 HD11 HG21 ' A' ' 121' ' ' THR . 53.0 mt -95.16 116.52 28.84 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.2 -0.454 . . . . 72.329999999999998 110.942 179.904 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 13.4 t60 -105.64 113.83 27.63 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.152 -0.477 . . . . 63.340000000000003 110.87 179.861 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 68' ' ' PHE . . . . . 0.551 ' CE1' HG23 ' A' ' 114' ' ' ILE . 0.0 OUTLIER -103.83 139.92 38.37 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.229 -0.441 . . . . 70.219999999999999 110.899 -179.927 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -115.47 107.25 14.94 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.188 -0.46 . . . . 61.109999999999999 111.122 179.921 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 70' ' ' MET . . . . . 0.425 ' H ' HG22 ' A' ' 47' ' ' ILE . 0.3 OUTLIER -74.7 81.98 2.07 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.248 -0.433 . . . . 73.329999999999998 110.911 179.949 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -40.61 158.75 0.16 Allowed Pre-proline 0 C--N 1.33 -0.273 0 CA-C-O 121.579 0.704 . . . . 43.350000000000001 111.143 -179.928 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.74 -1.12 7.92 Favored 'Trans proline' 0 C--N 1.341 0.179 0 C-N-CA 122.701 2.267 . . . . 62.420000000000002 112.39 179.886 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 73' ' ' MET . . . . . 0.634 ' HB3' HG23 ' A' ' 77' ' ' THR . 0.1 OUTLIER -112.75 -26.02 8.79 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.198 -0.455 . . . . 72.239999999999995 110.88 179.899 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 74' ' ' TYR . . . . . 0.635 ' CD1' ' C ' ' A' ' 74' ' ' TYR . 0.0 OUTLIER -48.87 149.93 2.92 Favored Pre-proline 0 C--N 1.328 -0.327 0 CA-C-O 121.681 0.753 . . . . 73.099999999999994 110.939 -179.893 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 75' ' ' PRO . . . . . 0.551 ' C ' ' HA ' ' A' ' 74' ' ' TYR . 53.9 Cg_endo -69.72 -12.88 12.24 Favored 'Cis proline' 0 C--O 1.232 0.187 0 C-N-CA 122.761 -1.766 . . . . 73.400000000000006 112.329 -0.056 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 76' ' ' TYR . . . . . 0.49 ' CB ' ' O ' ' A' ' 73' ' ' MET . 6.5 t80 -35.74 -51.29 0.67 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.251 -0.431 . . . . 74.129999999999995 110.93 -179.9 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 77' ' ' THR . . . . . 0.634 HG23 ' HB3' ' A' ' 73' ' ' MET . 48.2 p -107.1 167.51 9.85 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.12 -0.491 . . . . 74.420000000000002 111.122 -179.992 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -88.93 129.39 48.53 Favored Pre-proline 0 C--N 1.329 -0.314 0 CA-C-O 121.59 0.709 . . . . 61.43 111.122 179.858 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 79' ' ' PRO . . . . . 0.58 ' HG3' HD11 ' A' ' 113' ' ' ILE . 53.0 Cg_endo -69.77 -172.47 0.58 Allowed 'Trans proline' 0 C--N 1.341 0.171 0 C-N-CA 122.667 2.244 . . . . 72.340000000000003 112.321 -179.948 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -120.57 132.98 55.42 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.212 -0.449 . . . . 63.240000000000002 110.871 -179.957 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 81' ' ' ILE . . . . . 0.487 HD13 ' HA ' ' A' ' 68' ' ' PHE . 9.8 mm -122.96 142.31 40.04 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-N 116.161 -0.472 . . . . 43.299999999999997 111.159 179.97 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . 0.515 ' HG3' ' CD ' ' A' ' 84' ' ' LYS . 4.6 pt-20 -145.09 144.93 31.21 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.217 -0.447 . . . . 51.32 110.893 179.972 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 83' ' ' PHE . . . . . 0.496 ' CE2' ' HD3' ' A' ' 98' ' ' LYS . 33.7 m-85 -99.04 135.28 40.68 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.157 -0.474 . . . . 55.520000000000003 110.888 -179.94 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 84' ' ' LYS . . . . . 0.515 ' CD ' ' HG3' ' A' ' 82' ' ' GLU . 9.2 mmmt -125.4 171.84 10.13 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.165 -0.471 . . . . 73.450000000000003 110.847 -179.989 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . 0.486 ' O ' ' C ' ' A' ' 86' ' ' VAL . 2.8 m-80 62.41 -73.87 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.216 -0.447 . . . . 71.340000000000003 110.878 179.954 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 86' ' ' VAL . . . . . 0.704 HG23 ' O ' ' A' ' 86' ' ' VAL . 33.6 m 29.74 91.51 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.18 -0.464 . . . . 73.219999999999999 111.11 179.911 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -93.64 -63.57 1.19 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.138 -0.483 . . . . 74.049999999999997 110.909 -179.958 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 88' ' ' ASN . . . . . 0.725 ' OD1' HG11 ' A' ' 60' ' ' VAL . 17.1 t30 -81.82 39.22 0.54 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.202 -0.454 . . . . 75.109999999999999 110.925 -179.987 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 89' ' ' VAL . . . . . 0.733 HG21 HD11 ' A' ' 64' ' ' ILE . 15.6 t -141.2 149.49 20.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.171 -0.468 . . . . 73.409999999999997 111.135 179.905 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 90' ' ' MET . . . . . . . . . . . . . 6.2 mtm -107.72 -61.49 1.56 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.152 -0.476 . . . . 54.450000000000003 110.865 179.927 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 91' ' ' ASP . . . . . 0.417 ' OD1' ' N ' ' A' ' 92' ' ' SER . 0.0 OUTLIER -177.64 -30.84 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.233 -0.439 . . . . 75.340000000000003 110.908 179.988 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 92' ' ' SER . . . . . 0.417 ' N ' ' OD1' ' A' ' 91' ' ' ASP . 47.4 t -55.46 -45.7 76.89 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.175 -0.466 . . . . 63.329999999999998 110.89 -179.807 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 93' ' ' GLN . . . . . 0.514 ' HG3' ' CE2' ' A' ' 128' ' ' PHE . 3.9 mp0 -68.58 -41.71 79.28 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.125 -0.489 . . . . 73.239999999999995 110.903 -179.985 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . 0.668 ' CD1' HG11 ' A' ' 89' ' ' VAL . 7.5 mp -58.61 -48.98 79.16 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.211 -0.45 . . . . 71.239999999999995 110.916 -179.986 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 45.7 mt-30 -66.16 -34.45 78.06 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.226 -0.443 . . . . 72.109999999999999 110.93 179.928 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 96' ' ' MET . . . . . 0.424 ' SD ' ' CE1' ' A' ' 128' ' ' PHE . 5.7 ttp -59.74 -39.7 85.62 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.159 -0.473 . . . . 73.299999999999997 110.864 179.972 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 97' ' ' LEU . . . . . 0.862 HD22 HG22 ' A' ' 121' ' ' THR . 13.4 mt -67.24 -42.18 84.39 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.288 -0.415 . . . . 51.130000000000003 110.892 -179.972 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 98' ' ' LYS . . . . . 0.496 ' HD3' ' CE2' ' A' ' 83' ' ' PHE . 3.2 mmmp? -55.23 -42.35 73.28 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.22 -0.445 . . . . 70.349999999999994 110.893 179.876 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -59.81 -44.57 93.94 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.206 -0.452 . . . . 72.420000000000002 110.883 -179.887 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 100' ' ' GLU . . . . . 0.508 ' O ' HD12 ' A' ' 104' ' ' ILE . 19.3 mt-10 -69.88 -27.44 64.82 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.111 -0.495 . . . . 64.030000000000001 110.872 -179.97 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 101' ' ' PHE . . . . . 0.784 ' CD2' HD11 ' A' ' 117' ' ' ILE . 11.8 m-30 -59.37 -28.83 67.22 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.198 -0.455 . . . . 74.109999999999999 110.869 -179.945 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 6.5 ttmt -71.79 -43.38 65.77 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.136 -0.484 . . . . 72.510000000000005 110.903 179.983 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 16.8 ttpp -69.07 -42.97 75.5 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.235 -0.439 . . . . 72.549999999999997 110.882 179.857 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 104' ' ' ILE . . . . . 0.546 HD11 ' CD2' ' A' ' 120' ' ' PHE . 3.5 mt -62.59 -47.46 92.82 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.248 -0.433 . . . . 74.420000000000002 111.148 179.854 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 105' ' ' HIS . . . . . . . . . . . . . 35.6 t-80 -62.84 -41.94 99.54 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.185 -0.461 . . . . 63.399999999999999 110.872 179.884 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -57.33 -41.25 79.65 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.172 -0.467 . . . . 74.010000000000005 110.866 -179.952 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 9.4 t -83.57 -15.61 48.55 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.226 -0.443 . . . . 61.109999999999999 111.137 -179.954 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 108' ' ' SER . . . . . 0.578 ' HB2' HG22 ' A' ' 113' ' ' ILE . 1.8 m -124.54 43.55 2.99 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.203 -0.453 . . . . 