data_1kj5_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 1kj5 _Structure_validation_residue.Date_analyzed 2016-10-06 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 nuclear orig core ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 6.7 t-80 . . . . . 0 CA--C 1.528 0.11 0 CA-C-O 120.807 0.337 . . . . 0.0 111.089 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 5.2 t80 -63.48 158.66 20.33 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.501 179.573 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -66.57 86.08 0.11 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.079 0.466 . . . . 0.0 110.547 179.813 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -106.86 -74.32 0.66 Allowed 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.616 -0.72 . . . . 0.0 110.867 -179.709 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 6' ' ' VAL . . . . . 0.453 ' HA ' ' H ' ' A' ' 10' ' ' GLY . 12.7 p -53.64 -25.22 11.03 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.228 0 CA-C-N 115.987 -0.551 . . . . 0.0 111.157 179.914 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -45.37 -53.37 8.69 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.835 -0.62 . . . . 0.0 111.34 179.992 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 58.6 m -95.68 -31.24 13.34 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.984 -179.925 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 147.26 54.63 0.02 OUTLIER Glycine 0 N--CA 1.452 -0.276 0 C-N-CA 120.865 -0.683 . . . . 0.0 112.404 179.989 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . 0.453 ' H ' ' HA ' ' A' ' 6' ' ' VAL . . . -123.89 174.32 16.77 Favored Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.714 -0.755 . . . . 0.0 112.632 -179.919 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 7.3 tt0 -150.02 156.39 41.6 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.87 0.367 . . . . 0.0 110.918 -179.946 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 12' ' ' CYS . . . . . 0.402 ' HB3' ' HB2' ' A' ' 27' ' ' CYS . 0.8 OUTLIER -98.02 131.06 44.77 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.041 -0.527 . . . . 0.0 111.031 -179.937 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -134.85 134.75 41.09 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.871 179.982 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 40.3 m-85 -59.15 -28.66 66.79 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.119 -179.973 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 47.1 m -107.25 169.45 8.56 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.152 -179.804 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -52.64 154.28 2.74 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 115.984 -0.553 . . . . 0.0 111.464 -179.986 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . 0.627 ' SG ' ' HE3' ' A' ' 33' ' ' LYS . 85.3 m -45.33 134.04 5.73 Favored Pre-proline 0 C--N 1.328 -0.347 0 CA-C-N 115.437 -0.802 . . . . 0.0 111.633 -179.748 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . 0.526 ' HG2' ' H ' ' A' ' 19' ' ' ILE . 69.7 Cg_endo -77.06 -78.94 0.01 OUTLIER 'Trans proline' 0 C--N 1.347 0.464 0 C-N-CA 122.501 2.134 . . . . 0.0 111.81 179.444 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' ILE . . . . . 0.526 ' H ' ' HG2' ' A' ' 18' ' ' PRO . 2.0 tt -56.63 -172.1 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.534 0.334 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.126 179.351 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' PHE . . . . . 0.402 ' H ' ' CG1' ' A' ' 19' ' ' ILE . 0.3 OUTLIER -77.94 41.41 0.35 Allowed 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.728 0.299 . . . . 0.0 111.471 -179.926 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' THR . . . . . 0.617 ' HB ' ' SG ' ' A' ' 35' ' ' CYS . 0.4 OUTLIER -89.97 -165.81 1.44 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.471 -0.331 . . . . 0.0 110.905 179.799 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . 0.524 ' O ' ' HG2' ' A' ' 22' ' ' LYS . 0.0 OUTLIER -150.13 128.54 12.17 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-O 120.985 0.421 . . . . 0.0 110.719 179.504 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' ILE . . . . . 0.549 HG13 ' HB2' ' A' ' 33' ' ' LYS . 0.1 OUTLIER -78.06 124.45 36.46 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.908 -179.447 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' GLN . . . . . 0.57 ' HB2' ' HE2' ' A' ' 36' ' ' LYS . 3.1 mt-30 -93.8 -57.68 2.48 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.91 179.989 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -136.1 -148.62 5.59 Favored Glycine 0 N--CA 1.452 -0.287 0 C-N-CA 120.919 -0.658 . . . . 0.0 112.486 -179.984 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -118.96 147.25 44.26 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.962 0.41 . . . . 0.0 111.241 -179.997 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' CYS . . . . . 0.418 ' HB3' ' H ' ' A' ' 28' ' ' TYR . 9.5 t -83.87 -95.39 0.06 Allowed 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.746 -0.661 . . . . 0.0 110.953 -179.768 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' TYR . . . . . 0.418 ' H ' ' HB3' ' A' ' 27' ' ' CYS . 14.9 m-85 -61.51 -156.61 0.01 OUTLIER 'General case' 0 CA--C 1.53 0.176 0 CA-C-O 120.985 0.422 . . . . 0.0 111.474 179.984 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 1.9 mtp180 -50.06 -35.36 24.84 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-N 116.053 -0.521 . . . . 0.0 111.109 179.983 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 155.64 17.39 0.04 OUTLIER Glycine 0 N--CA 1.452 -0.289 0 C-N-CA 120.727 -0.749 . . . . 0.0 112.5 179.925 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 18.6 tttt -89.67 -24.21 21.66 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.91 0.386 . . . . 0.0 110.531 179.83 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -130.27 144.92 51.66 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.96 -0.564 . . . . 0.0 111.009 179.897 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . 0.627 ' HE3' ' SG ' ' A' ' 17' ' ' CYS . 0.0 OUTLIER -102.24 139.66 37.55 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.787 -179.992 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -81.72 125.51 30.7 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.657 179.861 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 35' ' ' CYS . . . . . 0.617 ' SG ' ' HB ' ' A' ' 21' ' ' THR . 4.6 t -127.49 151.53 48.74 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.355 -179.684 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . 0.57 ' HE2' ' HB2' ' A' ' 24' ' ' GLN . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.071 0 CA-C-O 118.253 -0.879 . . . . 0.0 110.799 179.953 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 6.5 t-80 . . . . . 0 C--O 1.231 0.128 0 CA-C-O 120.802 0.334 . . . . 0.0 110.853 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 9.0 t80 -54.96 162.14 1.39 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.731 179.732 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 1.2 m120 -72.42 80.49 1.04 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.206 0.527 . . . . 0.0 110.543 179.836 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 3.0 m -98.3 -70.0 0.74 Allowed 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.398 -0.819 . . . . 0.0 110.525 -179.916 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 2.0 p -54.85 -13.52 0.83 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-N 116.081 -0.509 . . . . 0.0 111.153 179.176 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 1.2 t -41.88 -51.7 4.24 Favored 'General case' 0 N--CA 1.462 0.153 0 CA-C-N 115.865 -0.607 . . . . 0.0 111.488 -179.717 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 1.3 m -105.79 -10.0 16.94 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.782 179.951 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 125.53 39.03 0.45 Allowed Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.874 -0.679 . . . . 0.0 112.399 -179.964 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -82.68 170.31 49.96 Favored Glycine 0 N--CA 1.452 -0.294 0 C-N-CA 120.806 -0.711 . . . . 0.0 112.466 -179.998 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -143.5 153.93 43.12 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.817 0.342 . . . . 0.0 110.959 179.968 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 1.9 m -110.13 137.08 48.37 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.947 -179.991 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -136.96 152.13 49.81 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.88 179.996 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 62.9 m-85 -75.6 -14.32 60.37 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.226 -179.797 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 1.9 p -120.61 169.94 9.89 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.977 -179.893 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -51.63 145.55 8.97 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.105 179.948 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER -45.49 142.04 3.49 Favored Pre-proline 0 C--N 1.329 -0.305 0 CA-C-N 115.752 -0.658 . . . . 0.0 111.674 -179.621 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 55.4 Cg_endo -91.01 -75.39 0.0 OUTLIER 'Trans proline' 0 N--CA 1.456 -0.734 0 C-N-CA 123.115 2.543 . . . . 0.0 113.023 -179.686 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 2.4 tt -56.02 -176.47 0.02 OUTLIER 'Isoleucine or valine' 0 CA--C 1.535 0.382 0 CA-C-O 120.848 0.356 . . . . 0.0 111.903 -179.496 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 4.0 p90 -74.88 32.15 0.09 Allowed 'General case' 0 CA--C 1.532 0.259 0 N-CA-C 112.616 0.599 . . . . 0.0 112.616 -178.85 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -78.86 -152.82 0.06 Allowed 'General case' 0 C--N 1.331 -0.227 0 C-N-CA 121.136 -0.226 . . . . 0.0 110.46 179.273 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 17.0 tttp -165.17 94.07 0.63 Allowed 'General case' 0 C--N 1.333 -0.126 0 C-N-CA 120.711 -0.395 . . . . 0.0 111.661 -179.919 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' ILE . . . . . 0.518 ' HB ' ' CE ' ' A' ' 33' ' ' LYS . 0.2 OUTLIER -49.14 131.83 7.1 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.576 179.252 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' GLN . . . . . 0.445 ' NE2' ' NZ ' ' A' ' 36' ' ' LYS . 0.0 OUTLIER -120.54 0.77 10.55 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.467 -0.333 . . . . 0.0 111.715 -179.426 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 176.44 -145.67 7.59 Favored Glycine 0 N--CA 1.451 -0.343 0 C-N-CA 120.428 -0.891 . . . . 0.0 112.889 180.0 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' THR . . . . . 0.497 ' HA ' ' HA ' ' A' ' 33' ' ' LYS . 1.2 p -127.01 149.45 49.89 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.06 0.457 . . . . 0.0 111.303 -179.749 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' CYS . . . . . 0.403 ' HB3' ' H ' ' A' ' 28' ' ' TYR . 8.5 t -89.64 -85.48 0.21 Allowed 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.672 -0.694 . . . . 0.0 111.146 -179.737 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' TYR . . . . . 0.403 ' H ' ' HB3' ' A' ' 27' ' ' CYS . 8.5 m-85 -61.37 -158.23 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.564 -179.641 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 81.8 mtt180 -48.56 -38.39 20.41 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-N 116.018 -0.537 . . . . 0.0 111.349 -179.73 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 157.54 17.5 0.04 OUTLIER Glycine 0 N--CA 1.452 -0.283 0 C-N-CA 120.725 -0.75 . . . . 0.0 112.674 179.919 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 3.0 mttt -95.62 -28.2 14.95 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.872 0.368 . . . . 0.0 110.814 179.874 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -118.13 149.66 40.67 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.121 -0.49 . . . . 0.0 111.044 -179.979 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . 0.557 ' HZ3' ' HB2' ' A' ' 35' ' ' CYS . 0.0 OUTLIER -97.44 145.52 26.11 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.892 -0.594 . . . . 0.0 110.883 -179.992 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -97.65 119.88 37.02 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.944 179.9 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 35' ' ' CYS . . . . . 0.557 ' HB2' ' HZ3' ' A' ' 33' ' ' LYS . 0.0 OUTLIER -114.55 160.94 18.69 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.728 -0.669 . . . . 0.0 111.261 -179.615 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . 0.458 ' NZ ' ' N ' ' A' ' 36' ' ' LYS . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.051 0 CA-C-O 118.271 -0.871 . . . . 0.0 111.001 -179.996 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.231 0.114 0 CA-C-O 120.886 0.374 . . . . 0.0 110.568 . . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 3' ' ' TYR . . . . . 0.427 ' HB3' ' SG ' ' A' ' 34' ' ' CYS . 1.4 t80 -56.52 145.44 28.01 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.882 -179.794 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 4.1 m120 -66.11 84.36 0.09 Allowed 'General case' 0 N--CA 1.45 -0.457 0 CA-C-O 121.135 0.493 . . . . 0.0 110.905 -179.995 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -102.26 -69.21 0.79 Allowed 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.579 -0.737 . . . . 0.0 110.776 -179.838 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 10.3 p -53.73 -21.27 4.68 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 115.777 -0.647 . . . . 0.0 111.282 179.893 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 22.5 p -45.32 -37.58 4.97 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-N 115.928 -0.578 . . . . 0.0 111.255 -179.939 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 2.8 m -112.03 -20.55 11.92 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.9 -179.949 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 118.01 49.15 0.38 Allowed Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.838 -0.696 . . . . 0.0 112.512 179.998 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -101.99 -173.24 27.71 Favored Glycine 0 N--CA 1.451 -0.301 0 C-N-CA 120.679 -0.772 . . . . 0.0 112.497 -179.999 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -149.46 137.52 20.52 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.694 0.283 . . . . 0.0 110.567 179.885 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' CYS . . . . . 0.543 ' HA ' ' O ' ' A' ' 33' ' ' LYS . 0.0 OUTLIER -89.58 110.68 21.52 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.001 0.429 . . . . 0.0 111.533 -179.63 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 1.6 mp -105.11 122.12 45.22 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.789 -0.641 . . . . 0.0 110.1 179.249 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' TYR . . . . . 0.785 ' HA ' ' HA ' ' A' ' 32' ' ' ALA . 31.9 m-85 -49.68 -33.32 15.4 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.07 -179.443 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 34.2 t -99.01 166.91 11.05 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.387 179.338 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -52.94 141.06 22.99 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.449 -0.341 . . . . 0.0 110.718 179.851 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . 0.513 ' SG ' ' HB ' ' A' ' 23' ' ' ILE . 39.5 m -45.5 132.01 6.22 Favored Pre-proline 0 C--N 1.33 -0.26 0 CA-C-N 116.063 -0.517 . . . . 0.0 111.914 -179.416 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . 0.456 ' HG2' ' H ' ' A' ' 19' ' ' ILE . 68.6 Cg_endo -81.49 -70.04 0.01 OUTLIER 'Trans proline' 0 N--CA 1.459 -0.503 0 C-N-CA 122.691 2.261 . . . . 0.0 112.261 179.624 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' ILE . . . . . 0.472 HG21 ' OG1' ' A' ' 21' ' ' THR . 0.3 OUTLIER -56.59 -173.24 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.534 0.334 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.639 179.759 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' PHE . . . . . 0.46 ' H ' HG13 ' A' ' 19' ' ' ILE . 27.9 p90 -74.51 25.91 0.08 Allowed 'General case' 0 C--N 1.331 -0.213 0 N-CA-C 112.073 0.397 . . . . 0.0 112.073 -179.626 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' THR . . . . . 0.562 ' HB ' ' SG ' ' A' ' 35' ' ' CYS . 0.9 OUTLIER -76.74 -163.04 0.3 Allowed 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 120.518 0.199 . . . . 0.0 110.763 179.711 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . 0.426 ' H ' ' HB ' ' A' ' 21' ' ' THR . 8.9 tttt -163.6 108.23 1.04 Allowed 'General case' 0 C--O 1.231 0.132 0 CA-C-O 120.843 0.354 . . . . 0.0 110.844 -179.97 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' ILE . . . . . 0.86 HG13 ' HB3' ' A' ' 33' ' ' LYS . 0.0 OUTLIER -68.93 139.57 20.29 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 CA-C-O 121.076 0.465 . . . . 0.0 110.755 179.891 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' GLN . . . . . 0.84 ' HB2' ' HE3' ' A' ' 36' ' ' LYS . 0.4 OUTLIER -105.19 -44.95 4.63 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.727 -0.67 . . . . 0.0 110.568 179.23 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -151.88 -149.48 5.1 Favored Glycine 0 N--CA 1.452 -0.292 0 C-N-CA 120.989 -0.624 . . . . 0.0 112.251 179.917 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -110.54 148.34 32.33 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.053 0.454 . . . . 0.0 111.277 -179.931 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' CYS . . . . . 0.449 ' HB2' ' HB3' ' A' ' 12' ' ' CYS . 0.0 OUTLIER -83.44 -91.3 0.08 Allowed 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.741 -0.663 . . . . 0.0 111.133 -179.694 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 29.4 m-85 -61.49 -156.18 0.01 OUTLIER 'General case' 0 CA--C 1.531 0.229 0 CA-C-N 116.066 -0.516 . . . . 0.0 111.764 -179.701 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -49.17 -39.55 29.69 Favored 'General case' 0 C--O 1.232 0.139 0 CA-C-N 115.917 -0.583 . . . . 0.0 111.314 -179.83 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 155.65 48.15 0.01 OUTLIER Glycine 0 N--CA 1.452 -0.257 0 C-N-CA 120.744 -0.741 . . . . 0.0 112.549 -179.975 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 5.9 mptt -120.04 -44.21 2.51 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.86 0.362 . . . . 0.0 110.881 179.999 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . 0.785 ' HA ' ' HA ' ' A' ' 14' ' ' TYR . . . -105.98 146.66 29.76 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.987 179.977 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . 0.86 ' HB3' HG13 ' A' ' 23' ' ' ILE . 2.7 mtpp -95.77 120.66 36.42 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.079 -179.932 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 34' ' ' CYS . . . . . 0.597 ' SG ' ' HE2' ' A' ' 36' ' ' LYS . 0.1 OUTLIER -69.74 111.7 5.69 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.213 179.287 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 35' ' ' CYS . . . . . 0.562 ' SG ' ' HB ' ' A' ' 21' ' ' THR . 3.3 t -116.16 146.93 41.89 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.233 -179.427 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . 0.84 ' HE3' ' HB2' ' A' ' 24' ' ' GLN . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.043 0 CA-C-O 118.23 -0.89 . . . . 0.0 110.887 179.827 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.232 0.16 0 CA-C-O 120.894 0.378 . . . . 0.0 110.902 . . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 5.2 t80 -65.55 160.17 22.98 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.594 179.852 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -68.91 85.63 0.33 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.1 0.476 . . . . 0.0 110.822 179.883 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 5' ' ' CYS . . . . . 0.665 ' HA ' ' HG2' ' A' ' 36' ' ' LYS . 0.0 OUTLIER -109.53 -79.05 0.58 Allowed 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.641 -0.709 . . . . 0.0 110.556 179.941 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 6' ' ' VAL . . . . . 0.414 HG23 ' O ' ' A' ' 6' ' ' VAL . 11.9 p -54.26 -16.82 1.56 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.188 0 CA-C-N 115.959 -0.564 . . . . 0.0 111.15 179.62 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -45.08 -53.63 7.7 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.925 -0.58 . . . . 0.0 111.342 -179.859 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 5.5 p -106.32 -5.06 19.36 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.982 179.995 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 118.37 51.14 0.32 Allowed Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.786 -0.721 . . . . 0.0 112.501 -179.964 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -96.88 -178.26 34.91 Favored Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.735 -0.745 . . . . 0.0 112.476 -179.973 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 6.1 tt0 -146.51 131.75 18.45 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.815 0.341 . . . . 0.0 110.826 179.948 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' CYS . . . . . 0.474 ' HB3' ' HB2' ' A' ' 27' ' ' CYS . 0.0 OUTLIER -102.62 131.02 49.67 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.951 -179.893 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 3.0 mt -133.03 158.15 43.46 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.006 -179.949 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 29.2 m-85 -82.41 -8.47 59.62 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.212 -179.848 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 98.7 p -117.65 169.08 9.86 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.386 -0.37 . . . . 0.0 111.085 -179.833 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -54.94 147.68 14.94 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.07 -0.513 . . . . 0.0 111.115 179.947 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . 0.425 ' HA ' ' HD3' ' A' ' 18' ' ' PRO . 0.1 OUTLIER -45.26 131.26 5.85 Favored Pre-proline 0 C--N 1.33 -0.265 0 CA-C-N 115.856 -0.611 . . . . 0.0 111.306 -179.855 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . 0.425 ' HD3' ' HA ' ' A' ' 17' ' ' CYS . 40.9 Cg_endo -90.8 -79.98 0.0 OUTLIER 'Trans proline' 0 N--CA 1.455 -0.767 0 C-N-CA 122.995 2.463 . . . . 0.0 112.64 -179.782 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' ILE . . . . . 0.564 HG21 ' OG1' ' A' ' 21' ' ' THR . 3.7 tt -56.6 -168.3 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.536 0.432 0 CA-C-N 116.376 -0.375 . . . . 0.0 111.758 -179.873 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' PHE . . . . . 0.544 ' H ' HG12 ' A' ' 19' ' ' ILE . 0.8 OUTLIER -75.69 33.97 0.12 Allowed 'General case' 0 CA--C 1.531 0.223 0 N-CA-C 112.083 0.401 . . . . 0.0 112.083 -179.492 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' THR . . . . . 0.564 ' OG1' HG21 ' A' ' 19' ' ' ILE . 0.1 OUTLIER -90.25 180.0 5.77 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.74 0.305 . . . . 0.0 110.695 179.263 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . 0.456 ' HE2' HE22 ' A' ' 24' ' ' GLN . 1.6 ptmm? -135.68 136.39 40.86 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.332 -0.394 . . . . 0.0 110.408 179.554 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' ILE . . . . . 0.472 ' HB ' ' HE3' ' A' ' 33' ' ' LYS . 0.1 OUTLIER -89.9 126.35 42.78 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.836 -179.715 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' GLN . . . . . 0.677 ' HB2' ' HE2' ' A' ' 36' ' ' LYS . 0.0 OUTLIER -104.08 -59.81 1.67 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.607 -0.724 . . . . 0.0 111.157 -179.703 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -141.45 -132.98 2.84 Favored Glycine 0 C--N 1.332 0.329 0 C-N-CA 120.673 -0.775 . . . . 0.0 112.904 -179.702 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 15.9 p -126.04 149.76 48.63 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.05 0.452 . . . . 0.0 111.234 -179.786 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' CYS . . . . . 0.474 ' HB2' ' HB3' ' A' ' 12' ' ' CYS . 0.7 OUTLIER -95.27 -78.06 0.46 Allowed 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.678 -0.692 . . . . 0.0 111.158 -179.738 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 17.6 m-85 -60.94 -164.65 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.504 -179.658 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 4.3 mtm180 -50.1 -36.97 31.76 Favored 'General case' 0 C--N 1.333 -0.143 0 CA-C-N 115.964 -0.562 . . . . 0.0 111.279 -179.936 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 153.74 43.61 0.02 OUTLIER Glycine 0 N--CA 1.452 -0.294 0 C-N-CA 120.751 -0.738 . . . . 0.0 112.556 179.949 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -122.54 -21.22 5.78 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.841 0.353 . . . . 0.0 110.947 179.967 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -127.63 143.94 51.12 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.123 -0.49 . . . . 0.0 111.036 179.992 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . 0.472 ' HE3' ' HB ' ' A' ' 23' ' ' ILE . 0.0 OUTLIER -96.1 134.66 38.89 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.877 179.998 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 34' ' ' CYS . . . . . 0.45 ' HB2' ' SG ' ' A' ' 27' ' ' CYS . 0.0 OUTLIER -79.16 141.49 37.18 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.139 -179.739 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 35' ' ' CYS . . . . . 0.416 ' SG ' ' HE3' ' A' ' 33' ' ' LYS . 0.8 OUTLIER -134.79 129.95 35.37 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.905 179.946 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . 0.677 ' HE2' ' HB2' ' A' ' 24' ' ' GLN . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.079 0 CA-C-O 118.256 -0.878 . . . . 0.0 110.874 179.942 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 2' ' ' HIS . . . . . 0.46 ' HE2' HG21 ' A' ' 6' ' ' VAL . 1.9 t-80 . . . . . 0 C--O 1.232 0.142 0 CA-C-O 120.845 0.355 . . . . 0.0 110.602 . . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 4.4 t80 -62.75 166.72 5.19 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.744 179.995 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 4' ' ' ASN . . . . . 0.439 ' ND2' ' HB2' ' A' ' 7' ' ' SER . 26.0 t-20 -81.89 78.49 8.6 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 121.409 0.623 . . . . 0.0 110.765 179.862 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 0.3 OUTLIER -106.23 -56.51 2.18 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.168 -0.924 . . . . 0.0 110.241 179.897 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 6' ' ' VAL . . . . . 0.46 HG21 ' HE2' ' A' ' 2' ' ' HIS . 60.9 t -54.99 -12.89 0.74 Allowed 'Isoleucine or valine' 0 CA--C 1.53 0.208 0 CA-C-N 115.754 -0.657 . . . . 0.0 111.105 179.168 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 7' ' ' SER . . . . . 0.439 ' HB2' ' ND2' ' A' ' 4' ' ' ASN . 6.2 t -34.38 -50.22 0.41 Allowed 'General case' 0 N--CA 1.464 0.266 0 CA-C-N 115.821 -0.627 . . . . 0.0 111.833 -179.831 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 28.2 t -107.75 -19.74 13.44 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.863 -179.96 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 136.39 34.85 0.22 Allowed Glycine 0 N--CA 1.45 -0.37 0 C-N-CA 120.828 -0.701 . . . . 0.0 112.321 -179.93 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -65.89 176.75 15.67 Favored Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.796 -0.716 . . . . 0.0 112.477 -179.995 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -144.84 142.51 29.99 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.84 0.352 . . . . 0.0 110.965 -179.967 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 3.2 m -106.18 125.24 50.76 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.079 -0.509 . . . . 0.0 110.704 179.876 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . 0.481 ' O ' ' HG3' ' A' ' 33' ' ' LYS . 3.6 mp -135.14 151.84 51.06 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.275 -0.421 . . . . 0.0 111.046 -179.842 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 11.8 m-85 -77.74 -3.96 43.89 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.881 179.942 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 15.7 t -122.3 173.85 7.36 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.007 -179.997 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -54.78 144.18 23.18 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.279 -179.987 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . 0.514 ' SG ' ' HE3' ' A' ' 33' ' ' LYS . 71.7 m -45.78 139.45 5.07 Favored Pre-proline 0 C--N 1.331 -0.228 0 CA-C-N 115.824 -0.626 . . . . 0.0 111.551 -179.792 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . 0.478 ' HG2' ' H ' ' A' ' 19' ' ' ILE . 68.1 Cg_endo -76.43 -83.3 0.0 OUTLIER 'Trans proline' 0 C--N 1.347 0.452 0 C-N-CA 122.498 2.132 . . . . 0.0 112.289 179.853 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' ILE . . . . . 0.591 HG13 ' H ' ' A' ' 20' ' ' PHE . 0.8 OUTLIER -56.53 -171.18 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.535 0.391 0 CA-C-O 120.859 0.362 . . . . 0.0 111.619 179.884 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' PHE . . . . . 0.591 ' H ' HG13 ' A' ' 19' ' ' ILE . 3.8 p90 -69.96 15.48 0.08 Allowed 'General case' 0 CA--C 1.533 0.291 0 N-CA-C 111.982 0.364 . . . . 0.0 111.982 -179.664 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' THR . . . . . 0.63 ' HB ' ' SG ' ' A' ' 35' ' ' CYS . 0.6 OUTLIER -63.15 -172.71 0.05 OUTLIER 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 120.851 0.358 . . . . 0.0 111.268 179.809 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -151.54 118.07 5.7 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.066 179.945 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' ILE . . . . . 0.496 ' H ' HG21 ' A' ' 23' ' ' ILE . 0.2 OUTLIER -64.76 120.67 12.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.735 179.99 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' GLN . . . . . 0.554 ' HB2' ' NZ ' ' A' ' 36' ' ' LYS . 0.0 OUTLIER -88.39 -28.84 20.69 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.552 179.922 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -177.47 -130.28 1.36 Allowed Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 121.026 -0.607 . . . . 0.0 112.219 179.998 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' THR . . . . . 0.616 ' HA ' ' HA ' ' A' ' 33' ' ' LYS . 0.6 OUTLIER -116.79 145.74 43.32 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.9 0.381 . . . . 0.0 111.037 179.831 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 25.5 t -94.37 -78.47 0.44 Allowed 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.839 -179.87 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' TYR . . . . . 0.5 ' HB3' ' NZ ' ' A' ' 31' ' ' LYS . 22.7 m-85 -60.12 -176.92 0.05 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.842 -0.617 . . . . 0.0 111.039 -179.979 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . 0.404 HH11 ' HD3' ' A' ' 29' ' ' ARG . 7.0 mmt-85 -50.31 -24.41 2.93 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.218 -179.988 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 153.65 32.75 0.03 OUTLIER Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.885 -0.674 . . . . 0.0 112.342 179.873 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . 0.5 ' NZ ' ' HB3' ' A' ' 28' ' ' TYR . 2.0 mttp -111.17 -35.76 5.8 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.759 0.314 . . . . 0.0 110.927 -179.968 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . 0.466 ' HB2' ' CD2' ' A' ' 28' ' ' TYR . . . -128.86 153.79 47.11 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.299 -0.41 . . . . 0.0 110.995 -179.983 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . 0.616 ' HA ' ' HA ' ' A' ' 26' ' ' THR . 0.0 OUTLIER -92.81 144.94 24.79 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.938 -179.869 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -88.36 128.18 35.5 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.456 179.86 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 35' ' ' CYS . . . . . 0.63 ' SG ' ' HB ' ' A' ' 21' ' ' THR . 2.5 t -130.06 150.17 51.45 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.195 -179.54 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . 0.554 ' NZ ' ' HB2' ' A' ' 24' ' ' GLN . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.044 0 CA-C-O 118.284 -0.865 . . . . 0.0 110.959 179.999 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 6.8 t-80 . . . . . 0 C--O 1.232 0.146 0 CA-C-O 120.874 0.369 . . . . 0.0 110.71 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 7.8 t80 -60.57 164.48 4.5 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.714 179.78 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 1.1 t30 -71.18 85.32 0.75 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.075 0.464 . . . . 0.0 110.51 179.683 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 5' ' ' CYS . . . . . 0.558 ' HA ' ' HG2' ' A' ' 36' ' ' LYS . 0.1 OUTLIER -102.54 -72.43 0.69 Allowed 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.686 -0.688 . . . . 0.0 110.668 -179.865 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 13.9 p -53.9 -19.74 3.32 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-N 115.973 -0.558 . . . . 0.0 111.132 179.723 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 3.3 p -45.13 -44.28 10.48 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 115.938 -0.574 . . . . 0.0 111.402 -179.972 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 3.1 p -113.89 1.06 14.63 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.974 -179.948 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 103.94 44.6 1.61 Allowed Glycine 0 N--CA 1.451 -0.334 0 C-N-CA 120.736 -0.745 . . . . 0.0 112.181 -179.846 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -85.99 -176.18 49.99 Favored Glycine 0 N--CA 1.45 -0.394 0 C-N-CA 120.795 -0.717 . . . . 0.0 112.499 -179.881 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 5.0 mp0 -147.91 150.13 33.51 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.753 0.311 . . . . 0.0 110.797 179.985 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -108.18 129.56 55.18 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.911 179.969 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . 0.561 ' HB2' ' NZ ' ' A' ' 33' ' ' LYS . 3.9 mm? -121.15 157.26 30.56 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.959 -179.847 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 60.0 m-85 -82.9 -18.91 38.51 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.78 179.852 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -126.88 -175.58 3.46 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.864 -179.946 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -51.06 140.16 16.4 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.064 -0.516 . . . . 