73.25 110.857 -179.899 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 4.9 ttt180 -90.38 83.23 5.9 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.123 -0.49 . . . . 73.099999999999994 110.845 -179.955 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 110' ' ' GLY . . . . . 0.476 ' HA2' ' CG ' ' A' ' 75' ' ' PRO . . . 136.63 -4.43 3.65 Favored Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.712 -0.756 . . . . 53.210000000000001 112.486 -179.971 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 111' ' ' GLN . . . . . . . . . . . . . 13.2 mm-40 -116.46 -94.76 0.48 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.784 0.326 . . . . 62.130000000000003 110.892 -179.909 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 39.9 mt-10 -149.05 131.4 15.62 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.236 -0.438 . . . . 63.130000000000003 110.915 -179.935 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 113' ' ' ILE . . . . . 0.58 HD11 ' HG3' ' A' ' 79' ' ' PRO . 16.3 pt -121.29 -9.52 9.71 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.157 -0.474 . . . . 73.420000000000002 111.166 179.932 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 114' ' ' ILE . . . . . 0.924 ' O ' HG23 ' A' ' 118' ' ' THR . 30.2 mm -65.53 -45.85 91.42 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.187 -0.461 . . . . 73.420000000000002 111.18 179.819 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 115' ' ' PHE . . . . . 0.726 ' CE1' HD13 ' A' ' 25' ' ' ILE . 31.8 t80 -73.03 -34.49 66.38 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.173 -0.467 . . . . 64.540000000000006 110.901 179.917 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 9.0 mm-40 -68.06 -47.88 67.11 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.131 -0.486 . . . . 72.340000000000003 110.92 -179.934 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 117' ' ' ILE . . . . . 0.784 HD11 ' CD2' ' A' ' 101' ' ' PHE . 0.9 OUTLIER -63.53 -39.98 87.35 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.13 -0.487 . . . . 71.200000000000003 111.133 179.938 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 118' ' ' THR . . . . . 0.924 HG23 ' O ' ' A' ' 114' ' ' ILE . 46.9 p -68.0 -43.54 78.65 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.18 -0.464 . . . . 73.340000000000003 111.13 179.972 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -68.01 -44.15 77.21 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.206 -0.452 . . . . 75.239999999999995 110.876 -179.877 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 120' ' ' PHE . . . . . 0.546 ' CD2' HD11 ' A' ' 104' ' ' ILE . 1.2 t80 -60.79 -49.45 77.43 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.147 -0.479 . . . . 71.019999999999996 110.881 -179.948 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 121' ' ' THR . . . . . 0.862 HG22 HD22 ' A' ' 97' ' ' LEU . 75.5 p -60.04 -40.37 89.14 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.143 -0.481 . . . . 73.230000000000004 111.171 -179.891 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -68.07 -51.34 47.65 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.208 -0.451 . . . . 74.109999999999999 110.894 179.972 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 123' ' ' GLU . . . . . 0.47 ' CG ' ' N ' ' A' ' 124' ' ' LYS . 4.5 pt-20 -58.91 -46.21 88.43 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.267 -0.424 . . . . 72.109999999999999 110.876 -179.908 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 124' ' ' LYS . . . . . 0.47 ' N ' ' CG ' ' A' ' 123' ' ' GLU . 0.0 OUTLIER -73.77 -26.91 60.89 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.17 -0.468 . . . . 63.43 110.896 179.966 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 125' ' ' LEU . . . . . 0.757 HD11 ' CB ' ' A' ' 62' ' ' SER . 2.5 tp -67.9 -50.21 57.5 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.234 -0.439 . . . . 74.319999999999993 110.944 179.913 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -61.41 -38.44 87.09 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.175 -0.466 . . . . 60.310000000000002 110.872 179.803 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 127' ' ' GLU . . . . . 0.433 ' HG3' ' N ' ' A' ' 128' ' ' PHE . 0.0 OUTLIER -62.27 -28.97 70.09 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.218 -0.446 . . . . 74.129999999999995 110.868 -179.879 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 128' ' ' PHE . . . . . 0.514 ' CE2' ' HG3' ' A' ' 93' ' ' GLN . 0.6 OUTLIER -77.09 -47.28 20.92 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.148 -0.478 . . . . 62.020000000000003 110.882 -179.912 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 129' ' ' GLN . . . . . 0.498 ' CG ' HG22 ' A' ' 60' ' ' VAL . 1.5 tm0? -67.92 -44.26 77.27 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.14 -0.482 . . . . 75.129999999999995 110.883 -179.916 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 130' ' ' ASN . . . . . 0.739 ' C ' HG23 ' A' ' 131' ' ' VAL . 37.8 t30 -62.89 -84.19 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.203 -0.453 . . . . 72.25 110.896 -179.933 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 131' ' ' VAL . . . . . 0.739 HG23 ' C ' ' A' ' 130' ' ' ASN . 2.7 t 86.29 -27.91 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 116.134 -0.485 . . . . 62.240000000000002 111.158 179.948 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 132' ' ' VAL . . . . . 0.502 ' CG2' ' O ' ' A' ' 131' ' ' VAL . 91.3 t -160.9 112.71 0.1 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.207 -0.451 . . . . 35.200000000000003 111.102 179.924 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 133' ' ' ASN . . . . . 0.42 ' O ' ' CB ' ' A' ' 134' ' ' THR . 11.0 p-10 -37.41 146.53 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.203 -0.453 . . . . 70.409999999999997 110.835 -179.987 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 134' ' ' THR . . . . . 0.42 ' CB ' ' O ' ' A' ' 133' ' ' ASN . 0.7 OUTLIER 78.97 -67.64 0.16 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.161 -0.472 . . . . 64.109999999999999 111.161 -179.97 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 69.59 159.32 0.18 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.2 -0.455 . . . . 74.25 110.896 179.969 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -84.83 125.17 32.37 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.184 -0.462 . . . . 61.32 110.863 -179.798 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 137' ' ' LEU . . . . . . . . . . . . . 5.5 tp -51.38 -45.82 62.58 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.172 -0.467 . . . . 74.310000000000002 110.888 -179.96 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--N 1.329 -0.291 0 CA-C-N 116.246 -0.434 . . . . 52.329999999999998 110.868 179.94 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 2.4 mtt . . . . . 0 C--O 1.231 0.084 0 CA-C-O 120.765 0.317 . . . . 73.040000000000006 110.861 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 83.6 p -154.01 -46.98 0.09 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.213 -0.448 . . . . 63.5 110.85 -179.798 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -91.35 145.69 24.43 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.116 -0.493 . . . . 65.030000000000001 110.881 -179.967 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . 0.415 ' O ' ' CB ' ' A' ' 5' ' ' HIS . 19.1 m -167.13 162.26 15.15 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.162 -0.472 . . . . 75.310000000000002 110.836 -179.944 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 5' ' ' HIS . . . . . 0.415 ' CB ' ' O ' ' A' ' 4' ' ' SER . 0.2 OUTLIER 77.25 121.46 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.123 -0.489 . . . . 73.109999999999999 110.839 179.924 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . 0.406 ' C ' ' O ' ' A' ' 5' ' ' HIS . 0.2 OUTLIER 37.71 83.59 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.194 -0.457 . . . . 64.340000000000003 110.906 -179.951 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . 0.449 ' OG1' ' N ' ' A' ' 8' ' ' LEU . 6.4 t 177.02 -174.94 0.12 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.201 -0.454 . . . . 65.299999999999997 111.181 179.923 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.449 ' N ' ' OG1' ' A' ' 7' ' ' THR . 50.9 mt -65.54 -27.63 68.59 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.231 -0.441 . . . . 65.319999999999993 110.916 -180.0 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 37.2 t70 -50.61 -31.13 15.11 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.187 -0.46 . . . . 74.450000000000003 110.894 179.819 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 82.6 mm-40 -67.51 -39.65 85.11 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.185 -0.461 . . . . 73.319999999999993 110.931 -179.938 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 19.2 m-85 -59.41 -25.4 64.29 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.176 -0.466 . . . . 74.319999999999993 110.945 -179.925 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 1.6 t80 -59.33 -38.98 81.7 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.155 -0.475 . . . . 70.299999999999997 110.901 -179.905 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -61.43 -42.52 98.88 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.166 -0.47 . . . . 61.109999999999999 110.879 -179.964 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 3.1 mp -67.54 -41.9 86.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.171 -0.468 . . . . 73.109999999999999 111.169 179.957 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . 0.42 ' NE2' ' O ' ' A' ' 71' ' ' THR . 73.0 mt-30 -60.88 -44.7 96.71 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.12 -0.491 . . . . 73.340000000000003 110.901 179.917 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 6.9 t -64.02 -39.6 94.47 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.217 -0.447 . . . . 64.219999999999999 110.911 -179.919 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 8.0 m-20 -58.02 -33.92 69.48 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.158 -0.474 . . . . 65.430000000000007 110.889 -179.9 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . 0.4 ' CD ' ' OH ' ' A' ' 74' ' ' TYR . 1.6 mm-40 -65.38 -37.67 87.71 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.173 -0.467 . . . . 73.439999999999998 110.886 -179.986 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.419 ' CD2' HG13 ' A' ' 46' ' ' ILE . 5.9 mp -66.14 -51.4 58.23 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.134 -0.485 . . . . 73.340000000000003 110.952 179.99 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -68.68 -34.18 75.24 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.196 -0.457 . . . . 74.019999999999996 110.881 179.915 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -64.54 -50.85 65.68 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.145 -0.479 . . . . 71.030000000000001 111.113 179.906 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . 0.748 ' HA ' HD12 ' A' ' 25' ' ' ILE . 0.6 OUTLIER -75.1 -34.46 31.82 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 116.252 -0.431 . . . . 70.329999999999998 111.161 179.943 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . 0.519 ' O ' ' CA ' ' A' ' 27' ' ' MET . 0.0 OUTLIER -52.43 -35.53 52.33 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.177 -0.465 . . . . 64.540000000000006 110.896 179.972 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -68.43 -28.53 67.15 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.132 -0.486 . . . . 74.209999999999994 110.908 -179.833 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . 0.785 HD13 ' CE1' ' A' ' 115' ' ' PHE . 4.7 mt -84.13 -45.15 18.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.134 -0.485 . . . . 72.519999999999996 111.137 179.939 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 26' ' ' TYR . . . . . 0.508 ' O ' ' N ' ' A' ' 29' ' ' ASP . 32.3 m-85 -106.32 21.01 18.1 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.146 -0.479 . . . . 73.310000000000002 110.915 -179.991 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 27' ' ' MET . . . . . 0.519 ' CA ' ' O ' ' A' ' 23' ' ' ARG . 0.0 OUTLIER -33.87 -45.56 0.19 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.112 -0.494 . . . . 73.25 110.873 179.951 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 31.1 t70 -86.19 -31.19 21.9 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.209 -0.45 . . . . 74.349999999999994 110.871 179.965 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . 0.508 ' N ' ' O ' ' A' ' 26' ' ' TYR . 1.3 m-20 -103.21 37.77 1.91 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.151 -0.477 . . . . 44.450000000000003 110.907 179.972 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 30' ' ' PHE . . . . . 0.607 ' HA ' HD13 ' A' ' 50' ' ' ILE . 0.6 OUTLIER -109.91 135.13 51.26 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.183 -0.462 . . . . 65.400000000000006 110.876 -179.881 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 45.4 m -115.24 130.9 57.04 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.132 -0.485 . . . . 72.5 111.182 -179.934 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -104.9 115.3 30.06 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.283 -0.417 . . . . 62.140000000000001 110.904 179.925 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.898 HD21 ' CE1' ' A' ' 67' ' ' HIS . 0.5 OUTLIER -119.18 4.01 11.34 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.223 -0.444 . . . . 54.509999999999998 110.882 -179.915 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . 0.539 ' N ' HD12 ' A' ' 33' ' ' LEU . 1.3 m -68.91 127.26 32.49 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.213 -0.449 . . . . 64.519999999999996 111.125 179.945 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 1.4 ptmt -64.08 88.31 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.198 -0.455 . . . . 74.439999999999998 110.866 179.904 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . 0.443 ' O ' ' C ' ' A' ' 37' ' ' LYS . 0.4 OUTLIER -98.15 -62.17 1.28 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.208 -0.451 . . . . 74.120000000000005 110.894 179.929 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . 0.443 ' C ' ' O ' ' A' ' 36' ' ' ARG . 1.8 mmtt -34.53 142.06 0.05 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.24 -0.436 . . . . 70.329999999999998 110.875 179.957 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 2.8 t -70.12 167.33 17.96 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.245 -0.434 . . . . 64.409999999999997 110.812 -179.906 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . 0.432 ' O ' ' CB ' ' A' ' 40' ' ' TRP . 2.9 m 58.84 164.05 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.09 -0.505 . . . . 42.229999999999997 110.868 -179.83 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 40' ' ' TRP . . . . . 0.554 ' O ' ' CE3' ' A' ' 40' ' ' TRP . 0.0 OUTLIER 78.25 -41.98 0.33 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.135 -0.484 . . . . 74.019999999999996 110.902 179.991 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . 0.553 ' HB2' ' CD2' ' A' ' 40' ' ' TRP . 7.3 t0 -178.74 148.19 0.41 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.247 -0.433 . . . . 51.310000000000002 110.872 179.945 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 32.2 mtmt -148.14 76.5 1.37 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.244 -0.435 . . . . 75.329999999999998 110.914 179.966 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 2.5 mt-30 -166.17 64.28 0.87 Allowed Pre-proline 0 C--N 1.329 -0.287 0 CA-C-O 121.634 0.73 . . . . 63.140000000000001 110.933 179.961 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.73 162.17 43.1 Favored 'Trans proline' 0 C--N 1.342 0.216 0 C-N-CA 122.681 2.254 . . . . 74.230000000000004 112.328 179.994 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 45' ' ' GLN . . . . . 0.506 ' O ' HG22 ' A' ' 46' ' ' ILE . 17.6 tt0 -132.65 11.36 4.4 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.192 -0.458 . . . . 71.319999999999993 110.899 179.996 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . 0.506 HG22 ' O ' ' A' ' 45' ' ' GLN . 0.0 OUTLIER 81.67 -11.56 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.178 -0.465 . . . . 54.350000000000001 111.108 179.936 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . 0.468 HG12 ' CD1' ' A' ' 33' ' ' LEU . 0.2 OUTLIER -51.5 150.57 0.91 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 116.157 -0.474 . . . . 73.200000000000003 111.114 179.879 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 6.8 p90 -161.95 161.19 28.57 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.118 -0.492 . . . . 73.030000000000001 110.875 179.968 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . 0.57 ' CD ' HD23 ' A' ' 33' ' ' LEU . 8.6 mt-10 -111.25 161.02 16.44 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.137 -0.483 . . . . 71.340000000000003 110.858 -179.942 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . 0.607 HD13 ' HA ' ' A' ' 30' ' ' PHE . 7.8 mm -140.27 132.38 32.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.114 -0.493 . . . . 73.519999999999996 111.173 179.941 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 24.2 m -84.44 123.29 30.07 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.205 -0.452 . . . . 75.209999999999994 111.164 179.995 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . 0.533 HD12 HD12 ' A' ' 66' ' ' LEU . 31.2 mt -121.72 164.98 16.48 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.229 -0.442 . . . . 61.229999999999997 110.928 179.979 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 53' ' ' ARG . . . . . 0.67 ' C ' HD21 ' A' ' 125' ' ' LEU . 7.6 ptt180 175.68 163.42 0.32 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.231 -0.44 . . . . 71.049999999999997 110.848 179.943 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . 0.882 ' CA ' HD11 ' A' ' 125' ' ' LEU . 1.4 t -60.59 -156.47 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.184 -0.462 . . . . 71.219999999999999 110.87 -179.842 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . 0.417 HG22 ' OD1' ' A' ' 126' ' ' ASP . 15.7 m -122.31 -22.84 2.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.114 -0.494 . . . . 73.299999999999997 111.144 179.896 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 56' ' ' ASP . . . . . 0.439 ' OD1' ' N ' ' A' ' 56' ' ' ASP . 0.2 OUTLIER -110.5 -175.39 2.71 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.181 -0.463 . . . . 61.399999999999999 110.889 179.906 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 3.9 mmmm -118.47 -10.87 10.04 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.173 -0.467 . . . . 61.140000000000001 110.884 179.999 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . 0.558 ' HA ' ' C ' ' A' ' 59' ' ' PRO . 44.3 mt-10 -126.34 141.89 41.24 Favored Pre-proline 0 C--N 1.329 -0.288 0 CA-C-O 121.659 0.742 . . . . 74.25 110.885 179.974 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 59' ' ' PRO . . . . . 0.558 ' C ' ' HA ' ' A' ' 58' ' ' GLU . 53.4 Cg_endo -69.79 -3.18 7.58 Favored 'Cis proline' 0 C--N 1.342 0.205 0 C-N-CA 122.653 -1.811 . . . . 