0.0 111.14 179.915 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . 0.606 ' SG ' ' HE3' ' A' ' 33' ' ' LYS . 82.9 m -45.52 137.89 5.25 Favored Pre-proline 0 C--N 1.331 -0.21 0 CA-C-N 116.081 -0.509 . . . . 0.0 111.555 -179.782 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . 0.429 ' HD3' ' HA ' ' A' ' 17' ' ' CYS . 50.7 Cg_endo -89.75 -73.34 0.0 OUTLIER 'Trans proline' 0 N--CA 1.454 -0.796 0 C-N-CA 122.957 2.438 . . . . 0.0 112.231 179.802 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' ILE . . . . . 0.596 HG13 ' H ' ' A' ' 20' ' ' PHE . 0.7 OUTLIER -56.47 -173.45 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.534 0.338 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.456 179.738 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' PHE . . . . . 0.596 ' H ' HG13 ' A' ' 19' ' ' ILE . 2.1 p90 -78.1 40.03 0.32 Allowed 'General case' 0 C--N 1.332 -0.196 0 CA-C-N 116.563 -0.29 . . . . 0.0 111.594 -179.753 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' THR . . . . . 0.581 ' HB ' ' SG ' ' A' ' 35' ' ' CYS . 0.7 OUTLIER -89.48 -161.01 0.73 Allowed 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.567 -0.288 . . . . 0.0 110.631 179.448 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . 0.469 ' H ' ' HB ' ' A' ' 21' ' ' THR . 15.8 tttt -159.07 108.91 1.95 Allowed 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 120.721 0.296 . . . . 0.0 111.399 -179.953 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' ILE . . . . . 0.627 ' HB ' ' HE3' ' A' ' 33' ' ' LYS . 0.2 OUTLIER -60.39 126.61 18.51 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.226 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.735 179.592 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' GLN . . . . . 0.526 ' HB2' ' HE2' ' A' ' 36' ' ' LYS . 0.1 OUTLIER -111.66 -56.49 2.38 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.042 -0.527 . . . . 0.0 110.882 179.894 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -140.75 -160.96 8.5 Favored Glycine 0 N--CA 1.452 -0.29 0 C-N-CA 120.814 -0.708 . . . . 0.0 112.337 179.857 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -92.65 147.9 22.5 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.985 0.421 . . . . 0.0 111.231 179.917 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' CYS . . . . . 0.477 ' HB3' ' H ' ' A' ' 28' ' ' TYR . 0.1 OUTLIER -93.18 -92.71 0.16 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.951 -0.568 . . . . 0.0 111.002 -179.898 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' TYR . . . . . 0.477 ' H ' ' HB3' ' A' ' 27' ' ' CYS . 15.4 m-85 -61.24 -160.49 0.01 OUTLIER 'General case' 0 CA--C 1.53 0.209 0 CA-C-O 120.985 0.422 . . . . 0.0 111.46 -179.878 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 14.6 ttm-85 -50.08 -36.4 29.24 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 116.012 -0.54 . . . . 0.0 111.298 -179.905 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 154.44 34.08 0.03 OUTLIER Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.634 -0.793 . . . . 0.0 112.592 -179.974 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 31.8 mmtt -110.82 -20.58 12.42 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.924 0.392 . . . . 0.0 110.822 179.944 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -136.55 145.18 44.73 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.862 179.975 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . 0.627 ' HE3' ' HB ' ' A' ' 23' ' ' ILE . 0.1 OUTLIER -93.29 130.25 39.09 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.284 -0.416 . . . . 0.0 111.006 -179.799 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -69.27 127.67 33.89 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.547 179.679 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 35' ' ' CYS . . . . . 0.581 ' SG ' ' HB ' ' A' ' 21' ' ' THR . 6.8 t -131.44 132.78 44.58 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.169 -179.649 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . 0.558 ' HG2' ' HA ' ' A' ' 5' ' ' CYS . 0.0 OUTLIER . . . . . 0 C--O 1.25 1.083 0 CA-C-O 118.23 -0.891 . . . . 0.0 110.94 179.951 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 9.7 t-80 . . . . . 0 C--O 1.232 0.159 0 CA-C-O 120.873 0.368 . . . . 0.0 111.104 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 5.6 t80 -65.09 169.47 5.41 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.824 179.76 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 4' ' ' ASN . . . . . 0.4 HD21 ' HG ' ' A' ' 7' ' ' SER . 1.1 m120 -74.88 81.33 2.14 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 121.181 0.515 . . . . 0.0 110.532 179.71 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 1.2 m -111.64 -64.14 1.33 Allowed 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.482 -0.781 . . . . 0.0 111.086 -179.527 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 9.4 p -54.25 -15.0 0.98 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.215 0 CA-C-N 115.942 -0.572 . . . . 0.0 111.324 179.833 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 7' ' ' SER . . . . . 0.4 ' HG ' HD21 ' A' ' 4' ' ' ASN . 0.2 OUTLIER -44.96 -53.31 7.81 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.914 -0.585 . . . . 0.0 111.592 -179.785 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -96.5 -22.26 17.21 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.395 -0.366 . . . . 0.0 111.072 -179.791 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 133.77 45.6 0.11 Allowed Glycine 0 N--CA 1.452 -0.275 0 C-N-CA 120.887 -0.673 . . . . 0.0 112.257 -179.957 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -99.71 174.27 26.66 Favored Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.784 -0.722 . . . . 0.0 112.731 -179.738 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 3.0 tp60 -149.29 154.43 39.01 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.778 0.323 . . . . 0.0 110.702 179.922 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' CYS . . . . . 0.456 ' HB3' ' HB2' ' A' ' 27' ' ' CYS . 0.0 OUTLIER -105.12 133.7 49.46 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.853 179.968 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 3.4 mp -135.5 157.35 47.11 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.198 -0.456 . . . . 0.0 111.155 -179.672 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 22.9 m-85 -74.6 -10.9 59.99 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.882 179.874 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -124.7 -179.7 4.62 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.687 179.992 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -54.75 144.36 22.52 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.165 179.88 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 8.1 m -45.63 142.99 3.21 Favored Pre-proline 0 C--N 1.331 -0.202 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.34 -179.876 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . 0.482 ' HG2' ' H ' ' A' ' 19' ' ' ILE . 74.4 Cg_endo -79.05 -80.7 0.0 OUTLIER 'Trans proline' 0 C--N 1.345 0.386 0 C-N-CA 122.541 2.161 . . . . 0.0 112.384 179.997 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' ILE . . . . . 0.482 ' H ' ' HG2' ' A' ' 18' ' ' PRO . 0.9 OUTLIER -56.56 -170.34 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.535 0.402 0 CA-C-N 116.493 -0.321 . . . . 0.0 111.576 179.779 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' PHE . . . . . 0.445 ' N ' HG23 ' A' ' 19' ' ' ILE . 1.3 p90 -76.0 35.56 0.13 Allowed 'General case' 0 N--CA 1.463 0.183 0 CA-C-O 120.711 0.291 . . . . 0.0 111.417 179.987 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' THR . . . . . 0.44 HG23 ' HA ' ' A' ' 36' ' ' LYS . 0.7 OUTLIER -82.09 -165.96 1.13 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.512 -0.313 . . . . 0.0 110.87 179.77 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . 0.759 ' HG3' HE22 ' A' ' 24' ' ' GLN . 0.0 OUTLIER -151.23 130.33 12.65 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.895 0.379 . . . . 0.0 110.479 179.636 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' ILE . . . . . 0.689 HG13 ' HE3' ' A' ' 33' ' ' LYS . 0.0 OUTLIER -81.27 133.12 29.97 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-N 116.158 -0.474 . . . . 0.0 111.206 -179.514 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' GLN . . . . . 0.759 HE22 ' HG3' ' A' ' 22' ' ' LYS . 0.0 OUTLIER -107.75 -66.98 0.99 Allowed 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.581 -0.736 . . . . 0.0 111.088 -179.84 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -132.04 -130.04 3.09 Favored Glycine 0 N--CA 1.452 -0.289 0 C-N-CA 120.769 -0.729 . . . . 0.0 112.56 -179.927 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' THR . . . . . 0.577 ' HA ' ' HA ' ' A' ' 33' ' ' LYS . 44.4 p -125.11 153.67 42.61 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.054 0.455 . . . . 0.0 111.502 -179.807 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' CYS . . . . . 0.456 ' HB2' ' HB3' ' A' ' 12' ' ' CYS . 0.1 OUTLIER -100.56 -84.52 0.43 Allowed 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.558 -0.747 . . . . 0.0 111.299 -179.684 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 22.6 m-85 -61.12 -160.52 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.726 -0.67 . . . . 0.0 111.861 -179.447 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 10.7 ttt85 -49.72 -34.55 19.17 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 115.786 -0.643 . . . . 0.0 111.096 -179.918 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 149.6 22.07 0.07 OUTLIER Glycine 0 N--CA 1.451 -0.357 0 C-N-CA 120.646 -0.787 . . . . 0.0 112.738 179.81 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -98.93 -10.89 22.18 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.755 0.312 . . . . 0.0 110.968 179.881 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -144.51 146.83 32.61 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.288 -0.415 . . . . 0.0 111.156 179.987 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . 0.689 ' HE3' HG13 ' A' ' 23' ' ' ILE . 0.0 OUTLIER -99.86 141.52 32.57 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.789 179.914 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -74.72 144.04 43.87 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.028 -0.533 . . . . 0.0 111.718 -179.404 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 35' ' ' CYS . . . . . 0.469 ' SG ' ' HE2' ' A' ' 33' ' ' LYS . 84.7 m -134.98 143.89 47.09 Favored 'General case' 0 C--N 1.332 -0.154 0 CA-C-N 115.806 -0.634 . . . . 0.0 110.55 179.59 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . 0.643 ' HE2' HE21 ' A' ' 24' ' ' GLN . 0.0 OUTLIER . . . . . 0 C--O 1.248 1.017 0 CA-C-O 118.252 -0.88 . . . . 0.0 111.081 179.962 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 11.5 t-160 . . . . . 0 C--O 1.232 0.162 0 CA-C-O 120.772 0.32 . . . . 0.0 110.943 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 9.7 t80 -57.51 172.66 0.33 Allowed 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.047 179.946 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 5.1 m120 -77.3 76.91 3.84 Favored 'General case' 0 N--CA 1.448 -0.541 0 CA-C-O 121.248 0.547 . . . . 0.0 110.577 179.778 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -110.08 -64.69 1.23 Allowed 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.384 -0.825 . . . . 0.0 110.392 179.788 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -54.59 -16.84 1.73 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.177 0 CA-C-N 115.915 -0.584 . . . . 0.0 111.1 179.47 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 40.0 t -45.5 -40.46 8.5 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 115.846 -0.615 . . . . 0.0 111.212 -179.984 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -115.16 -0.77 13.17 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.777 179.957 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 113.07 34.7 1.77 Allowed Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 120.798 -0.715 . . . . 0.0 112.551 179.877 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -86.22 170.85 43.51 Favored Glycine 0 N--CA 1.451 -0.359 0 C-N-CA 120.809 -0.71 . . . . 0.0 112.559 -179.946 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -150.12 156.48 41.72 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.823 0.344 . . . . 0.0 110.854 179.977 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 0.2 OUTLIER -75.77 117.02 17.08 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.232 -179.88 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . 0.54 ' HG ' ' HD3' ' A' ' 18' ' ' PRO . 1.5 mm? -102.92 105.9 16.35 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.231 179.238 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 7.3 m-85 -50.82 -20.56 1.33 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.361 -179.714 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -125.55 176.11 7.08 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.805 179.827 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -52.52 146.29 10.13 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.108 -0.496 . . . . 0.0 111.047 179.912 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -45.2 122.07 5.02 Favored Pre-proline 0 C--N 1.33 -0.239 0 CA-C-N 115.939 -0.573 . . . . 0.0 111.255 -179.765 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . 0.54 ' HD3' ' HG ' ' A' ' 13' ' ' LEU . 58.2 Cg_endo -88.43 -72.5 0.0 OUTLIER 'Trans proline' 0 N--CA 1.456 -0.732 0 C-N-CA 122.788 2.326 . . . . 0.0 112.524 -179.829 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' ILE . . . . . 0.667 HG12 ' H ' ' A' ' 20' ' ' PHE . 9.0 tt -55.92 -176.01 0.02 OUTLIER 'Isoleucine or valine' 0 CA--C 1.533 0.306 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.457 179.967 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' PHE . . . . . 0.667 ' H ' HG12 ' A' ' 19' ' ' ILE . 0.6 OUTLIER -76.62 32.17 0.13 Allowed 'General case' 0 C--N 1.33 -0.249 0 N-CA-C 112.032 0.382 . . . . 0.0 112.032 -179.391 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' THR . . . . . 0.507 ' HB ' ' H ' ' A' ' 22' ' ' LYS . 0.9 OUTLIER -83.37 -154.3 0.15 Allowed 'General case' 0 C--N 1.332 -0.161 0 CA-C-O 120.575 0.226 . . . . 0.0 110.693 179.322 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . 0.507 ' H ' ' HB ' ' A' ' 21' ' ' THR . 0.1 OUTLIER -158.01 105.58 1.96 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.546 -0.297 . . . . 0.0 110.675 179.694 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' ILE . . . . . 0.559 ' HB ' ' SG ' ' A' ' 35' ' ' CYS . 0.0 OUTLIER -64.75 137.78 24.33 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.238 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.737 -179.999 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -112.77 -69.84 0.84 Allowed 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.72 179.822 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -127.68 -143.58 5.74 Favored Glycine 0 N--CA 1.45 -0.426 0 C-N-CA 120.92 -0.657 . . . . 0.0 112.487 179.986 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -115.77 143.65 45.09 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.042 0.449 . . . . 0.0 111.429 -179.845 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' CYS . . . . . 0.48 ' HB3' ' H ' ' A' ' 28' ' ' TYR . 2.1 t -81.89 -88.39 0.08 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.805 -0.634 . . . . 0.0 110.629 179.835 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' TYR . . . . . 0.48 ' H ' ' HB3' ' A' ' 27' ' ' CYS . 15.7 m-85 -62.12 -153.41 0.01 OUTLIER 'General case' 0 CA--C 1.532 0.262 0 CA-C-N 116.076 -0.511 . . . . 0.0 111.459 179.824 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -50.17 -35.86 27.95 Favored 'General case' 0 C--N 1.333 -0.119 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.577 -179.766 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 149.5 28.27 0.06 OUTLIER Glycine 0 N--CA 1.452 -0.295 0 C-N-CA 120.585 -0.817 . . . . 0.0 112.699 -179.943 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 1.6 mttp -102.12 -26.31 13.41 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.928 0.394 . . . . 0.0 110.607 179.871 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -122.75 139.74 53.65 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.922 179.943 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . 0.532 ' HE2' HD11 ' A' ' 23' ' ' ILE . 14.5 mtpt -92.59 120.86 33.44 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.363 -0.38 . . . . 0.0 110.743 179.918 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -64.13 111.71 2.68 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.01 -0.541 . . . . 0.0 111.033 -179.822 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 35' ' ' CYS . . . . . 0.559 ' SG ' ' HB ' ' A' ' 23' ' ' ILE . 1.8 m -106.69 138.44 42.86 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.821 -179.896 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.048 0 CA-C-O 118.213 -0.899 . . . . 0.0 111.055 179.72 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 C--O 1.232 0.158 0 CA-C-O 120.881 0.372 . . . . 0.0 110.794 . . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 2.4 t80 -64.93 156.44 31.11 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.591 179.894 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 6.4 p-10 -72.15 83.94 1.01 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 121.309 0.576 . . . . 