63.240000000000002 112.36 0.035 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 60' ' ' VAL . . . . . 0.667 HG22 ' HG2' ' A' ' 129' ' ' GLN . 18.3 m -157.61 -173.29 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.232 -0.44 . . . . 74.530000000000001 111.144 179.918 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . 0.408 ' O ' ' O ' ' A' ' 62' ' ' SER . 8.3 tt0 -114.86 -22.1 9.8 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.184 -0.462 . . . . 72.129999999999995 110.873 -179.969 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . 0.844 ' HB3' HD13 ' A' ' 125' ' ' LEU . 0.4 OUTLIER 49.4 101.63 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.137 -0.483 . . . . 61.149999999999999 110.864 -179.787 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 63' ' ' SER . . . . . 0.405 ' HB3' ' CD ' ' A' ' 87' ' ' GLN . 26.0 t -125.31 123.26 39.05 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.14 -0.482 . . . . 75.299999999999997 110.887 -179.83 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 64' ' ' ILE . . . . . 0.921 HD11 HG21 ' A' ' 89' ' ' VAL . 64.7 mt -145.16 142.56 22.59 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.178 -0.465 . . . . 55.549999999999997 111.163 179.938 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 23.5 m -107.52 119.07 38.4 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.198 -0.455 . . . . 40.020000000000003 111.123 -179.994 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . 0.565 HD11 HG21 ' A' ' 121' ' ' THR . 54.1 mt -99.01 109.97 22.64 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.242 -0.436 . . . . 72.420000000000002 110.915 179.913 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 67' ' ' HIS . . . . . 0.898 ' CE1' HD21 ' A' ' 33' ' ' LEU . 1.9 t60 -96.47 109.76 22.26 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.152 -0.476 . . . . 64.040000000000006 110.853 179.869 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 68' ' ' PHE . . . . . 0.493 ' HD2' HD12 ' A' ' 81' ' ' ILE . 0.0 OUTLIER -103.92 139.91 38.42 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.245 -0.434 . . . . 73.140000000000001 110.875 -179.911 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . 0.451 ' O ' ' CB ' ' A' ' 79' ' ' PRO . . . -126.64 129.04 47.71 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.145 -0.479 . . . . 63.140000000000001 111.119 179.908 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 70' ' ' MET . . . . . 0.473 ' CE ' HD11 ' A' ' 114' ' ' ILE . 0.0 OUTLIER -94.64 157.86 15.78 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.234 -0.439 . . . . 73.010000000000005 110.854 179.982 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 71' ' ' THR . . . . . 0.42 ' O ' ' NE2' ' A' ' 15' ' ' GLN . 0.1 OUTLIER -112.16 162.93 19.09 Favored Pre-proline 0 C--N 1.33 -0.241 0 CA-C-O 121.601 0.715 . . . . 51.240000000000002 111.096 -179.945 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.76 0.1 6.13 Favored 'Trans proline' 0 C--N 1.341 0.173 0 C-N-CA 122.71 2.273 . . . . 60.109999999999999 112.348 179.933 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 73' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -115.06 -26.71 7.6 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.241 -0.436 . . . . 63.240000000000002 110.911 179.895 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 74' ' ' TYR . . . . . 0.66 ' CD1' ' C ' ' A' ' 74' ' ' TYR . 0.0 OUTLIER -45.76 151.66 0.81 Allowed Pre-proline 0 C--N 1.329 -0.323 0 CA-C-O 121.675 0.75 . . . . 72.329999999999998 110.935 -179.873 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 75' ' ' PRO . . . . . 0.552 ' HA ' ' CD2' ' A' ' 74' ' ' TYR . 53.6 Cg_endo -69.8 2.15 5.02 Favored 'Cis proline' 0 C--O 1.232 0.205 0 C-N-CA 122.634 -1.819 . . . . 61.210000000000001 112.329 -0.036 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 76' ' ' TYR . . . . . 0.729 ' O ' HG23 ' A' ' 77' ' ' THR . 19.6 t80 -75.3 44.46 0.26 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.258 -0.428 . . . . 72.219999999999999 110.967 -179.968 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 77' ' ' THR . . . . . 0.729 HG23 ' O ' ' A' ' 76' ' ' TYR . 0.6 OUTLIER -172.61 -177.57 1.75 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.086 -0.506 . . . . 73.129999999999995 111.181 -179.971 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -118.73 116.59 34.58 Favored Pre-proline 0 C--N 1.329 -0.313 0 CA-C-O 121.587 0.708 . . . . 73.099999999999994 111.075 179.863 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 79' ' ' PRO . . . . . 0.474 ' HG3' ' CD1' ' A' ' 113' ' ' ILE . 53.7 Cg_endo -69.72 -164.66 0.13 Allowed 'Trans proline' 0 C--N 1.342 0.192 0 C-N-CA 122.674 2.249 . . . . 50.5 112.356 179.978 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . 0.578 ' O ' HD13 ' A' ' 81' ' ' ILE . 0.3 OUTLIER -135.32 136.03 41.24 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.19 -0.459 . . . . 71.439999999999998 110.907 179.985 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 81' ' ' ILE . . . . . 0.578 HD13 ' O ' ' A' ' 80' ' ' GLU . 10.0 mm -127.99 144.34 37.98 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.113 -0.494 . . . . 60.329999999999998 111.168 179.954 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . 0.453 ' HG3' ' CD ' ' A' ' 84' ' ' LYS . 1.2 pt-20 -148.51 145.93 28.12 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.162 -0.472 . . . . 72.230000000000004 110.888 179.973 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 83' ' ' PHE . . . . . 0.558 ' CE2' ' HD3' ' A' ' 98' ' ' LYS . 7.3 m-85 -99.33 139.95 34.22 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.171 -0.468 . . . . 74.420000000000002 110.895 -179.965 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 84' ' ' LYS . . . . . 0.478 ' O ' ' N ' ' A' ' 86' ' ' VAL . 5.3 mmmt -127.06 173.62 9.53 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.172 -0.467 . . . . 74.129999999999995 110.889 179.981 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . 0.549 HD22 ' N ' ' A' ' 85' ' ' ASN . 1.2 m-80 61.35 -75.51 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.191 -0.459 . . . . 55.43 110.907 179.946 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 86' ' ' VAL . . . . . 0.672 HG11 HD21 ' A' ' 94' ' ' LEU . 3.6 m 40.22 91.35 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.151 -0.477 . . . . 75.239999999999995 111.099 179.858 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 87' ' ' GLN . . . . . 0.405 ' CD ' ' HB3' ' A' ' 63' ' ' SER . 0.1 OUTLIER -96.79 -65.08 0.99 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.143 -0.48 . . . . 74.299999999999997 110.934 179.974 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 88' ' ' ASN . . . . . 0.47 ' ND2' ' HB ' ' A' ' 60' ' ' VAL . 8.5 m120 -84.95 34.23 0.54 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.218 -0.447 . . . . 74.140000000000001 110.907 -179.995 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 89' ' ' VAL . . . . . 0.921 HG21 HD11 ' A' ' 64' ' ' ILE . 17.1 t -138.06 146.57 26.86 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.205 -0.452 . . . . 61.229999999999997 111.148 179.925 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 90' ' ' MET . . . . . . . . . . . . . 13.7 mtm -101.75 -62.97 1.19 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.186 -0.461 . . . . 71.219999999999999 110.857 179.932 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -179.53 -32.73 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.215 -0.448 . . . . 74.450000000000003 110.848 179.973 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 39.0 t -53.97 -42.3 68.8 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.206 -0.452 . . . . 74.219999999999999 110.872 -179.789 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 93' ' ' GLN . . . . . 0.579 ' HG3' ' CZ ' ' A' ' 128' ' ' PHE . 0.2 OUTLIER -70.36 -39.69 74.46 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.132 -0.485 . . . . 74.129999999999995 110.945 -179.98 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . 0.672 HD21 HG11 ' A' ' 86' ' ' VAL . 7.4 mp -59.76 -48.16 82.77 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.174 -0.466 . . . . 64.400000000000006 110.927 179.992 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 73.7 mt-30 -65.52 -33.91 77.03 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.186 -0.461 . . . . 71.340000000000003 110.944 179.91 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 96' ' ' MET . . . . . . . . . . . . . 46.7 ttp -59.8 -38.01 80.73 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.193 -0.458 . . . . 75.540000000000006 110.891 179.947 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 97' ' ' LEU . . . . . 0.665 HD22 HG22 ' A' ' 121' ' ' THR . 30.4 mt -72.21 -38.97 68.89 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.226 -0.443 . . . . 74.140000000000001 110.954 179.992 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 98' ' ' LYS . . . . . 0.558 ' HD3' ' CE2' ' A' ' 83' ' ' PHE . 2.3 mmmp? -57.1 -38.36 73.28 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.169 -0.469 . . . . 60.130000000000003 110.945 179.797 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 5.1 m -63.26 -40.32 97.08 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.185 -0.462 . . . . 74.540000000000006 110.872 -179.897 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 100' ' ' GLU . . . . . 0.536 ' O ' HD12 ' A' ' 104' ' ' ILE . 4.2 mm-40 -74.24 -26.46 60.25 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.129 -0.487 . . . . 72.200000000000003 110.894 -179.961 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 101' ' ' PHE . . . . . 0.596 ' CD1' ' O ' ' A' ' 97' ' ' LEU . 