0.0 111.324 -179.618 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -97.76 -65.21 0.98 Allowed 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.475 -0.784 . . . . 0.0 110.009 179.38 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 6' ' ' VAL . . . . . 0.459 HG23 ' O ' ' A' ' 6' ' ' VAL . 14.6 p -53.9 -18.4 2.23 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 115.141 -0.936 . . . . 0.0 111.389 179.676 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 6.8 t -42.19 -48.73 4.89 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 115.975 -0.557 . . . . 0.0 111.532 -179.632 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -111.84 -22.23 11.22 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.375 -0.375 . . . . 0.0 110.794 179.868 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 133.17 53.25 0.08 OUTLIER Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.934 -0.65 . . . . 0.0 112.258 -179.962 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -89.98 -178.54 44.7 Favored Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.823 -0.703 . . . . 0.0 112.69 -179.762 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -149.32 141.19 23.7 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.748 0.309 . . . . 0.0 110.649 -179.962 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -93.2 125.79 37.97 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.912 -179.936 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -123.51 155.18 38.04 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.771 179.867 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 85.8 m-85 -82.47 -31.38 29.41 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.978 -179.808 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -104.1 171.98 7.05 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.793 179.926 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -54.9 149.55 11.38 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.064 -0.517 . . . . 0.0 111.242 -179.931 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . 0.403 ' HA ' ' HD3' ' A' ' 18' ' ' PRO . 0.1 OUTLIER -45.43 123.53 5.68 Favored Pre-proline 0 C--N 1.33 -0.278 0 CA-C-N 115.692 -0.686 . . . . 0.0 111.051 179.932 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . 0.403 ' HD3' ' HA ' ' A' ' 17' ' ' CYS . 42.2 Cg_endo -90.63 -72.96 0.0 OUTLIER 'Trans proline' 0 N--CA 1.456 -0.723 0 C-N-CA 122.876 2.384 . . . . 0.0 112.864 -179.51 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' ILE . . . . . 0.671 HG13 ' H ' ' A' ' 20' ' ' PHE . 1.6 tp -56.13 -170.97 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.536 0.407 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.617 -179.728 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' PHE . . . . . 0.671 ' H ' HG13 ' A' ' 19' ' ' ILE . 4.5 p90 -71.03 23.12 0.04 OUTLIER 'General case' 0 CA--C 1.531 0.236 0 N-CA-C 112.227 0.455 . . . . 0.0 112.227 -179.347 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' THR . . . . . 0.498 ' OG1' HG22 ' A' ' 19' ' ' ILE . 0.8 OUTLIER -81.91 -165.73 1.06 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.537 0.208 . . . . 0.0 110.642 179.406 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 40.0 tttp -161.97 117.31 1.97 Allowed 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 120.876 0.369 . . . . 0.0 111.13 179.928 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' ILE . . . . . 0.425 ' HB ' ' NZ ' ' A' ' 33' ' ' LYS . 0.8 OUTLIER -67.45 135.74 27.94 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.853 179.745 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' GLN . . . . . 0.57 ' HB2' ' NZ ' ' A' ' 36' ' ' LYS . 1.7 mp0 -114.7 -42.43 3.26 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.895 -0.593 . . . . 0.0 110.826 -179.924 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -154.54 -131.32 1.49 Allowed Glycine 0 N--CA 1.451 -0.363 0 C-N-CA 120.899 -0.667 . . . . 0.0 112.371 179.922 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' THR . . . . . 0.583 ' HA ' ' HA ' ' A' ' 33' ' ' LYS . 15.6 p -122.49 141.15 51.95 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.841 0.353 . . . . 0.0 111.177 179.886 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' CYS . . . . . 0.471 ' HB3' ' H ' ' A' ' 28' ' ' TYR . 0.2 OUTLIER -82.99 -91.29 0.08 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.013 -0.54 . . . . 0.0 111.056 -179.842 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' TYR . . . . . 0.471 ' H ' ' HB3' ' A' ' 27' ' ' CYS . 23.7 m-85 -60.94 -168.02 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.166 0 CA-C-O 120.962 0.411 . . . . 0.0 111.206 -179.985 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 5.4 ttt-85 -50.39 -35.86 30.17 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 115.985 -0.552 . . . . 0.0 111.301 -179.938 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 159.66 44.39 0.02 OUTLIER Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.676 -0.773 . . . . 0.0 112.593 179.962 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 9.8 mtpt -119.73 -14.16 9.05 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.896 0.379 . . . . 0.0 110.651 179.798 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -154.35 147.27 24.48 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.668 179.858 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . 0.583 ' HA ' ' HA ' ' A' ' 26' ' ' THR . 0.0 OUTLIER -92.08 146.03 24.05 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.977 0.418 . . . . 0.0 110.937 -179.843 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 0.2 OUTLIER -77.63 135.2 38.09 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.895 -0.593 . . . . 0.0 111.091 -179.74 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 0.9 OUTLIER -136.57 128.97 30.16 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.972 179.88 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . 0.57 ' NZ ' ' HB2' ' A' ' 24' ' ' GLN . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.054 0 CA-C-O 118.245 -0.883 . . . . 0.0 110.748 179.802 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 7.2 t-80 . . . . . 0 C--O 1.231 0.117 0 CA-C-O 120.855 0.36 . . . . 0.0 110.709 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 2.4 t80 -63.81 167.29 6.18 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.619 179.834 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 1.4 t-20 -80.47 76.91 7.29 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.344 0.592 . . . . 0.0 110.265 179.567 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 5' ' ' CYS . . . . . 0.646 ' HA ' ' HD2' ' A' ' 36' ' ' LYS . 0.0 OUTLIER -101.3 -63.54 1.13 Allowed 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.085 -0.961 . . . . 0.0 110.643 -179.722 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 10.8 p -54.29 -16.91 1.6 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-N 115.827 -0.624 . . . . 0.0 111.134 179.586 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -38.03 -48.61 1.22 Allowed 'General case' 0 N--CA 1.462 0.174 0 CA-C-N 115.788 -0.642 . . . . 0.0 111.89 -179.725 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -109.28 -29.05 8.66 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.433 -0.349 . . . . 0.0 111.095 -179.916 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 142.69 45.52 0.05 OUTLIER Glycine 0 N--CA 1.452 -0.249 0 C-N-CA 120.804 -0.713 . . . . 0.0 112.428 -179.924 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -97.91 169.21 24.08 Favored Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.732 -0.747 . . . . 0.0 112.567 -179.882 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 12.7 mt-30 -143.11 148.86 37.3 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.75 0.31 . . . . 0.0 110.63 179.978 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' CYS . . . . . 0.484 ' HA ' ' O ' ' A' ' 33' ' ' LYS . 0.0 OUTLIER -103.0 125.11 49.62 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.297 -0.411 . . . . 0.0 111.222 -179.903 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -122.62 143.56 49.68 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.41 179.623 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 26.8 m-85 -60.31 -10.58 4.87 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.351 -0.386 . . . . 0.0 111.261 -179.755 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -114.07 155.69 25.5 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.788 179.613 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -54.95 157.82 3.06 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.284 179.823 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -44.91 112.08 1.42 Allowed Pre-proline 0 C--N 1.327 -0.39 0 CA-C-N 115.452 -0.794 . . . . 0.0 111.2 179.926 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 60.9 Cg_endo -87.78 -72.46 0.0 OUTLIER 'Trans proline' 0 N--CA 1.457 -0.619 0 C-N-CA 122.724 2.282 . . . . 0.0 112.664 -179.839 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' ILE . . . . . 0.549 HG12 ' H ' ' A' ' 20' ' ' PHE . 4.6 tt -56.37 -169.85 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.534 0.34 0 CA-C-N 116.321 -0.4 . . . . 0.0 111.588 -179.979 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' PHE . . . . . 0.549 ' H ' HG12 ' A' ' 19' ' ' ILE . 5.8 p90 -76.64 36.01 0.16 Allowed 'General case' 0 CA--C 1.53 0.179 0 N-CA-C 111.859 0.318 . . . . 0.0 111.859 -179.616 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' THR . . . . . 0.503 ' OG1' HG23 ' A' ' 19' ' ' ILE . 0.3 OUTLIER -88.08 -161.21 0.7 Allowed 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.662 0.268 . . . . 0.0 110.758 179.39 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . 0.456 ' H ' ' HB ' ' A' ' 21' ' ' THR . 1.4 tttm -157.58 103.1 1.91 Allowed 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.86 0.362 . . . . 0.0 111.028 -179.931 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' ILE . . . . . 0.66 HD11 ' HE2' ' A' ' 33' ' ' LYS . 1.4 tp -69.67 131.91 33.63 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.224 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.994 179.745 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' GLN . . . . . 0.497 ' HB2' ' HE3' ' A' ' 36' ' ' LYS . 18.6 mt-30 -114.29 -66.5 1.08 Allowed 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.125 179.346 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -125.52 167.07 17.99 Favored Glycine 0 N--CA 1.449 -0.478 0 CA-C-N 115.511 -0.768 . . . . 0.0 111.401 179.175 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 1.7 p -75.77 154.62 36.19 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 121.261 0.553 . . . . 0.0 111.16 -179.955 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' CYS . . . . . 0.46 ' HB2' ' HB3' ' A' ' 12' ' ' CYS . 5.4 t -84.35 -96.15 0.06 Allowed 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.317 -0.856 . . . . 0.0 111.252 -179.55 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' TYR . . . . . 0.401 ' H ' ' HB3' ' A' ' 27' ' ' CYS . 61.7 m-85 -61.65 -144.06 0.0 OUTLIER 'General case' 0 CA--C 1.534 0.349 0 CA-C-N 115.982 -0.554 . . . . 0.0 111.628 -179.796 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 7.6 mtt180 -48.16 -42.82 30.63 Favored 'General case' 0 C--O 1.232 0.133 0 CA-C-O 120.801 0.334 . . . . 0.0 111.402 -179.625 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 153.39 24.62 0.04 OUTLIER Glycine 0 N--CA 1.451 -0.363 0 C-N-CA 120.767 -0.73 . . . . 0.0 112.566 -179.94 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -99.86 -40.85 7.49 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.75 0.309 . . . . 0.0 110.932 179.953 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -97.76 139.26 33.89 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.887 179.937 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . 0.66 ' HE2' HD11 ' A' ' 23' ' ' ILE . 0.8 OUTLIER -91.63 126.53 36.74 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.914 0.388 . . . . 0.0 110.881 -179.937 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -83.08 104.39 13.24 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.911 -0.586 . . . . 0.0 111.045 179.869 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 35' ' ' CYS . . . . . 0.514 ' SG ' ' HB ' ' A' ' 23' ' ' ILE . 30.4 m -98.24 144.13 28.0 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.742 179.947 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . 0.646 ' HD2' ' HA ' ' A' ' 5' ' ' CYS . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.073 0 CA-C-O 118.198 -0.906 . . . . 0.0 110.872 179.753 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 6.0 t-80 . . . . . 0 C--O 1.231 0.121 0 CA-C-O 120.857 0.361 . . . . 0.0 110.673 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 5.7 t80 -57.5 158.8 5.47 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.744 179.962 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -70.24 82.41 0.53 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.215 0.531 . . . . 0.0 110.819 -179.916 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 5' ' ' CYS . . . . . 0.764 ' HA ' ' HG2' ' A' ' 36' ' ' LYS . 0.1 OUTLIER -100.8 -72.96 0.66 Allowed 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.475 -0.784 . . . . 0.0 110.29 179.596 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 6' ' ' VAL . . . . . 0.477 ' HA ' ' H ' ' A' ' 10' ' ' GLY . 9.9 p -54.0 -17.58 1.83 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 115.621 -0.718 . . . . 0.0 111.247 179.452 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -45.03 -48.65 11.67 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-N 115.834 -0.621 . . . . 0.0 111.443 -179.895 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 55.2 p -115.18 -4.35 12.46 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.94 179.991 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 123.46 53.43 0.2 Allowed Glycine 0 N--CA 1.452 -0.284 0 C-N-CA 120.725 -0.75 . . . . 0.0 112.494 179.886 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . 0.477 ' H ' ' HA ' ' A' ' 6' ' ' VAL . . . -97.09 171.16 26.75 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.804 -0.712 . . . . 0.0 112.467 -179.972 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 6.1 tp-100 -148.6 145.93 28.02 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.806 0.336 . . . . 0.0 110.911 -179.999 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 12' ' ' CYS . . . . . 0.428 ' HB3' ' HB2' ' A' ' 27' ' ' CYS . 0.1 OUTLIER -100.6 110.71 22.87 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.04 -179.893 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . 0.445 ' O ' ' HG3' ' A' ' 33' ' ' LYS . 11.0 mt -119.67 147.64 44.31 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.918 179.891 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 1.4 m-85 -88.86 16.29 7.12 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.957 179.934 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 15' ' ' SER . . . . . 0.448 ' O ' ' HD3' ' A' ' 33' ' ' LYS . 8.5 p -139.79 158.4 44.15 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.89 179.908 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -48.79 140.66 8.3 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.381 -179.879 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . 0.402 ' HA ' ' HD3' ' A' ' 18' ' ' PRO . 0.2 OUTLIER -45.96 123.88 6.53 Favored Pre-proline 0 C--N 1.332 -0.176 0 CA-C-N 115.888 -0.596 . . . . 0.0 111.379 -179.875 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . 0.402 ' HD3' ' HA ' ' A' ' 17' ' ' CYS . 56.8 Cg_endo -89.38 -73.65 0.0 OUTLIER 'Trans proline' 0 N--CA 1.455 -0.747 0 C-N-CA 122.895 2.396 . . . . 0.0 112.69 -179.812 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 19' ' ' ILE . . . . . 0.662 HG12 ' H ' ' A' ' 20' ' ' PHE . 6.6 tt -56.47 -174.21 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.535 0.375 0 CA-C-N 116.492 -0.322 . . . . 0.0 111.567 -179.894 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 20' ' ' PHE . . . . . 0.662 ' H ' HG12 ' A' ' 19' ' ' ILE . 50.8 p90 -70.1 17.63 0.06 Allowed 'General case' 0 CA--C 1.531 0.224 0 N-CA-C 112.472 0.545 . . . . 0.0 112.472 -179.285 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 21' ' ' THR . . . . . 0.617 ' OG1' HG21 ' A' ' 19' ' ' ILE . 0.7 OUTLIER -74.91 -174.24 2.15 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.744 0.307 . . . . 0.0 110.683 179.417 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . 0.486 ' HG3' ' HZ1' ' A' ' 36' ' ' LYS . 10.0 ptmt -147.31 127.65 13.95 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.999 179.807 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 23' ' ' ILE . . . . . 0.688 ' HB ' ' HE3' ' A' ' 33' ' ' LYS . 0.2 OUTLIER -81.26 119.78 31.56 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.645 179.802 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 24' ' ' GLN . . . . . 0.684 ' HB2' ' HE2' ' A' ' 36' ' ' LYS . 0.9 OUTLIER -95.75 -46.72 6.47 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.763 -179.892 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -152.06 -127.13 1.28 Allowed Glycine 0 N--CA 1.45 -0.391 0 C-N-CA 120.9 -0.667 . . . . 0.0 112.226 179.838 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 26' ' ' THR . . . . . 0.557 ' HA ' ' HA ' ' A' ' 33' ' ' LYS . 17.0 p -131.96 138.76 48.44 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.864 0.364 . . . . 0.0 111.16 179.844 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 27' ' ' CYS . . . . . 0.428 ' HB2' ' HB3' ' A' ' 12' ' ' CYS . 