12.7 m-30 -59.44 -29.95 68.14 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.171 -0.468 . . . . 72.319999999999993 110.887 -179.94 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 1.9 tmpt? -74.82 -42.43 58.05 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.158 -0.474 . . . . 73.239999999999995 110.86 179.978 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 103' ' ' LYS . . . . . 0.408 ' HG2' ' N ' ' A' ' 104' ' ' ILE . 0.0 OUTLIER -70.13 -37.82 75.4 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.242 -0.436 . . . . 71.219999999999999 110.905 179.885 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 104' ' ' ILE . . . . . 0.536 HD12 ' O ' ' A' ' 100' ' ' GLU . 4.2 mt -63.47 -47.52 91.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.217 -0.447 . . . . 71.319999999999993 111.088 179.888 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 105' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -61.49 -41.09 96.75 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.223 -0.444 . . . . 74.310000000000002 110.879 179.9 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -61.66 -41.05 97.01 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.157 -0.474 . . . . 64.349999999999994 110.877 -179.921 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 8.8 t -81.41 -28.27 34.38 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.15 -0.477 . . . . 54.130000000000003 111.18 -179.986 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 108' ' ' SER . . . . . 0.555 ' HB2' HG22 ' A' ' 113' ' ' ILE . 67.1 m -100.47 17.48 21.52 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.178 -0.464 . . . . 55.399999999999999 110.856 -179.897 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.23 90.86 0.15 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.135 -0.484 . . . . 75.239999999999995 110.875 -179.961 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 137.57 -23.39 3.11 Favored Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.737 -0.744 . . . . 63.340000000000003 112.447 -179.997 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 111' ' ' GLN . . . . . . . . . . . . . 4.7 pt20 -119.64 -156.8 0.68 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.721 0.296 . . . . 74.209999999999994 110.962 -179.903 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 46.8 mt-10 -72.62 139.54 47.45 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.208 -0.451 . . . . 74.120000000000005 110.866 -179.918 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 113' ' ' ILE . . . . . 0.555 HG22 ' HB2' ' A' ' 108' ' ' SER . 4.7 pt -123.22 -24.66 2.25 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.196 -0.457 . . . . 73.340000000000003 111.139 179.96 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 114' ' ' ILE . . . . . 0.481 ' O ' HG23 ' A' ' 118' ' ' THR . 36.9 mm -59.26 -45.13 93.27 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 116.189 -0.46 . . . . 71.239999999999995 111.136 179.856 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 115' ' ' PHE . . . . . 0.785 ' CE1' HD13 ' A' ' 25' ' ' ILE . 28.8 t80 -66.95 -35.29 79.65 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.116 -0.493 . . . . 75.510000000000005 110.865 179.967 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 5.2 mm-40 -66.81 -47.91 70.58 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.154 -0.475 . . . . 73.430000000000007 110.89 -179.888 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 117' ' ' ILE . . . . . 0.558 ' O ' HG23 ' A' ' 121' ' ' THR . 0.3 OUTLIER -64.42 -41.92 93.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.133 -0.485 . . . . 70.219999999999999 111.151 179.959 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 118' ' ' THR . . . . . 0.482 ' N ' ' CG2' ' A' ' 117' ' ' ILE . 66.1 p -67.84 -42.25 81.71 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.208 -0.451 . . . . 64.200000000000003 111.141 179.979 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 6.1 t -66.55 -44.25 82.87 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.229 -0.442 . . . . 60.109999999999999 110.869 -179.876 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 120' ' ' PHE . . . . . 0.407 ' CE2' ' NZ ' ' A' ' 124' ' ' LYS . 0.2 OUTLIER -64.95 -47.08 78.91 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.132 -0.485 . . . . 73.349999999999994 110.88 -179.948 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 121' ' ' THR . . . . . 0.665 HG22 HD22 ' A' ' 97' ' ' LEU . 76.3 p -67.68 -38.96 84.45 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.163 -0.472 . . . . 72.319999999999993 111.159 -179.933 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 9.9 tt0 -64.96 -47.99 75.66 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.238 -0.437 . . . . 71.230000000000004 110.884 179.986 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 3.0 pt-20 -63.73 -39.25 93.84 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.262 -0.426 . . . . 72.140000000000001 110.86 -179.897 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 124' ' ' LYS . . . . . 0.418 ' O ' ' CG ' ' A' ' 127' ' ' GLU . 0.0 OUTLIER -67.49 -40.95 85.25 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.189 -0.46 . . . . 72.420000000000002 110.896 179.948 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 125' ' ' LEU . . . . . 0.882 HD11 ' CA ' ' A' ' 54' ' ' SER . 0.2 OUTLIER -68.95 -36.89 78.46 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.17 -0.468 . . . . 72.219999999999999 110.94 179.944 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 126' ' ' ASP . . . . . 0.417 ' OD1' HG22 ' A' ' 55' ' ' VAL . 7.9 t0 -64.02 -41.96 97.27 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.166 -0.47 . . . . 74.409999999999997 110.889 179.775 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 127' ' ' GLU . . . . . 0.418 ' CG ' ' O ' ' A' ' 124' ' ' LYS . 8.2 pt-20 -69.91 -37.49 75.98 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.152 -0.476 . . . . 75.519999999999996 110.87 -179.882 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 128' ' ' PHE . . . . . 0.579 ' CZ ' ' HG3' ' A' ' 93' ' ' GLN . 1.1 m-85 -50.04 -53.27 28.01 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.154 -0.476 . . . . 74.129999999999995 110.9 -179.932 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 129' ' ' GLN . . . . . 0.667 ' HG2' HG22 ' A' ' 60' ' ' VAL . 1.9 mt-30 -53.41 -41.77 66.33 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.113 -0.494 . . . . 65.109999999999999 110.87 -179.927 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 130' ' ' ASN . . . . . . . . . . . . . 1.2 t30 -44.01 -38.42 3.52 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.2 -0.455 . . . . 73.219999999999999 110.874 -179.943 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 131' ' ' VAL . . . . . 0.764 ' O ' HG22 ' A' ' 131' ' ' VAL . 1.4 p -164.99 74.75 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.209 -0.45 . . . . 73.400000000000006 111.116 179.95 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 132' ' ' VAL . . . . . 0.649 HG22 HG22 ' A' ' 134' ' ' THR . 7.3 p -94.36 136.87 24.46 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.195 -0.457 . . . . 64.010000000000005 111.14 179.904 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 133' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -69.01 92.59 0.53 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.192 -0.458 . . . . 74.120000000000005 110.869 -179.985 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 134' ' ' THR . . . . . 0.649 HG22 HG22 ' A' ' 132' ' ' VAL . 0.4 OUTLIER 174.75 -40.4 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.172 -0.467 . . . . 71.310000000000002 111.125 179.998 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER 38.49 74.03 0.1 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.215 -0.448 . . . . 74.329999999999998 110.887 179.996 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 175.9 173.56 0.32 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.185 -0.462 . . . . 63.009999999999998 110.822 -179.824 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 137' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -85.54 -174.52 5.22 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.163 -0.471 . . . . 65.200000000000003 110.92 180.0 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--N 1.33 -0.282 0 CA-C-N 116.222 -0.444 . . . . 75.219999999999999 110.861 179.933 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 8.0 ptp . . . . . 0 C--O 1.232 0.137 0 CA-C-O 120.787 0.327 . . . . 72.439999999999998 110.912 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 51.9 p -120.12 151.06 39.61 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.246 -0.434 . . . . 63.509999999999998 110.838 -179.789 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 3.3 mt -128.56 177.54 6.94 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.122 -0.49 . . . . 53.420000000000002 110.96 179.987 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 69.5 m -99.09 87.21 3.62 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.214 -0.448 . . . . 73.209999999999994 110.858 -179.941 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 5' ' ' HIS . . . . . 0.401 ' O ' ' C ' ' A' ' 6' ' ' LEU . 1.3 p80 -149.28 105.48 3.5 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.128 -0.487 . . . . 71.510000000000005 110.852 179.973 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . 0.401 ' C ' ' O ' ' A' ' 5' ' ' HIS . 6.2 tp 37.96 72.74 0.12 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.187 -0.46 . . . . 70.310000000000002 110.882 179.999 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . 0.427 ' OG1' ' N ' ' A' ' 8' ' ' LEU . 1.8 t -162.32 175.16 11.87 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.2 -0.454 . . . . 75.030000000000001 111.136 179.922 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.656 HD13 ' O ' ' A' ' 72' ' ' PRO . 47.9 mt -49.98 -23.29 1.93 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.22 -0.446 . . . . 73.319999999999993 110.929 179.924 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -51.5 -32.11 26.33 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.2 -0.455 . . . . 63.310000000000002 110.885 179.836 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 80.6 mm-40 -68.11 -37.75 81.51 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.149 -0.478 . . . . 74.430000000000007 110.903 -179.917 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 22.0 m-85 -59.74 -27.98 66.97 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.214 -0.448 . . . . 72.030000000000001 110.95 -179.857 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -59.54 -37.04 77.34 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.091 -0.504 . . . . 73.099999999999994 110.911 -179.94 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 1.4 mm-40 -64.13 -45.22 89.5 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.105 -0.498 . . . . 73.310000000000002 110.84 -179.944 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 4.2 mp -67.51 -42.64 87.2 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.178 -0.464 . . . . 74.219999999999999 111.184 179.95 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . 0.603 ' HB3' HG21 ' A' ' 46' ' ' ILE . 62.4 mt-30 -65.59 -48.4 72.47 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.168 -0.469 . . . . 75.129999999999995 110.925 179.921 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 4.2 t -58.57 -37.22 75.28 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.223 -0.444 . . . . 71.450000000000003 110.903 -179.942 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -57.79 -33.83 68.97 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.143 -0.481 . . . . 63.130000000000003 110.913 -179.91 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 14.8 mt-10 -66.97 -38.15 85.55 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.141 -0.481 . . . . 64.319999999999993 110.9 -179.992 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.408 ' CD2' HG13 ' A' ' 46' ' ' ILE . 8.9 mp -63.42 -51.34 66.16 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.117 -0.492 . . . . 75.109999999999999 110.911 -179.96 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 3.0 pt-20 -68.48 -34.83 76.6 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.147 -0.478 . . . . 75.209999999999994 110.877 179.949 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -66.49 -50.44 63.29 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.163 -0.471 . . . . 74.150000000000006 111.107 179.923 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . 0.592 HD11 ' HB2' ' A' ' 115' ' ' PHE . 0.8 OUTLIER -74.21 -34.46 37.71 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.261 -0.427 . . . . 74.299999999999997 111.165 179.968 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 38.1 mtp180 -52.9 -34.8 56.55 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.192 -0.458 . . . . 71.239999999999995 110.873 179.91 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -67.13 -35.26 79.35 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.221 -0.445 . . . . 74.5 110.831 -179.762 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . 0.651 HD13 ' CE1' ' A' ' 115' ' ' PHE . 3.2 mt -80.05 -45.09 22.74 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.155 -0.475 . . . . 75.129999999999995 111.126 179.978 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 25.2 m-85 -107.02 45.14 1.0 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.176 -0.465 . . . . 54.219999999999999 110.907 -179.97 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 2.2 mtm -43.08 -54.07 4.56 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.191 -0.459 . . . . 73.430000000000007 110.861 179.911 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -92.99 -24.42 18.37 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.236 -0.438 . . . . 73.230000000000004 110.865 179.987 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 9.1 m-20 -86.99 28.76 0.87 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.182 -0.463 . . . . 62.0 110.861 179.968 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 30' ' ' PHE . . . . . 0.611 ' C ' ' CD1' ' A' ' 30' ' ' PHE . 0.4 OUTLIER -113.5 144.34 43.01 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.222 -0.445 . . . . 72.129999999999995 110.892 -179.917 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . 0.4 ' N ' ' CD1' ' A' ' 30' ' ' PHE . 52.6 m -123.9 130.07 52.0 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.126 -0.488 . . . . 75.400000000000006 111.092 -179.902 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -96.92 114.14 25.74 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.204 -0.453 . . . . 42.420000000000002 110.844 179.88 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 1.113 HD23 ' N ' ' A' ' 34' ' ' THR . 0.1 OUTLIER -117.17 -18.35 10.01 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.217 -0.447 . . . . 74.140000000000001 110.894 -179.961 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . 1.113 ' N ' HD23 ' A' ' 33' ' ' LEU . 4.9 m -34.55 94.39 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.199 -0.455 . . . . 70.439999999999998 111.122 -179.981 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . 0.472 ' N ' ' O ' ' A' ' 33' ' ' LEU . 0.2 OUTLIER -43.55 100.17 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.19 -0.459 . . . . 71.219999999999999 110.872 179.913 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 1.9 mmt-85 -98.85 -83.72 0.41 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.222 -0.445 . . . . 74.140000000000001 110.86 179.985 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 8.8 mmpt? -109.75 -13.41 14.49 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.255 -0.43 . . . . 71.540000000000006 110.908 179.932 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -85.77 -174.23 5.03 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.23 -0.441 . . . . 62.149999999999999 110.825 -179.878 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 4.1 m 63.07 -167.07 0.22 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.108 -0.496 . . . . 62.219999999999999 110.843 -179.807 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 40' ' ' TRP . . . . . . . . . . . . . 15.3 p90 -112.82 -12.47 13.32 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.112 -0.494 . . . . 72.219999999999999 110.943 179.994 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 2.0 t70 -123.14 138.43 54.66 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.223 -0.444 . . . . 74.409999999999997 110.821 179.944 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -123.28 73.6 1.18 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.145 -0.48 . . . . 75.310000000000002 110.867 179.973 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 1.7 mt-30 -141.55 60.79 12.25 Favored Pre-proline 0 C--N 1.329 -0.289 0 CA-C-O 121.611 0.72 . . . . 73.129999999999995 110.958 179.966 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_endo -69.78 -169.37 0.33 Allowed 'Trans proline' 0 C--N 1.341 0.157 0 C-N-CA 122.72 2.28 . . . . 72.540000000000006 112.304 -179.925 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 45' ' ' GLN . . . . . 0.808 ' HG2' HG23 ' A' ' 47' ' ' ILE . 24.5 pt20 -170.81 31.64 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.236 -0.438 . . . . 70.349999999999994 110.875 -179.964 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . 0.699 HG22 ' O ' ' A' ' 45' ' ' GLN . 0.1 OUTLIER 86.68 2.52 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.244 -0.435 . . . . 71.310000000000002 111.182 -179.992 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . 0.808 HG23 ' HG2' ' A' ' 45' ' ' GLN . 0.2 OUTLIER -66.39 147.68 12.48 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.167 -0.47 . . . . 62.240000000000002 111.113 179.864 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 48' ' ' PHE . . . . . 0.926 ' HA ' HD22 ' A' ' 33' ' ' LEU . 6.6 p90 -160.94 163.41 31.86 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.189 -0.46 . . . . 71.319999999999993 110.885 179.977 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . 0.782 ' HG3' HD13 ' A' ' 33' ' ' LEU . 19.1 mt-10 -110.73 157.39 19.8 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.128 -0.487 . . . . 73.5 110.878 -179.929 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . 0.568 HD13 ' HA ' ' A' ' 30' ' ' PHE . 9.5 mm -134.27 135.24 54.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.177 -0.465 . . . . 60.210000000000001 111.136 -179.986 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 99.7 m -85.08 135.08 34.15 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.156 -0.474 . . . . 54.409999999999997 111.131 -179.996 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . 0.574 HD12 HD22 ' A' ' 66' ' ' LEU . 9.1 mt -133.98 156.01 48.95 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.203 -0.453 . . . . 74.150000000000006 110.936 179.978 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 53' ' ' ARG . . . . . 0.619 ' C ' HD21 ' A' ' 125' ' ' LEU . 0.0 OUTLIER -155.92 163.43 39.77 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.174 -0.466 . . . . 74.329999999999998 110.858 179.956 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . 0.687 ' N ' HD21 ' A' ' 125' ' ' LEU . 