0.1 OUTLIER -71.85 -85.09 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.903 179.995 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 8.5 m-85 -60.84 -168.46 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.193 179.916 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 10.7 tpt180 -50.22 -31.9 15.14 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.049 -0.523 . . . . 0.0 111.148 179.934 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 157.38 36.9 0.02 OUTLIER Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 120.795 -0.717 . . . . 0.0 112.58 179.98 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 1.7 mtpp -113.2 -8.63 13.53 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.804 0.335 . . . . 0.0 110.776 179.886 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -150.86 151.39 32.16 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.288 179.989 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . 0.688 ' HE3' ' HB ' ' A' ' 23' ' ' ILE . 0.0 OUTLIER -97.97 139.59 33.58 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.753 -0.658 . . . . 0.0 110.739 179.827 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 34' ' ' CYS . . . . . 0.467 ' O ' ' HA ' ' A' ' 23' ' ' ILE . 0.0 OUTLIER -87.76 134.26 33.71 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.913 179.981 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 35' ' ' CYS . . . . . 0.573 ' SG ' ' HE3' ' A' ' 33' ' ' LYS . 1.0 OUTLIER -130.94 125.73 34.22 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.169 -179.971 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . 0.764 ' HG2' ' HA ' ' A' ' 5' ' ' CYS . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.047 0 CA-C-O 118.199 -0.905 . . . . 0.0 110.75 179.661 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 11.7 t-80 . . . . . 0 C--O 1.232 0.143 0 CA-C-O 120.801 0.334 . . . . 0.0 111.109 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 10.4 t80 -62.87 160.89 13.74 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.742 179.642 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 6.7 t-20 -64.09 91.58 0.07 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.222 0.534 . . . . 0.0 110.213 179.623 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -119.51 -75.87 0.58 Allowed 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.485 -0.78 . . . . 0.0 109.71 179.928 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 6' ' ' VAL . . . . . 0.447 ' HA ' ' H ' ' A' ' 10' ' ' GLY . 8.1 p -54.68 -13.72 0.84 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.191 0 CA-C-N 115.76 -0.655 . . . . 0.0 110.688 178.794 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 41.3 t -38.58 -50.89 1.62 Allowed 'General case' 0 N--CA 1.462 0.146 0 CA-C-N 115.76 -0.654 . . . . 0.0 111.288 179.926 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -110.75 -22.95 11.32 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.903 -0.589 . . . . 0.0 110.75 179.957 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 147.88 41.23 0.04 OUTLIER Glycine 0 N--CA 1.452 -0.273 0 C-N-CA 120.736 -0.745 . . . . 0.0 112.536 179.937 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . 0.447 ' H ' ' HA ' ' A' ' 6' ' ' VAL . . . -88.53 170.54 38.78 Favored Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.821 -0.704 . . . . 0.0 112.55 179.993 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -143.74 145.76 32.65 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.787 0.327 . . . . 0.0 110.887 -179.937 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 1.9 m -95.88 134.68 38.58 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.861 179.934 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -122.75 152.22 40.82 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.849 -179.874 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 90.5 m-85 -88.39 4.54 45.92 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.696 179.833 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 15' ' ' SER . . . . . 0.461 ' O ' ' HD2' ' A' ' 33' ' ' LYS . 5.6 t -153.99 -176.22 5.75 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.858 179.954 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -49.8 137.49 16.24 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.048 -0.524 . . . . 0.0 111.38 -179.945 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . 0.433 ' HA ' ' HD3' ' A' ' 18' ' ' PRO . 0.1 OUTLIER -45.86 146.05 2.13 Favored Pre-proline 0 C--N 1.332 -0.183 0 CA-C-N 115.952 -0.567 . . . . 0.0 111.316 179.982 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . 0.433 ' HD3' ' HA ' ' A' ' 17' ' ' CYS . 53.0 Cg_endo -90.94 -80.37 0.0 OUTLIER 'Trans proline' 0 N--CA 1.454 -0.795 0 C-N-CA 122.969 2.446 . . . . 0.0 112.656 -179.754 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 19' ' ' ILE . . . . . 0.61 HG12 ' H ' ' A' ' 20' ' ' PHE . 6.1 tt -56.17 -172.38 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.534 0.346 0 CA-C-N 116.375 -0.375 . . . . 0.0 111.664 -179.866 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 20' ' ' PHE . . . . . 0.61 ' H ' HG12 ' A' ' 19' ' ' ILE . 0.2 OUTLIER -75.84 36.6 0.14 Allowed 'General case' 0 CA--C 1.531 0.236 0 N-CA-C 111.947 0.351 . . . . 0.0 111.947 -179.533 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 21' ' ' THR . . . . . 0.454 ' OG1' HG22 ' A' ' 19' ' ' ILE . 0.0 OUTLIER -85.81 -162.95 0.79 Allowed 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 120.526 0.203 . . . . 0.0 110.657 179.354 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . 0.551 ' HG3' HE22 ' A' ' 24' ' ' GLN . 2.1 pttt -155.66 122.22 5.25 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.937 0.399 . . . . 0.0 111.527 -179.907 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 23' ' ' ILE . . . . . 0.437 ' HB ' ' HE3' ' A' ' 33' ' ' LYS . 0.3 OUTLIER -75.66 125.72 35.6 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.47 179.434 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 24' ' ' GLN . . . . . 0.551 HE22 ' HG3' ' A' ' 22' ' ' LYS . 1.6 mp0 -103.48 -44.07 5.23 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.174 -0.467 . . . . 0.0 111.104 -179.739 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -146.89 -143.69 3.91 Favored Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.739 -0.743 . . . . 0.0 112.627 -179.92 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 26' ' ' THR . . . . . 0.769 ' HA ' ' HA ' ' A' ' 33' ' ' LYS . 0.0 OUTLIER -120.14 140.41 51.13 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.851 0.357 . . . . 0.0 111.217 -179.908 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 41.6 t -85.97 -80.5 0.23 Allowed 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.89 179.913 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 2.9 m-85 -60.27 -173.72 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.813 -0.63 . . . . 0.0 110.943 179.932 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -50.57 -28.13 8.06 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.934 179.772 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 161.76 10.42 0.04 OUTLIER Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.886 -0.673 . . . . 0.0 112.536 179.954 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -96.74 -16.01 21.09 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.754 0.312 . . . . 0.0 111.161 -179.886 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -134.93 150.45 50.4 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.828 179.912 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . 0.769 ' HA ' ' HA ' ' A' ' 26' ' ' THR . 0.0 OUTLIER -108.57 143.1 38.05 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.832 179.9 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -79.09 125.4 29.36 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.637 179.97 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -126.15 140.12 52.82 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.818 -179.896 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . 0.443 ' HE3' ' HB2' ' A' ' 24' ' ' GLN . 0.0 OUTLIER . . . . . 0 C--O 1.248 1.021 0 CA-C-O 118.22 -0.895 . . . . 0.0 110.895 179.798 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 2.0 t-80 . . . . . 0 C--O 1.232 0.149 0 CA-C-O 120.991 0.424 . . . . 0.0 110.844 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 9.1 t80 -61.38 167.5 3.24 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.688 179.737 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -77.65 77.27 4.17 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.235 0.541 . . . . 0.0 110.684 179.813 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 0.4 OUTLIER -103.89 -76.29 0.6 Allowed 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.298 -0.865 . . . . 0.0 110.494 179.943 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 6' ' ' VAL . . . . . 0.56 ' HA ' ' H ' ' A' ' 10' ' ' GLY . 7.5 p -54.13 -17.76 2.04 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.153 0 CA-C-N 116.019 -0.537 . . . . 0.0 111.126 179.579 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -45.34 -59.04 2.89 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 115.834 -0.621 . . . . 0.0 111.552 -179.912 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 52.4 p -98.81 -20.11 17.05 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.367 -0.379 . . . . 0.0 111.245 -179.643 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 144.49 53.81 0.03 OUTLIER Glycine 0 N--CA 1.452 -0.267 0 C-N-CA 120.688 -0.768 . . . . 0.0 112.605 -179.963 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . 0.56 ' H ' ' HA ' ' A' ' 6' ' ' VAL . . . -105.02 159.79 15.53 Favored Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.78 -0.724 . . . . 0.0 112.465 179.924 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 1.2 mt-30 -125.25 153.21 43.54 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.761 0.315 . . . . 0.0 110.909 -179.926 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 3.1 m -118.59 119.7 35.28 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.086 -179.773 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -124.82 159.1 31.81 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.722 179.928 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 34.2 m-85 -88.56 -5.52 58.14 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.341 -0.39 . . . . 0.0 111.165 -179.921 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 15' ' ' SER . . . . . 0.511 ' HG ' ' H ' ' A' ' 16' ' ' ALA . 2.4 t -128.4 -179.3 4.95 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.372 -0.377 . . . . 0.0 110.917 -179.877 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . 0.511 ' H ' ' HG ' ' A' ' 15' ' ' SER . . . -48.84 141.64 7.25 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.087 179.966 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . 0.402 ' HA ' ' HZ1' ' A' ' 33' ' ' LYS . 0.9 OUTLIER -45.63 141.63 3.85 Favored Pre-proline 0 C--N 1.329 -0.318 0 CA-C-N 115.907 -0.588 . . . . 0.0 111.455 -179.756 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 38.9 Cg_endo -89.84 -81.59 0.0 OUTLIER 'Trans proline' 0 N--CA 1.453 -0.885 0 C-N-CA 122.91 2.407 . . . . 0.0 112.357 179.94 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 19' ' ' ILE . . . . . 0.701 HG13 ' H ' ' A' ' 20' ' ' PHE . 4.3 tp -56.57 -173.95 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.535 0.393 0 CA-C-N 116.406 -0.361 . . . . 0.0 111.638 179.976 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 20' ' ' PHE . . . . . 0.701 ' H ' HG13 ' A' ' 19' ' ' ILE . 7.5 p90 -71.62 21.36 0.05 Allowed 'General case' 0 CA--C 1.535 0.371 0 N-CA-C 112.939 0.718 . . . . 0.0 112.939 -178.876 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 21' ' ' THR . . . . . 0.578 ' OG1' HG21 ' A' ' 19' ' ' ILE . 0.2 OUTLIER -75.71 -172.21 1.81 Allowed 'General case' 0 N--CA 1.463 0.187 0 C-N-CA 121.051 -0.259 . . . . 0.0 110.86 179.288 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 6.4 tttp -145.94 111.59 5.53 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 120.789 0.328 . . . . 0.0 111.093 -179.749 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 23' ' ' ILE . . . . . 0.479 ' HB ' ' HE3' ' A' ' 33' ' ' LYS . 0.2 OUTLIER -58.72 123.97 11.91 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.189 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.009 -179.96 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -99.36 -25.6 14.42 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.84 179.923 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -178.74 -116.87 0.52 Allowed Glycine 0 N--CA 1.451 -0.358 0 C-N-CA 120.828 -0.701 . . . . 0.0 112.391 179.957 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 26' ' ' THR . . . . . 0.683 ' HA ' ' HA ' ' A' ' 33' ' ' LYS . 1.0 OUTLIER -133.78 143.57 48.49 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.983 0.42 . . . . 0.0 111.352 -179.961 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 10.4 t -81.9 -79.3 0.18 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.903 -0.59 . . . . 0.0 110.968 179.973 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 11.3 m-85 -61.28 -160.5 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.002 -0.545 . . . . 0.0 111.427 -179.928 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 12.0 mtm180 -50.13 -39.2 42.37 Favored 'General case' 0 C--N 1.332 -0.156 0 CA-C-N 115.997 -0.547 . . . . 0.0 111.18 -179.944 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 159.26 33.16 0.02 OUTLIER Glycine 0 N--CA 1.451 -0.328 0 C-N-CA 120.811 -0.709 . . . . 0.0 112.486 179.937 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 2.0 mmpt? -107.77 -32.08 7.78 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.894 0.378 . . . . 0.0 110.788 -179.971 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -121.3 150.67 41.07 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.013 -0.54 . . . . 0.0 110.875 179.932 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . 0.683 ' HA ' ' HA ' ' A' ' 26' ' ' THR . 0.0 OUTLIER -90.32 145.39 25.01 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.985 -179.872 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 34' ' ' CYS . . . . . 0.416 ' O ' ' HA ' ' A' ' 23' ' ' ILE . 0.0 OUTLIER -95.03 135.7 36.24 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.976 179.948 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 35' ' ' CYS . . . . . 0.572 ' SG ' ' HE3' ' A' ' 33' ' ' LYS . 1.1 m -129.26 140.27 51.51 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.046 -0.525 . . . . 0.0 110.57 179.93 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . 0.542 ' HE3' ' H ' ' A' ' 36' ' ' LYS . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.07 0 CA-C-O 118.179 -0.915 . . . . 0.0 111.063 179.844 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 2.0 t-80 . . . . . 0 C--O 1.231 0.125 0 CA-C-O 120.872 0.368 . . . . 0.0 110.674 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 6.5 t80 -63.89 160.51 17.44 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.752 179.897 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -71.83 82.77 0.9 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.184 0.516 . . . . 0.0 110.546 179.727 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -99.66 -67.43 0.85 Allowed 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.469 -0.787 . . . . 0.0 110.498 179.948 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 4.2 p -54.78 -15.5 1.31 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.516 179.645 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -42.63 -52.98 4.65 Favored 'General case' 0 N--CA 1.464 0.252 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.518 -179.646 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 10.7 p -101.73 -1.21 33.0 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.903 -179.904 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 112.89 30.36 2.8 Favored Glycine 0 N--CA 1.451 -0.328 0 C-N-CA 120.7 -0.762 . . . . 0.0 112.168 -179.868 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -84.49 165.01 40.31 Favored Glycine 0 N--CA 1.45 -0.388 0 C-N-CA 120.849 -0.691 . . . . 0.0 112.711 -179.869 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -146.38 142.6 28.37 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.643 0.259 . . . . 0.0 110.674 179.94 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 12' ' ' CYS . . . . . 0.449 ' HA ' ' O ' ' A' ' 33' ' ' LYS . 0.0 OUTLIER -97.1 122.54 40.21 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.887 0.375 . . . . 0.0 111.173 -179.868 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -117.02 147.36 42.4 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.729 179.785 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 14' ' ' TYR . . . . . 0.565 ' HH ' ' HG2' ' A' ' 31' ' ' LYS . 0.1 OUTLIER -51.0 -33.96 27.17 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.059 -0.519 . . . . 0.0 111.4 -179.609 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -108.65 163.26 13.41 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.793 179.957 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -52.86 155.2 2.46 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.543 179.473 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . 0.529 ' SG ' ' HB ' ' A' ' 23' ' ' ILE . 3.1 m -44.93 138.66 4.11 Favored Pre-proline 0 C--N 1.327 -0.41 0 CA-C-N 115.901 -0.591 . . . . 0.0 111.342 -179.573 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . 0.413 ' HD3' ' HA ' ' A' ' 17' ' ' CYS . 50.2 Cg_endo -88.28 -71.87 0.01 OUTLIER 'Trans proline' 0 N--CA 1.454 -0.837 0 C-N-CA 122.996 2.464 . . . . 0.0 111.801 179.62 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 19' ' ' ILE . . . . . 0.484 ' C ' ' H ' ' A' ' 21' ' ' THR . 