0.3 OUTLIER -58.72 -169.0 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.174 -0.466 . . . . 33.140000000000001 110.85 -179.753 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -82.51 -37.65 14.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.128 -0.487 . . . . 72.540000000000006 111.131 179.973 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 5.4 t0 -130.43 -153.55 0.57 Allowed 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.157 -0.474 . . . . 50.039999999999999 110.873 179.91 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . 0.442 ' HD2' ' CD ' ' A' ' 61' ' ' GLU . 0.5 OUTLIER -116.94 -11.09 10.85 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.213 -0.449 . . . . 73.319999999999993 110.891 -179.983 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . 0.548 ' HA ' ' C ' ' A' ' 59' ' ' PRO . 1.8 pt-20 -126.6 147.07 59.15 Favored Pre-proline 0 C--N 1.329 -0.3 0 CA-C-O 121.664 0.745 . . . . 64.420000000000002 110.888 179.982 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 59' ' ' PRO . . . . . 0.548 ' C ' ' HA ' ' A' ' 58' ' ' GLU . 53.6 Cg_endo -69.75 -8.38 10.45 Favored 'Cis proline' 0 C--N 1.342 0.217 0 C-N-CA 122.679 -1.8 . . . . 75.530000000000001 112.353 0.011 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 60' ' ' VAL . . . . . 0.43 HG21 ' CG ' ' A' ' 88' ' ' ASN . 14.1 m -149.11 164.77 4.04 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.198 -0.455 . . . . 65.430000000000007 111.143 179.924 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . 0.442 ' CD ' ' HD2' ' A' ' 57' ' ' LYS . 1.9 tp10 -93.95 -28.2 15.93 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.226 -0.443 . . . . 74.209999999999994 110.872 -179.919 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . 0.869 ' HB3' HD11 ' A' ' 125' ' ' LEU . 5.1 t 40.42 93.82 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.146 -0.479 . . . . 62.399999999999999 110.885 -179.796 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 63' ' ' SER . . . . . 0.429 ' HB2' ' CG ' ' A' ' 53' ' ' ARG . 1.3 t -115.17 123.76 49.73 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.142 -0.481 . . . . 43.140000000000001 110.845 -179.801 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 64' ' ' ILE . . . . . 0.666 HD13 HD11 ' A' ' 94' ' ' LEU . 38.0 mt -134.8 137.49 50.83 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 116.165 -0.471 . . . . 53.009999999999998 111.134 179.934 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 51.6 m -100.16 114.6 28.11 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.159 -0.473 . . . . 73.409999999999997 111.156 179.956 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . 0.945 HD21 HG21 ' A' ' 121' ' ' THR . 1.5 mp -94.04 111.46 23.18 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.22 -0.445 . . . . 72.129999999999995 110.887 179.966 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 1.5 t60 -102.77 111.4 23.7 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.184 -0.462 . . . . 53.109999999999999 110.844 179.831 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 68' ' ' PHE . . . . . 0.571 ' CE1' HG23 ' A' ' 114' ' ' ILE . 0.0 OUTLIER -103.83 142.38 34.48 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.199 -0.455 . . . . 70.019999999999996 110.904 -179.944 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -124.8 121.94 36.0 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.121 -0.491 . . . . 43.399999999999999 111.116 179.93 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 70' ' ' MET . . . . . 0.544 ' CE ' HD11 ' A' ' 114' ' ' ILE . 0.0 OUTLIER -86.61 91.41 8.57 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.205 -0.452 . . . . 75.439999999999998 110.869 179.987 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -43.87 157.24 0.28 Allowed Pre-proline 0 C--N 1.33 -0.256 0 CA-C-O 121.589 0.709 . . . . 72.530000000000001 111.118 -179.932 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 72' ' ' PRO . . . . . 0.656 ' O ' HD13 ' A' ' 8' ' ' LEU . 53.9 Cg_endo -69.7 2.21 3.71 Favored 'Trans proline' 0 C--N 1.341 0.169 0 C-N-CA 122.671 2.247 . . . . 54.32 112.364 179.93 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 73' ' ' MET . . . . . 0.492 ' O ' ' CB ' ' A' ' 76' ' ' TYR . 0.1 OUTLIER -118.57 -25.84 6.33 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.208 -0.451 . . . . 75.099999999999994 110.884 179.943 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 74' ' ' TYR . . . . . 0.658 ' CD1' ' C ' ' A' ' 74' ' ' TYR . 0.0 OUTLIER -47.66 150.45 1.8 Allowed Pre-proline 0 C--N 1.329 -0.316 0 CA-C-O 121.697 0.76 . . . . 73.400000000000006 110.915 -179.875 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 75' ' ' PRO . . . . . 0.552 ' C ' ' HA ' ' A' ' 74' ' ' TYR . 53.4 Cg_endo -69.76 -10.97 11.76 Favored 'Cis proline' 0 C--N 1.341 0.182 0 C-N-CA 122.68 -1.8 . . . . 72.420000000000002 112.348 -0.038 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 76' ' ' TYR . . . . . 0.492 ' CB ' ' O ' ' A' ' 73' ' ' MET . 25.0 t80 -34.03 -52.21 0.44 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.189 -0.459 . . . . 71.530000000000001 110.934 -179.879 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 31.0 p -106.46 -175.74 2.88 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.075 -0.511 . . . . 75.120000000000005 111.066 -179.938 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -100.96 132.37 22.13 Favored Pre-proline 0 C--N 1.329 -0.306 0 CA-C-O 121.552 0.691 . . . . 61.229999999999997 111.08 179.89 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 79' ' ' PRO . . . . . 0.711 ' HG3' HD11 ' A' ' 113' ' ' ILE . 53.7 Cg_endo -69.71 -167.52 0.23 Allowed 'Trans proline' 0 C--N 1.341 0.155 0 C-N-CA 122.672 2.248 . . . . 61.140000000000001 112.339 179.969 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . 0.576 ' O ' HD13 ' A' ' 81' ' ' ILE . 1.7 tt0 -130.0 142.63 50.61 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.164 -0.471 . . . . 61.229999999999997 110.905 -179.983 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 81' ' ' ILE . . . . . 0.576 HD13 ' O ' ' A' ' 80' ' ' GLU . 6.1 mm -133.94 141.68 43.31 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.18 -0.464 . . . . 71.129999999999995 111.135 -179.996 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . 0.473 ' HG3' ' CD ' ' A' ' 84' ' ' LYS . 3.5 pt-20 -147.44 140.3 24.94 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.211 -0.45 . . . . 71.329999999999998 110.878 179.995 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 83' ' ' PHE . . . . . 0.511 ' CD1' HD11 ' A' ' 66' ' ' LEU . 11.8 m-85 -95.71 140.98 29.74 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.114 -0.493 . . . . 64.310000000000002 110.847 -179.899 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 84' ' ' LYS . . . . . 0.473 ' CD ' ' HG3' ' A' ' 82' ' ' GLU . 9.8 mmmt -124.53 171.01 10.34 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.149 -0.478 . . . . 55.5 110.895 179.965 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . 0.558 HD22 ' N ' ' A' ' 85' ' ' ASN . 1.1 m-80 63.35 -73.17 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.241 -0.436 . . . . 65.129999999999995 110.891 179.899 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 86' ' ' VAL . . . . . 0.672 HG11 HD21 ' A' ' 94' ' ' LEU . 2.7 m 40.96 94.5 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.142 -0.481 . . . . 62.439999999999998 111.125 179.893 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -97.13 -83.29 0.39 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.136 -0.484 . . . . 62.149999999999999 110.946 179.98 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 88' ' ' ASN . . . . . 0.43 ' CG ' HG21 ' A' ' 60' ' ' VAL . 13.2 t30 -59.99 -40.46 89.26 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.209 -0.45 . . . . 73.430000000000007 110.879 -179.984 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 89' ' ' VAL . . . . . 1.084 HG21 HD13 ' A' ' 94' ' ' LEU . 0.9 OUTLIER -62.58 141.03 18.5 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.157 -0.474 . . . . 74.319999999999993 111.109 179.953 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 90' ' ' MET . . . . . . . . . . . . . 6.8 mtm -97.22 -67.25 0.86 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.149 -0.478 . . . . 71.329999999999998 110.848 179.935 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 6.8 p-10 178.77 -32.4 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.249 -0.432 . . . . 74.409999999999997 110.889 179.997 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -54.55 -46.45 73.64 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.175 -0.466 . . . . 43.310000000000002 110.882 -179.757 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 93' ' ' GLN . . . . . 0.601 ' OE1' ' CE2' ' A' ' 128' ' ' PHE . 1.5 pt20 -70.87 -36.84 72.97 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.136 -0.484 . . . . 72.310000000000002 110.943 -179.98 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . 1.084 HD13 HG21 ' A' ' 89' ' ' VAL . 0.6 OUTLIER -57.66 -47.42 82.31 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.185 -0.461 . . . . 72.510000000000005 110.967 179.991 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 3.5 mm-40 -62.93 -34.09 76.73 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.193 -0.458 . . . . 72.109999999999999 110.913 179.89 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 96' ' ' MET . . . . . . . . . . . . . 19.1 ttp -59.95 -40.04 87.61 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.173 -0.467 . . . . 65.129999999999995 110.912 179.943 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 97' ' ' LEU . . . . . 0.599 ' O ' ' CD1' ' A' ' 101' ' ' PHE . 27.0 mt -68.02 -40.78 82.87 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.204 -0.453 . . . . 71.329999999999998 110.914 179.98 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 98' ' ' LYS . . . . . 0.487 ' HD3' ' CE2' ' A' ' 83' ' ' PHE . 3.7 mmtp -57.26 -36.52 71.08 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.178 -0.465 . . . . 63.450000000000003 110.899 179.857 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -68.93 -43.73 74.51 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.209 -0.45 . . . . 74.209999999999994 110.847 -179.897 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 100' ' ' GLU . . . . . 0.406 ' O ' HD12 ' A' ' 104' ' ' ILE . 37.3 mm-40 -66.82 -24.0 66.11 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.173 -0.467 . . . . 75.049999999999997 110.905 -179.959 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 101' ' ' PHE . . . . . 0.627 ' CD2' HD11 ' A' ' 117' ' ' ILE . 11.1 m-30 -60.53 -37.08 80.03 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.148 -0.478 . . . . 74.340000000000003 110.917 -179.972 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 1.7 tmpt? -63.96 -40.22 95.93 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.112 -0.495 . . . . 75.319999999999993 110.878 -180.0 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 2.3 mppt? -69.48 -40.35 77.12 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.226 -0.443 . . . . 63.25 110.89 179.868 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 104' ' ' ILE . . . . . 0.455 ' O ' ' CG2' ' A' ' 107' ' ' THR . 4.3 mt -64.12 -47.62 89.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.218 -0.446 . . . . 64.420000000000002 111.08 179.913 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 105' ' ' HIS . . . . . 0.474 ' O ' ' N ' ' A' ' 109' ' ' ARG . 3.4 t60 -62.56 -41.28 98.81 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.207 -0.451 . . . . 72.109999999999999 110.854 179.898 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 1.3 t-20 -57.66 -36.95 72.58 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.244 -0.435 . . . . 72.219999999999999 110.905 -179.946 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 107' ' ' THR . . . . . 0.455 ' CG2' ' O ' ' A' ' 104' ' ' ILE . 5.1 t -84.93 -26.1 27.45 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.149 -0.478 . . . . 65.219999999999999 111.141 179.995 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 108' ' ' SER . . . . . 0.49 ' OG ' HG22 ' A' ' 113' ' ' ILE . 27.5 p -109.05 20.87 17.9 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.251 -0.431 . . . . 72.319999999999993 110.885 -179.893 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 109' ' ' ARG . . . . . 0.474 ' N ' ' O ' ' A' ' 105' ' ' HIS . 11.6 ttt180 -62.83 77.48 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.104 -0.498 . . . . 70.319999999999993 110.875 -179.926 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 110' ' ' GLY . . . . . 0.427 ' N ' ' O ' ' A' ' 108' ' ' SER . . . 136.67 33.55 0.23 Allowed Glycine 0 N--CA 1.451 -0.365 0 C-N-CA 120.745 -0.741 . . . . 73.439999999999998 112.488 -179.977 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 111' ' ' GLN . . . . . . . . . . . . . 3.9 pt20 -170.12 -166.27 0.53 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.735 0.302 . . . . 73.319999999999993 110.897 -179.898 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 15.2 mt-10 -68.98 129.98 41.46 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.218 -0.446 . . . . 74.030000000000001 110.914 -179.926 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 113' ' ' ILE . . . . . 0.711 HD11 ' HG3' ' A' ' 79' ' ' PRO . 22.4 pt -126.69 -8.15 4.83 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.202 -0.453 . . . . 71.319999999999993 111.139 179.947 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 114' ' ' ILE . . . . . 0.663 ' O ' HG23 ' A' ' 118' ' ' THR . 42.3 mm -64.88 -44.17 96.25 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-N 116.189 -0.46 . . . . 64.230000000000004 111.127 179.8 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 115' ' ' PHE . . . . . 0.651 ' CE1' HD13 ' A' ' 25' ' ' ILE . 19.2 t80 -68.85 -35.24 76.69 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.208 -0.451 . . . . 73.420000000000002 110.884 179.966 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 35.5 mm-40 -66.48 -46.03 77.69 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.127 -0.488 . . . . 61.530000000000001 110.877 -179.943 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 117' ' ' ILE . . . . . 0.627 HD11 ' CD2' ' A' ' 101' ' ' PHE . 0.4 OUTLIER -64.03 -40.81 90.38 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.149 -0.478 . . . . 73.25 111.168 179.983 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 118' ' ' THR . . . . . 0.663 HG23 ' O ' ' A' ' 114' ' ' ILE . 67.7 p -68.25 -41.56 80.98 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.129 -0.487 . . . . 54.329999999999998 111.136 179.974 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 1.2 t -67.98 -43.5 78.82 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.215 -0.448 . . . . 74.140000000000001 110.871 -179.852 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -66.64 -41.56 88.07 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.174 -0.466 . . . . 74.519999999999996 110.87 -179.971 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 121' ' ' THR . . . . . 0.945 HG21 HD21 ' A' ' 66' ' ' LEU . 11.9 p -67.66 -39.18 84.56 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.119 -0.491 . . . . 51.229999999999997 111.133 -179.926 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 59.1 tt0 -64.99 -50.64 65.53 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.245 -0.434 . . . . 74.349999999999994 110.899 -179.981 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 123' ' ' GLU . . . . . 0.453 ' HG3' ' N ' ' A' ' 124' ' ' LYS . 12.3 pt-20 -60.16 -36.38 77.43 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.173 -0.467 . . . . 62.299999999999997 110.882 -179.921 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 124' ' ' LYS . . . . . 0.49 ' HA ' ' CG ' ' A' ' 127' ' ' GLU . 0.0 OUTLIER -78.52 -32.36 47.99 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.144 -0.48 . . . . 60.310000000000002 110.91 179.942 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 125' ' ' LEU . . . . . 0.869 HD11 ' HB3' ' A' ' 62' ' ' SER . 0.5 OUTLIER -72.25 -41.48 66.74 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.217 -0.447 . . . . 61.509999999999998 110.952 179.903 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -70.37 -46.28 64.4 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.151 -0.477 . . . . 63.049999999999997 110.896 179.835 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 127' ' ' GLU . . . . . 0.571 ' CD ' ' N ' ' A' ' 128' ' ' PHE . 3.1 pp20? -59.15 -50.82 72.56 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.153 -0.476 . . . . 63.439999999999998 110.859 -179.91 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 128' ' ' PHE . . . . . 0.601 ' CE2' ' OE1' ' A' ' 93' ' ' GLN . 0.0 OUTLIER -59.41 -37.3 77.7 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.145 -0.479 . . . . 75.120000000000005 110.873 -179.881 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 129' ' ' GLN . . . . . 0.417 ' CG ' HG22 ' A' ' 60' ' ' VAL . 1.1 tm0? -72.97 -18.54 61.36 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.122 -0.49 . . . . 73.209999999999994 110.885 -179.957 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 130' ' ' ASN . . . . . . . . . . . . . 44.8 t30 -58.05 -70.76 0.13 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.234 -0.439 . . . . 63.229999999999997 110.868 -179.889 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 131' ' ' VAL . . . . . 0.418 ' O ' ' C ' ' A' ' 132' ' ' VAL . 40.1 t -136.96 -32.76 0.36 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.177 -0.465 . . . . 72.150000000000006 111.148 179.878 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 132' ' ' VAL . . . . . 0.477 ' CG2' ' HA ' ' A' ' 128' ' ' PHE . 26.7 t -35.76 153.7 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 116.167 -0.469 . . . . 73.209999999999994 111.135 179.914 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 133' ' ' ASN . . . . . 0.453 ' C ' ' O ' ' A' ' 132' ' ' VAL . 0.8 OUTLIER -32.76 97.09 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.183 -0.462 . . . . 73.430000000000007 110.922 179.993 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 134' ' ' THR . . . . . 0.606 HG22 ' H ' ' A' ' 135' ' ' GLN . 0.2 OUTLIER -98.8 -166.09 1.32 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.183 -0.462 . . . . 72.5 111.141 -179.975 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 135' ' ' GLN . . . . . 0.606 ' H ' HG22 ' A' ' 134' ' ' THR . 5.6 tp60 -157.72 130.54 7.45 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.205 -0.452 . . . . 73.030000000000001 110.951 179.988 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 136' ' ' SER . . . . . 0.419 ' O ' ' C ' ' A' ' 137' ' ' LEU . 20.1 m -85.93 51.72 2.28 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.242 -0.435 . . . . 33.43 110.866 -179.792 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 137' ' ' LEU . . . . . 0.419 ' C ' ' O ' ' A' ' 136' ' ' SER . 0.4 OUTLIER 36.23 79.66 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.177 -0.465 . . . . 73.040000000000006 110.928 -179.954 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 14.9 pt-20 . . . . . 0 C--N 1.329 -0.293 0 CA-C-N 116.22 -0.446 . . . . 61.020000000000003 110.917 179.934 . . . . . . . . 0 0 . 1 stop_ save_