1.5 tt -56.97 -168.76 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.535 0.396 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.036 179.177 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 20' ' ' PHE . . . . . 0.45 ' H ' ' CG1' ' A' ' 19' ' ' ILE . 2.1 p90 -73.43 23.43 0.07 Allowed 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.583 0.23 . . . . 0.0 111.538 179.917 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 21' ' ' THR . . . . . 0.484 ' H ' ' C ' ' A' ' 19' ' ' ILE . 0.2 OUTLIER -65.23 -169.45 0.05 OUTLIER 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 120.766 0.317 . . . . 0.0 111.116 179.844 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -156.15 111.0 2.88 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.701 179.996 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 23' ' ' ILE . . . . . 0.751 HG13 ' HB3' ' A' ' 33' ' ' LYS . 0.0 OUTLIER -75.9 132.66 32.73 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-O 121.044 0.45 . . . . 0.0 111.202 -179.779 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 24' ' ' GLN . . . . . 0.473 ' NE2' ' HE2' ' A' ' 36' ' ' LYS . 0.3 OUTLIER -92.98 -43.57 8.86 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.719 -0.673 . . . . 0.0 110.37 179.42 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -159.47 -138.76 2.53 Favored Glycine 0 N--CA 1.45 -0.399 0 CA-C-N 115.613 -0.721 . . . . 0.0 112.05 179.942 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 26' ' ' THR . . . . . 0.605 HG22 ' HE3' ' A' ' 33' ' ' LYS . 4.1 p -120.71 145.34 47.58 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 120.89 0.376 . . . . 0.0 111.028 179.775 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -80.89 -88.4 0.08 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.971 -179.929 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 8.0 m-85 -61.23 -161.69 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.231 179.908 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -50.29 -34.38 23.24 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.972 179.956 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 151.93 48.6 0.02 OUTLIER Glycine 0 N--CA 1.452 -0.27 0 C-N-CA 120.801 -0.714 . . . . 0.0 112.466 179.878 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . 0.565 ' HG2' ' HH ' ' A' ' 14' ' ' TYR . 0.0 OUTLIER -116.43 -35.05 4.39 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.769 0.318 . . . . 0.0 110.917 179.968 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -123.79 140.59 52.83 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.221 -179.973 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . 0.751 ' HB3' HG13 ' A' ' 23' ' ' ILE . 1.0 OUTLIER -85.74 130.68 34.5 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.879 -179.953 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -80.82 112.23 18.01 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.534 179.703 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 35' ' ' CYS . . . . . 0.524 ' SG ' ' HB ' ' A' ' 23' ' ' ILE . 68.8 m -113.46 151.37 31.52 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.949 -0.568 . . . . 0.0 110.522 179.982 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . 0.473 ' HE2' ' NE2' ' A' ' 24' ' ' GLN . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.027 0 CA-C-O 118.232 -0.89 . . . . 0.0 110.93 179.704 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 4.1 t-80 . . . . . 0 C--O 1.232 0.152 0 CA-C-O 120.841 0.353 . . . . 0.0 110.841 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 3.4 t80 -58.93 150.77 23.45 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.402 179.623 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 4' ' ' ASN . . . . . 0.496 ' OD1' ' HB2' ' A' ' 7' ' ' SER . 4.4 t30 -64.5 86.41 0.05 OUTLIER 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.274 0.559 . . . . 0.0 110.562 179.947 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 5' ' ' CYS . . . . . 0.456 ' C ' ' H ' ' A' ' 7' ' ' SER . 0.1 OUTLIER -116.82 -74.54 0.6 Allowed 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.449 -0.796 . . . . 0.0 110.103 -179.991 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 5.5 p -55.65 -8.17 0.4 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.192 0 CA-C-N 115.946 -0.57 . . . . 0.0 111.21 178.95 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 7' ' ' SER . . . . . 0.496 ' HB2' ' OD1' ' A' ' 4' ' ' ASN . 2.3 t -31.61 -54.02 0.26 Allowed 'General case' 0 N--CA 1.464 0.227 0 CA-C-N 115.755 -0.657 . . . . 0.0 111.553 -179.702 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -115.34 -40.19 3.47 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.695 -0.684 . . . . 0.0 110.754 179.826 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 178.38 41.48 0.07 OUTLIER Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 120.965 -0.636 . . . . 0.0 112.236 -179.975 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -94.3 162.77 24.9 Favored Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 120.818 -0.706 . . . . 0.0 112.682 -179.798 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 2.1 pt20 -150.25 150.61 31.77 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.736 0.303 . . . . 0.0 110.675 179.988 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 12' ' ' CYS . . . . . 0.513 ' HB3' ' HB2' ' A' ' 27' ' ' CYS . 0.0 OUTLIER -98.45 114.69 27.15 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.948 0.404 . . . . 0.0 111.384 -179.893 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -99.69 133.99 43.23 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.211 179.429 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER -53.27 -21.92 6.18 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.398 -0.365 . . . . 0.0 111.184 -179.792 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -114.32 159.24 20.44 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.585 179.618 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -53.22 155.87 2.51 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.332 -0.395 . . . . 0.0 111.131 179.891 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -39.6 112.52 0.78 Allowed Pre-proline 0 C--N 1.328 -0.331 0 CA-C-N 115.427 -0.806 . . . . 0.0 111.749 -179.563 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 60.5 Cg_endo -83.56 -72.6 0.01 OUTLIER 'Trans proline' 0 N--CA 1.459 -0.519 0 C-N-CA 122.689 2.26 . . . . 0.0 112.281 179.784 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 19' ' ' ILE . . . . . 0.511 HG23 ' OG1' ' A' ' 21' ' ' THR . 1.2 tt -56.46 -172.8 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.534 0.334 0 CA-C-N 116.408 -0.36 . . . . 0.0 111.375 179.741 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 20' ' ' PHE . . . . . 0.402 ' H ' ' CG1' ' A' ' 19' ' ' ILE . 38.0 p90 -72.92 24.56 0.06 Allowed 'General case' 0 CA--C 1.53 0.205 0 N-CA-C 111.983 0.364 . . . . 0.0 111.983 -179.66 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 21' ' ' THR . . . . . 0.511 ' OG1' HG23 ' A' ' 19' ' ' ILE . 0.8 OUTLIER -76.88 -162.99 0.31 Allowed 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.626 0.25 . . . . 0.0 110.669 179.527 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . 0.459 ' H ' ' HB ' ' A' ' 21' ' ' THR . 8.1 pttp -155.14 111.82 3.24 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.92 0.391 . . . . 0.0 111.0 179.813 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 23' ' ' ILE . . . . . 0.941 HG13 ' HB3' ' A' ' 33' ' ' LYS . 0.0 OUTLIER -74.53 131.41 35.02 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.869 -179.979 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 24' ' ' GLN . . . . . 0.553 ' HB2' ' HZ1' ' A' ' 36' ' ' LYS . 2.2 mp0 -100.56 -39.38 7.94 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.053 -0.522 . . . . 0.0 110.72 179.68 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -157.15 -151.17 5.92 Favored Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.823 -0.703 . . . . 0.0 112.381 -179.986 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 26' ' ' THR . . . . . 0.679 HG22 ' HE3' ' A' ' 33' ' ' LYS . 0.0 OUTLIER -115.24 149.48 37.68 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.012 0.434 . . . . 0.0 111.208 -179.931 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 27' ' ' CYS . . . . . 0.513 ' HB2' ' HB3' ' A' ' 12' ' ' CYS . 0.0 OUTLIER -91.4 -87.59 0.2 Allowed 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.764 -0.653 . . . . 0.0 111.199 -179.891 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 5.0 m-85 -61.08 -164.01 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.496 -179.743 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -50.24 -33.03 18.22 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.952 -0.567 . . . . 0.0 111.199 -179.907 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 151.35 41.12 0.03 OUTLIER Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 120.673 -0.775 . . . . 0.0 112.742 179.851 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 23.5 mtpt -115.57 -24.39 8.33 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.748 0.309 . . . . 0.0 110.975 179.882 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -129.96 141.82 50.72 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.13 179.97 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . 0.941 ' HB3' HG13 ' A' ' 23' ' ' ILE . 1.5 mmpt? -93.99 133.66 37.2 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.05 -179.982 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -77.31 117.56 18.93 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.382 179.574 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 35' ' ' CYS . . . . . 0.556 ' SG ' ' HB ' ' A' ' 23' ' ' ILE . 20.1 m -118.35 146.13 44.61 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.026 -179.579 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . 0.553 ' HZ1' ' HB2' ' A' ' 24' ' ' GLN . 5.2 mtmm . . . . . 0 C--O 1.249 1.037 0 CA-C-O 118.29 -0.862 . . . . 0.0 110.851 179.624 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 8.7 t-80 . . . . . 0 C--O 1.232 0.166 0 CA-C-O 121.009 0.433 . . . . 0.0 111.037 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 10.8 t80 -67.2 174.64 3.07 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.717 179.669 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 4' ' ' ASN . . . . . 0.519 ' O ' ' ND2' ' A' ' 4' ' ' ASN . 0.8 OUTLIER -77.1 89.14 3.6 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 121.635 0.731 . . . . 0.0 110.117 179.508 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -118.06 -78.54 0.58 Allowed 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.313 -0.858 . . . . 0.0 109.345 179.954 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 6' ' ' VAL . . . . . 0.714 ' HA ' ' H ' ' A' ' 10' ' ' GLY . 10.4 p -54.47 -20.27 4.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 115.672 -0.695 . . . . 0.0 110.112 178.248 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 10.4 t -44.86 -43.19 8.59 Favored 'General case' 0 C--O 1.232 0.171 0 CA-C-N 115.29 -0.868 . . . . 0.0 111.406 179.989 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 23.0 p -97.53 -36.37 10.33 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.076 -179.793 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 153.85 50.29 0.01 OUTLIER Glycine 0 N--CA 1.453 -0.218 0 C-N-CA 120.686 -0.768 . . . . 0.0 112.531 -179.937 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . 0.714 ' H ' ' HA ' ' A' ' 6' ' ' VAL . . . -120.9 -177.14 15.63 Favored Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.768 -0.73 . . . . 0.0 112.578 -179.973 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 32.9 mt-30 -147.1 150.83 35.78 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 120.851 0.358 . . . . 0.0 111.138 -179.946 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 3.2 m -96.79 122.67 40.01 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.389 179.483 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 3.3 mt -132.75 159.01 40.94 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.377 -0.374 . . . . 0.0 111.07 -179.681 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 28.2 m-85 -88.34 -9.93 51.12 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.924 -179.923 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 1.6 m -113.56 167.12 10.86 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.134 -179.862 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -52.98 147.3 9.5 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.04 -0.527 . . . . 0.0 111.318 -179.942 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -45.6 120.7 5.07 Favored Pre-proline 0 C--N 1.328 -0.351 0 CA-C-N 115.666 -0.697 . . . . 0.0 111.469 -179.89 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 58.9 Cg_endo -84.01 -75.42 0.0 OUTLIER 'Trans proline' 0 N--CA 1.458 -0.579 0 C-N-CA 122.599 2.2 . . . . 0.0 112.455 179.876 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 19' ' ' ILE . . . . . 0.455 HG21 ' N ' ' A' ' 20' ' ' PHE . 0.3 OUTLIER -56.36 -172.48 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.534 0.34 0 CA-C-N 116.493 -0.322 . . . . 0.0 111.478 179.956 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 20' ' ' PHE . . . . . 0.455 ' N ' HG21 ' A' ' 19' ' ' ILE . 3.0 p90 -75.34 33.5 0.11 Allowed 'General case' 0 CA--C 1.531 0.227 0 N-CA-C 112.113 0.412 . . . . 0.0 112.113 -179.398 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 21' ' ' THR . . . . . 0.406 ' H ' ' C ' ' A' ' 19' ' ' ILE . 0.6 OUTLIER -90.52 -168.95 2.24 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.761 0.315 . . . . 0.0 110.64 179.306 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . 0.513 ' HG3' HE22 ' A' ' 24' ' ' GLN . 11.6 ptpt -151.95 129.86 11.73 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.264 -0.426 . . . . 0.0 110.819 179.649 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 23' ' ' ILE . . . . . 0.694 ' HB ' ' HE3' ' A' ' 33' ' ' LYS . 0.2 OUTLIER -80.76 127.45 39.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.846 -179.811 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 24' ' ' GLN . . . . . 0.515 ' HB2' ' HE2' ' A' ' 36' ' ' LYS . 0.0 OUTLIER -105.68 -35.89 7.25 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.813 -0.63 . . . . 0.0 110.894 -179.734 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -161.21 -128.05 0.92 Allowed Glycine 0 N--CA 1.451 -0.362 0 C-N-CA 120.788 -0.72 . . . . 0.0 112.503 179.974 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 26' ' ' THR . . . . . 0.453 ' HA ' ' HA ' ' A' ' 33' ' ' LYS . 40.9 p -127.72 150.37 49.81 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.992 0.425 . . . . 0.0 111.145 -179.947 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 15.0 t -93.75 -83.59 0.32 Allowed 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.776 -0.647 . . . . 0.0 111.186 -179.671 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 43.2 m-85 -60.85 -169.45 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.59 -179.658 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 12.9 mtp180 -45.92 -44.03 14.34 Favored 'General case' 0 N--CA 1.462 0.135 0 CA-C-N 115.876 -0.602 . . . . 0.0 111.377 -179.866 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 163.1 48.37 0.02 OUTLIER Glycine 0 N--CA 1.452 -0.285 0 C-N-CA 120.635 -0.793 . . . . 0.0 112.649 179.983 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 30.5 mttt -128.97 -18.62 3.73 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.844 0.354 . . . . 0.0 111.009 179.976 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -136.0 147.58 48.04 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.056 179.917 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . 0.694 ' HE3' ' HB ' ' A' ' 23' ' ' ILE . 0.0 OUTLIER -91.58 148.09 22.53 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.815 -179.979 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -94.45 126.27 39.62 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.905 -0.589 . . . . 0.0 111.272 -179.798 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 35' ' ' CYS . . . . . 0.528 ' SG ' ' HE3' ' A' ' 33' ' ' LYS . 0.8 OUTLIER -122.51 143.63 49.59 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.411 179.506 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . 0.515 ' HE2' ' HB2' ' A' ' 24' ' ' GLN . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.058 0 CA-C-O 118.236 -0.888 . . . . 0.0 111.087 -179.894 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 8.6 t-80 . . . . . 0 C--O 1.231 0.095 0 CA-C-O 120.845 0.355 . . . . 0.0 110.889 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 3' ' ' TYR . . . . . 0.4 ' HB3' ' SG ' ' A' ' 5' ' ' CYS . 2.2 t80 -62.16 163.56 7.99 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.275 179.703 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 19.2 t-20 -79.21 74.36 5.78 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 121.491 0.662 . . . . 0.0 110.525 179.807 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 5' ' ' CYS . . . . . 0.764 ' HA ' ' HG2' ' A' ' 36' ' ' LYS . 0.0 OUTLIER -104.49 -55.83 2.29 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 114.984 -1.007 . . . . 0.0 109.934 179.696 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 6' ' ' VAL . . . . . 0.514 ' HA ' ' N ' ' A' ' 10' ' ' GLY . 1.6 p -55.68 -8.08 0.39 Allowed 'Isoleucine or valine' 0 CA--C 1.53 0.182 0 CA-C-N 115.713 -0.676 . . . . 0.0 111.404 179.048 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 7' ' ' SER . . . . . 0.434 ' H ' ' C ' ' A' ' 5' ' ' CYS . 4.2 t -35.58 -52.95 0.68 Allowed 'General case' 0 N--CA 1.464 0.24 0 CA-C-N 115.877 -0.602 . . . . 0.0 111.72 -179.472 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 8.6 p -115.04 -10.98 12.17 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.861 -179.942 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 145.16 31.44 0.08 OUTLIER Glycine 0 N--CA 1.45 -0.39 0 C-N-CA 120.854 -0.688 . . . . 0.0 112.304 -179.84 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . 0.514 ' N ' ' HA ' ' A' ' 6' ' ' VAL . . . -62.27 175.38 7.0 Favored Glycine 0 N--CA 1.45 -0.429 0 C-N-CA 120.905 -0.664 . . . . 0.0 112.527 -179.974 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 3.2 pt20 -150.26 156.82 42.28 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.895 0.378 . . . . 0.0 111.175 -179.831 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 3.3 m -128.17 111.61 13.63 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.79 179.864 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . 0.611 HD22 ' HZ3' ' A' ' 33' ' ' LYS . 1.1 pt? -140.14 148.51 41.75 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.97 179.949 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 27.2 m-85 -63.31 -33.01 74.58 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.03 -0.532 . . . . 0.0 111.462 -179.58 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -79.7 148.96 31.35 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.39 -0.368 . . . . 0.0 111.316 -179.682 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . 0.412 ' HA ' ' HD3' ' A' ' 33' ' ' LYS . . . -55.16 154.79 5.34 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.118 179.698 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -41.4 122.9 2.2 Favored Pre-proline 0 C--N 1.327 -0.377 0 CA-C-N 115.397 -0.819 . . . . 0.0 111.786 -179.635 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 59.3 Cg_endo -86.98 -77.14 0.0 OUTLIER 'Trans proline' 0 N--CA 1.456 -0.694 0 C-N-CA 122.771 2.314 . . . . 0.0 112.314 179.609 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 19' ' ' ILE . . . . . 0.484 HG22 ' OG1' ' A' ' 21' ' ' THR . 0.3 OUTLIER -56.54 -171.74 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.535 0.367 0 CA-C-N 116.452 -0.34 . . . . 0.0 111.387 179.727 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 20' ' ' PHE . . . . . 0.438 ' N ' HG21 ' A' ' 19' ' ' ILE . 0.7 OUTLIER -71.25 19.38 0.06 Allowed 'General case' 0 CA--C 1.531 0.238 0 N-CA-C 112.414 0.524 . . . . 0.0 112.414 -179.426 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 21' ' ' THR . . . . . 0.484 ' OG1' HG22 ' A' ' 19' ' ' ILE . 0.3 OUTLIER -73.99 -170.57 0.94 Allowed 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.761 0.315 . . . . 0.0 110.625 179.388 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . 0.463 ' HG2' ' OXT' ' A' ' 36' ' ' LYS . 0.7 OUTLIER -150.76 122.73 8.18 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.79 179.822 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 23' ' ' ILE . . . . . 0.867 ' HB ' ' HE3' ' A' ' 33' ' ' LYS . 0.2 OUTLIER -71.61 130.18 35.2 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-O 120.975 0.416 . . . . 0.0 110.402 179.913 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 24' ' ' GLN . . . . . 0.649 HE22 ' HB3' ' A' ' 34' ' ' CYS . 0.0 OUTLIER -111.95 -4.56 14.5 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.856 -0.611 . . . . 0.0 111.13 -179.298 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 163.82 -135.4 3.77 Favored Glycine 0 N--CA 1.45 -0.412 0 C-N-CA 120.879 -0.677 . . . . 0.0 112.229 -179.993 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 26' ' ' THR . . . . . 0.658 ' HA ' ' HA ' ' A' ' 33' ' ' LYS . 1.2 p -127.3 149.71 49.91 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 121.029 0.442 . . . . 0.0 111.286 179.883 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 27' ' ' CYS . . . . . 0.414 ' HB3' ' H ' ' A' ' 28' ' ' TYR . 4.2 t -88.08 -82.47 0.23 Allowed 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.607 -0.724 . . . . 0.0 111.014 -179.691 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 28' ' ' TYR . . . . . 0.414 ' H ' ' HB3' ' A' ' 27' ' ' CYS . 60.8 m-85 -61.13 -165.95 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.682 -179.841 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -49.22 -42.43 40.39 Favored 'General case' 0 C--N 1.333 -0.139 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.337 -179.813 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 163.94 50.21 0.02 OUTLIER Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.724 -0.75 . . . . 0.0 112.557 179.896 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -124.78 -37.96 2.42 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.78 0.324 . . . . 0.0 110.835 179.948 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -121.54 145.92 47.47 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.887 179.921 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . 0.867 ' HE3' ' HB ' ' A' ' 23' ' ' ILE . 0.0 OUTLIER -94.98 145.56 24.85 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.835 -179.941 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 34' ' ' CYS . . . . . 0.649 ' HB3' HE22 ' A' ' 24' ' ' GLN . 0.0 OUTLIER -90.66 142.96 27.21 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.208 -179.969 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 35' ' ' CYS . . . . . 0.572 ' SG ' ' HE3' ' A' ' 33' ' ' LYS . 1.2 m -138.68 142.07 39.0 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.973 179.933 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . 0.764 ' HG2' ' HA ' ' A' ' 5' ' ' CYS . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.066 0 CA-C-O 118.217 -0.897 . . . . 0.0 110.987 179.803 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 15.2 t-80 . . . . . 0 C--O 1.231 0.122 0 CA-C-O 120.921 0.391 . . . . 0.0 110.936 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 6.0 t80 -61.15 174.58 0.65 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.958 -0.564 . . . . 0.0 110.693 179.731 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -79.55 79.37 6.03 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 121.264 0.554 . . . . 0.0 110.274 179.569 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -109.21 -65.01 1.18 Allowed 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.3 -0.864 . . . . 0.0 110.691 -179.748 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 6' ' ' VAL . . . . . 0.484 ' HA ' ' H ' ' A' ' 10' ' ' GLY . 0.3 OUTLIER -53.93 -17.83 1.93 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 115.672 -0.694 . . . . 0.0 111.143 179.923 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -45.46 -35.99 4.14 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-N 115.916 -0.584 . . . . 0.0 111.183 179.899 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -114.89 -13.7 11.95 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.801 179.845 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 123.81 41.58 0.41 Allowed Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.85 -0.691 . . . . 0.0 112.496 -179.973 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . 0.484 ' H ' ' HA ' ' A' ' 6' ' ' VAL . . . -92.23 174.89 37.4 Favored Glycine 0 N--CA 1.452 -0.284 0 C-N-CA 120.785 -0.721 . . . . 0.0 112.417 179.978 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 1.2 tt0 -147.45 150.87 35.44 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.764 0.316 . . . . 0.0 110.874 179.919 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 1.7 m -93.49 139.37 30.8 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.132 -0.485 . . . . 0.0 111.264 -179.71 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . 0.412 ' HG ' ' HD3' ' A' ' 18' ' ' PRO . 3.2 mm? -126.35 142.41 51.54 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.459 179.657 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 2.0 m-85 -74.67 -1.91 23.9 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.396 -0.366 . . . . 0.0 111.209 -179.761 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 15' ' ' SER . . . . . 0.485 ' O ' ' HD2' ' A' ' 33' ' ' LYS . 0.4 OUTLIER -149.91 -179.05 6.83 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.813 179.852 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -44.97 137.18 4.28 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.213 179.984 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . 0.432 ' SG ' ' HD2' ' A' ' 18' ' ' PRO . 0.5 OUTLIER -45.49 141.77 3.61 Favored Pre-proline 0 C--N 1.33 -0.268 0 CA-C-N 115.919 -0.582 . . . . 0.0 111.691 -179.568 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . 0.432 ' HD2' ' SG ' ' A' ' 17' ' ' CYS . 68.3 Cg_endo -79.3 -83.92 0.0 OUTLIER 'Trans proline' 0 C--N 1.348 0.545 0 C-N-CA 122.618 2.212 . . . . 0.0 112.641 -179.982 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 19' ' ' ILE . . . . . 0.513 HG23 ' OG1' ' A' ' 21' ' ' THR . 3.6 tt -56.17 -176.07 0.02 OUTLIER 'Isoleucine or valine' 0 CA--C 1.533 0.308 0 CA-C-O 120.784 0.326 . . . . 0.0 111.593 -179.768 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 20' ' ' PHE . . . . . 0.45 ' H ' HG12 ' A' ' 19' ' ' ILE . 0.4 OUTLIER -76.3 35.19 0.14 Allowed 'General case' 0 C--N 1.331 -0.205 0 N-CA-C 111.996 0.369 . . . . 0.0 111.996 -179.368 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 21' ' ' THR . . . . . 0.513 ' OG1' HG23 ' A' ' 19' ' ' ILE . 0.0 OUTLIER -75.9 -152.46 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.792 -0.185 . . . . 0.0 110.507 179.441 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . 0.42 ' H ' ' HB ' ' A' ' 21' ' ' THR . 8.0 ttmm -160.45 108.59 1.63 Allowed 'General case' 0 C--O 1.231 0.122 0 CA-C-O 120.859 0.361 . . . . 0.0 111.838 -179.744 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 23' ' ' ILE . . . . . 0.609 HD11 ' HB2' ' A' ' 33' ' ' LYS . 0.1 OUTLIER -66.12 133.21 31.29 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.197 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.852 179.344 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 24' ' ' GLN . . . . . 0.663 ' HB2' ' NZ ' ' A' ' 36' ' ' LYS . 0.0 OUTLIER -114.54 -68.53 0.92 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.614 179.537 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -121.98 164.19 15.16 Favored Glycine 0 N--CA 1.452 -0.295 0 C-N-CA 121.032 -0.604 . . . . 0.0 111.931 179.632 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 26' ' ' THR . . . . . 0.589 ' HA ' ' HA ' ' A' ' 33' ' ' LYS . 1.0 OUTLIER -75.5 153.02 37.76 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.07 0.462 . . . . 0.0 111.622 -179.802 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 18.4 t -100.67 -78.74 0.51 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.655 -0.702 . . . . 0.0 110.911 -179.903 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 3.4 m-85 -60.3 -174.69 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.989 179.931 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 20.0 ttm-85 -50.6 -25.86 4.67 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.873 179.783 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 156.26 9.59 0.06 OUTLIER Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.971 -0.633 . . . . 0.0 112.162 179.851 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -98.64 -14.01 20.06 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.685 0.279 . . . . 0.0 111.11 -179.858 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -138.51 141.95 39.35 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.411 -0.359 . . . . 0.0 110.555 179.896 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . 0.609 ' HB2' HD11 ' A' ' 23' ' ' ILE . 0.0 OUTLIER -107.53 141.71 38.55 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.95 0.405 . . . . 0.0 110.776 -179.889 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -84.11 131.27 34.8 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.025 -0.534 . . . . 0.0 111.668 -179.466 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -115.9 156.33 26.36 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 115.774 -0.648 . . . . 0.0 111.089 179.907 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . 0.663 ' NZ ' ' HB2' ' A' ' 24' ' ' GLN . 0.1 OUTLIER . . . . . 0 C--O 1.249 1.051 0 CA-C-O 118.412 -0.804 . . . . 0.0 111.005 -179.792 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 6.3 t-80 . . . . . 0 C--O 1.232 0.151 0 CA-C-O 120.846 0.355 . . . . 0.0 110.853 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 6.1 t80 -62.51 169.73 2.83 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.986 179.847 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 1.7 m120 -76.01 86.46 2.92 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.083 0.468 . . . . 0.0 110.764 179.89 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -114.93 -74.58 0.61 Allowed 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.652 -0.704 . . . . 0.0 110.441 179.862 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 7.3 p -54.23 -15.34 1.08 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 115.67 -0.695 . . . . 0.0 111.05 179.467 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -44.18 -57.12 3.61 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-N 115.901 -0.59 . . . . 0.0 111.386 -179.932 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 1.2 m -99.81 -27.81 13.44 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.872 179.986 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 147.23 53.09 0.02 OUTLIER Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.78 -0.724 . . . . 0.0 112.432 -179.926 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -121.53 166.86 14.32 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.849 -0.691 . . . . 0.0 112.386 -179.973 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 1.9 tp60 -147.96 151.63 36.14 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.742 0.306 . . . . 0.0 110.398 179.86 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 12' ' ' CYS . . . . . 0.413 ' HB3' ' HB3' ' A' ' 27' ' ' CYS . 1.6 m -65.58 120.91 13.77 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.865 0.364 . . . . 0.0 111.093 -179.742 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . 0.514 ' HB3' ' O ' ' A' ' 15' ' ' SER . 0.4 OUTLIER -99.74 109.85 22.27 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.934 -0.576 . . . . 0.0 110.478 179.752 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 5.2 m-85 -52.89 -19.96 2.96 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.015 -0.539 . . . . 0.0 111.096 -179.893 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 15' ' ' SER . . . . . 0.514 ' O ' ' HB3' ' A' ' 13' ' ' LEU . 0.7 OUTLIER -133.19 169.94 16.15 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.16 179.368 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -50.75 142.67 10.94 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.568 -0.287 . . . . 0.0 110.743 179.852 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -44.97 126.35 5.33 Favored Pre-proline 0 C--N 1.331 -0.203 0 CA-C-N 116.132 -0.485 . . . . 0.0 111.237 -179.571 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 59.1 Cg_endo -90.05 -72.67 0.0 OUTLIER 'Trans proline' 0 N--CA 1.456 -0.724 0 C-N-CA 122.978 2.452 . . . . 0.0 112.74 -179.554 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 19' ' ' ILE . . . . . 0.763 HG13 ' H ' ' A' ' 20' ' ' PHE . 5.2 tp -56.02 -172.92 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.533 0.292 0 CA-C-N 116.344 -0.389 . . . . 0.0 111.501 -179.86 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 20' ' ' PHE . . . . . 0.763 ' H ' HG13 ' A' ' 19' ' ' ILE . 8.1 p90 -74.47 33.13 0.09 Allowed 'General case' 0 C--N 1.331 -0.205 0 N-CA-C 111.693 0.257 . . . . 0.0 111.693 -179.765 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 21' ' ' THR . . . . . 0.449 ' H ' ' C ' ' A' ' 19' ' ' ILE . 0.6 OUTLIER -81.17 -150.78 0.08 Allowed 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.582 -0.281 . . . . 0.0 110.617 179.447 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . 0.706 ' HG3' HE22 ' A' ' 24' ' ' GLN . 2.6 tptp -167.11 108.71 0.65 Allowed 'General case' 0 C--N 1.332 -0.158 0 CA-C-O 120.798 0.333 . . . . 0.0 110.954 179.991 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 23' ' ' ILE . . . . . 0.683 HG13 ' HE2' ' A' ' 33' ' ' LYS . 0.0 OUTLIER -68.27 138.65 22.11 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.614 179.665 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 24' ' ' GLN . . . . . 0.706 HE22 ' HG3' ' A' ' 22' ' ' LYS . 0.0 OUTLIER -108.94 -69.93 0.83 Allowed 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.842 -179.984 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -131.51 -146.74 5.84 Favored Glycine 0 N--CA 1.451 -0.34 0 CA-C-N 115.689 -0.687 . . . . 0.0 112.159 179.995 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 26' ' ' THR . . . . . 0.613 ' HA ' ' HA ' ' A' ' 33' ' ' LYS . 9.6 p -113.96 147.93 37.75 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 121.012 0.434 . . . . 0.0 111.338 -179.942 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 27' ' ' CYS . . . . . 0.413 ' HB3' ' HB3' ' A' ' 12' ' ' CYS . 51.7 t -94.15 -92.8 0.18 Allowed 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.705 -0.68 . . . . 0.0 111.016 -179.779 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 16.7 m-85 -61.4 -156.29 0.01 OUTLIER 'General case' 0 CA--C 1.53 0.193 0 CA-C-N 115.978 -0.555 . . . . 0.0 111.604 -179.858 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 3.4 mmm-85 -50.59 -43.94 56.71 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 115.978 -0.556 . . . . 0.0 111.364 -179.896 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 161.31 26.68 0.02 OUTLIER Glycine 0 N--CA 1.453 -0.217 0 C-N-CA 120.691 -0.766 . . . . 0.0 112.679 179.992 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -105.26 -15.16 15.13 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.887 0.375 . . . . 0.0 110.694 179.911 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -140.84 126.69 19.26 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.737 -179.993 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . 0.683 ' HE2' HG13 ' A' ' 23' ' ' ILE . 0.0 OUTLIER -93.03 132.04 37.49 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.779 0.324 . . . . 0.0 110.778 179.877 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -55.72 120.16 6.87 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.715 179.82 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 35' ' ' CYS . . . . . 0.512 ' SG ' ' HB ' ' A' ' 23' ' ' ILE . 0.9 OUTLIER -122.2 141.74 51.15 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.017 -179.672 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . 0.458 ' N ' ' HZ1' ' A' ' 36' ' ' LYS . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.028 0 CA-C-O 118.223 -0.894 . . . . 0.0 110.901 179.844 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 13.9 t-80 . . . . . 0 C--O 1.232 0.144 0 CA-C-O 120.824 0.345 . . . . 0.0 111.09 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 21.0 t80 -65.01 161.53 18.53 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.655 179.572 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -60.75 100.02 0.1 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.347 0.594 . . . . 0.0 110.153 179.509 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 5' ' ' CYS . . . . . 0.714 ' HA ' ' HG2' ' A' ' 36' ' ' LYS . 0.1 OUTLIER -130.34 -82.42 0.54 Allowed 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.545 -0.752 . . . . 0.0 109.918 -179.712 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 7.1 p -54.49 -15.26 1.13 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.183 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.702 178.872 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -44.75 -47.09 10.77 Favored 'General case' 0 C--N 1.333 -0.14 0 CA-C-N 115.669 -0.696 . . . . 0.0 111.519 -179.91 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 3.3 p -114.12 -3.11 13.29 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.288 -0.415 . . . . 0.0 111.11 -179.847 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 124.38 38.23 0.53 Allowed Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 120.678 -0.772 . . . . 0.0 112.617 179.947 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -102.54 169.99 19.88 Favored Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.802 -0.714 . . . . 0.0 112.333 179.925 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -150.34 144.84 25.76 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.866 0.365 . . . . 0.0 110.928 179.9 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 12' ' ' CYS . . . . . 0.434 ' HB3' ' HB2' ' A' ' 27' ' ' CYS . 0.0 OUTLIER -92.47 136.05 33.54 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.006 179.866 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 1.9 mp -131.51 162.67 29.72 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.847 -179.885 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 59.3 m-85 -79.73 -45.19 19.35 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.944 -179.993 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -89.21 171.67 9.63 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.13 -179.861 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -55.21 152.53 8.01 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.079 -0.509 . . . . 0.0 111.459 179.994 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . 0.401 ' HA ' ' HD3' ' A' ' 18' ' ' PRO . 0.1 OUTLIER -45.36 127.05 6.02 Favored Pre-proline 0 C--N 1.329 -0.289 0 CA-C-N 115.603 -0.726 . . . . 0.0 111.373 -179.988 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . 0.401 ' HD3' ' HA ' ' A' ' 17' ' ' CYS . 57.1 Cg_endo -89.18 -78.62 0.0 OUTLIER 'Trans proline' 0 N--CA 1.456 -0.721 0 C-N-CA 122.758 2.305 . . . . 0.0 112.589 -179.953 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 19' ' ' ILE . . . . . 0.763 HG13 ' H ' ' A' ' 20' ' ' PHE . 5.4 tp -56.45 -171.93 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.535 0.371 0 CA-C-N 116.496 -0.32 . . . . 0.0 111.732 -179.793 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 20' ' ' PHE . . . . . 0.763 ' H ' HG13 ' A' ' 19' ' ' ILE . 2.1 p90 -69.77 19.8 0.04 OUTLIER 'General case' 0 N--CA 1.463 0.222 0 N-CA-C 112.314 0.487 . . . . 0.0 112.314 -179.315 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 21' ' ' THR . . . . . 0.491 ' H ' ' C ' ' A' ' 19' ' ' ILE . 0.6 OUTLIER -73.25 -159.63 0.07 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.567 0.222 . . . . 0.0 110.651 179.473 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . 0.446 ' H ' ' HB ' ' A' ' 21' ' ' THR . 8.8 tptp -160.63 117.82 2.42 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.931 0.396 . . . . 0.0 111.421 -179.948 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 23' ' ' ILE . . . . . 0.556 HD12 ' HG2' ' A' ' 33' ' ' LYS . 0.6 OUTLIER -73.04 131.0 35.51 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.606 179.31 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 24' ' ' GLN . . . . . 0.864 ' HB2' ' HE2' ' A' ' 36' ' ' LYS . 1.7 tp-100 -113.31 -68.63 0.91 Allowed 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.618 179.915 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -126.54 -138.46 4.82 Favored Glycine 0 N--CA 1.45 -0.428 0 C-N-CA 120.847 -0.692 . . . . 0.0 112.074 179.697 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 26' ' ' THR . . . . . 0.651 ' HA ' ' HA ' ' A' ' 33' ' ' LYS . 3.1 p -125.3 146.61 49.48 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 120.932 0.396 . . . . 0.0 111.17 179.93 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 27' ' ' CYS . . . . . 0.434 ' HB2' ' HB3' ' A' ' 12' ' ' CYS . 0.0 OUTLIER -86.44 -81.88 0.21 Allowed 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.808 -0.633 . . . . 0.0 111.169 -179.717 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 24.0 m-85 -61.02 -165.27 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.905 -0.589 . . . . 0.0 111.887 -179.598 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -50.52 -34.48 25.44 Favored 'General case' 0 C--N 1.333 -0.152 0 CA-C-N 115.87 -0.605 . . . . 0.0 111.419 -179.929 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 153.91 41.37 0.02 OUTLIER Glycine 0 N--CA 1.452 -0.235 0 C-N-CA 120.726 -0.75 . . . . 0.0 112.491 -179.915 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 15.2 mttm -116.76 -23.53 8.09 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.841 0.353 . . . . 0.0 110.88 179.923 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -136.33 145.67 45.72 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.911 179.952 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . 0.651 ' HA ' ' HA ' ' A' ' 26' ' ' THR . 0.0 OUTLIER -98.26 138.95 34.78 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.918 -179.875 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -78.07 138.29 38.69 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.753 179.958 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 35' ' ' CYS . . . . . 0.417 ' SG ' ' NZ ' ' A' ' 33' ' ' LYS . 1.2 m -125.88 131.5 52.35 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.965 -179.839 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . 0.864 ' HE2' ' HB2' ' A' ' 24' ' ' GLN . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.054 0 CA-C-O 118.247 -0.882 . . . . 0.0 110.919 179.908 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 5.1 m-20 . . . . . 0 N--CA 1.487 1.385 0 CA-C-O 120.864 0.364 . . . . 0.0 111.246 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 6.7 t-80 -60.06 108.05 0.72 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.997 -0.547 . . . . 0.0 111.089 -179.879 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 5.2 t80 -63.48 158.66 20.33 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.501 179.573 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -66.57 86.08 0.11 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.079 0.466 . . . . 0.0 110.547 179.813 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -106.86 -74.32 0.66 Allowed 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.616 -0.72 . . . . 0.0 110.867 -179.709 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . 0.453 ' HA ' ' H ' ' A' ' 10' ' ' GLY . 12.7 p -53.64 -25.22 11.03 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.228 0 CA-C-N 115.987 -0.551 . . . . 0.0 111.157 179.914 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -45.37 -53.37 8.69 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.835 -0.62 . . . . 0.0 111.34 179.992 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 58.6 m -95.68 -31.24 13.34 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.984 -179.925 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 147.26 54.63 0.02 OUTLIER Glycine 0 N--CA 1.452 -0.276 0 C-N-CA 120.865 -0.683 . . . . 0.0 112.404 179.989 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . 0.453 ' H ' ' HA ' ' A' ' 6' ' ' VAL . . . -123.89 174.32 16.77 Favored Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.714 -0.755 . . . . 0.0 112.632 -179.919 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 7.3 tt0 -150.02 156.39 41.6 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.87 0.367 . . . . 0.0 110.918 -179.946 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . 0.402 ' HB3' ' HB2' ' A' ' 27' ' ' CYS . 0.8 OUTLIER -98.02 131.06 44.77 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.041 -0.527 . . . . 0.0 111.031 -179.937 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -134.85 134.75 41.09 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.871 179.982 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 40.3 m-85 -59.15 -28.66 66.79 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.119 -179.973 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 47.1 m -107.25 169.45 8.56 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.152 -179.804 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -52.64 154.28 2.74 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 115.984 -0.553 . . . . 0.0 111.464 -179.986 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . 0.627 ' SG ' ' HE3' ' A' ' 33' ' ' LYS . 85.3 m -45.33 134.04 5.73 Favored Pre-proline 0 C--N 1.328 -0.347 0 CA-C-N 115.437 -0.802 . . . . 0.0 111.633 -179.748 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . 0.526 ' HG2' ' H ' ' A' ' 19' ' ' ILE . 69.7 Cg_endo -77.06 -78.94 0.01 OUTLIER 'Trans proline' 0 C--N 1.347 0.464 0 C-N-CA 122.501 2.134 . . . . 0.0 111.81 179.444 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' ILE . . . . . 0.526 ' H ' ' HG2' ' A' ' 18' ' ' PRO . 2.0 tt -56.63 -172.1 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.534 0.334 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.126 179.351 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' PHE . . . . . 0.402 ' H ' ' CG1' ' A' ' 19' ' ' ILE . 0.3 OUTLIER -77.94 41.41 0.35 Allowed 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.728 0.299 . . . . 0.0 111.471 -179.926 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' THR . . . . . 0.617 ' HB ' ' SG ' ' A' ' 35' ' ' CYS . 0.4 OUTLIER -89.97 -165.81 1.44 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.471 -0.331 . . . . 0.0 110.905 179.799 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . 0.524 ' O ' ' HG2' ' A' ' 22' ' ' LYS . 0.0 OUTLIER -150.13 128.54 12.17 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-O 120.985 0.421 . . . . 0.0 110.719 179.504 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' ILE . . . . . 0.549 HG13 ' HB2' ' A' ' 33' ' ' LYS . 0.1 OUTLIER -78.06 124.45 36.46 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.908 -179.447 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' GLN . . . . . 0.57 ' HB2' ' HE2' ' A' ' 36' ' ' LYS . 3.1 mt-30 -93.8 -57.68 2.48 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.91 179.989 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -136.1 -148.62 5.59 Favored Glycine 0 N--CA 1.452 -0.287 0 C-N-CA 120.919 -0.658 . . . . 0.0 112.486 -179.984 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -118.96 147.25 44.26 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.962 0.41 . . . . 0.0 111.241 -179.997 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' CYS . . . . . 0.418 ' HB3' ' H ' ' A' ' 28' ' ' TYR . 9.5 t -83.87 -95.39 0.06 Allowed 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.746 -0.661 . . . . 0.0 110.953 -179.768 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' TYR . . . . . 0.418 ' H ' ' HB3' ' A' ' 27' ' ' CYS . 14.9 m-85 -61.51 -156.61 0.01 OUTLIER 'General case' 0 CA--C 1.53 0.176 0 CA-C-O 120.985 0.422 . . . . 0.0 111.474 179.984 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 1.9 mtp180 -50.06 -35.36 24.84 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-N 116.053 -0.521 . . . . 0.0 111.109 179.983 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 155.64 17.39 0.04 OUTLIER Glycine 0 N--CA 1.452 -0.289 0 C-N-CA 120.727 -0.749 . . . . 0.0 112.5 179.925 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 18.6 tttt -89.67 -24.21 21.66 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.91 0.386 . . . . 0.0 110.531 179.83 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -130.27 144.92 51.66 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.96 -0.564 . . . . 0.0 111.009 179.897 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . 0.627 ' HE3' ' SG ' ' A' ' 17' ' ' CYS . 0.0 OUTLIER -102.24 139.66 37.55 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.787 -179.992 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -81.72 125.51 30.7 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.657 179.861 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' CYS . . . . . 0.617 ' SG ' ' HB ' ' A' ' 21' ' ' THR . 4.6 t -127.49 151.53 48.74 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.355 -179.684 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . 0.57 ' HE2' ' HB2' ' A' ' 24' ' ' GLN . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.071 0 CA-C-O 118.253 -0.879 . . . . 0.0 110.799 179.953 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 1.7 t70 . . . . . 0 N--CA 1.486 1.345 0 CA-C-O 120.792 0.33 . . . . 0.0 111.08 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 6.5 t-80 -60.13 109.42 0.97 Allowed 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.853 179.971 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 9.0 t80 -54.96 162.14 1.39 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.731 179.732 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 1.2 m120 -72.42 80.49 1.04 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.206 0.527 . . . . 0.0 110.543 179.836 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 3.0 m -98.3 -70.0 0.74 Allowed 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.398 -0.819 . . . . 0.0 110.525 -179.916 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 2.0 p -54.85 -13.52 0.83 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-N 116.081 -0.509 . . . . 0.0 111.153 179.176 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 1.2 t -41.88 -51.7 4.24 Favored 'General case' 0 N--CA 1.462 0.153 0 CA-C-N 115.865 -0.607 . . . . 0.0 111.488 -179.717 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 1.3 m -105.79 -10.0 16.94 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.782 179.951 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 125.53 39.03 0.45 Allowed Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.874 -0.679 . . . . 0.0 112.399 -179.964 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -82.68 170.31 49.96 Favored Glycine 0 N--CA 1.452 -0.294 0 C-N-CA 120.806 -0.711 . . . . 0.0 112.466 -179.998 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -143.5 153.93 43.12 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.817 0.342 . . . . 0.0 110.959 179.968 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 1.9 m -110.13 137.08 48.37 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.947 -179.991 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -136.96 152.13 49.81 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.88 179.996 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 62.9 m-85 -75.6 -14.32 60.37 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.226 -179.797 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 1.9 p -120.61 169.94 9.89 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.977 -179.893 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -51.63 145.55 8.97 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.105 179.948 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER -45.49 142.04 3.49 Favored Pre-proline 0 C--N 1.329 -0.305 0 CA-C-N 115.752 -0.658 . . . . 0.0 111.674 -179.621 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 55.4 Cg_endo -91.01 -75.39 0.0 OUTLIER 'Trans proline' 0 N--CA 1.456 -0.734 0 C-N-CA 123.115 2.543 . . . . 0.0 113.023 -179.686 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 2.4 tt -56.02 -176.47 0.02 OUTLIER 'Isoleucine or valine' 0 CA--C 1.535 0.382 0 CA-C-O 120.848 0.356 . . . . 0.0 111.903 -179.496 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 4.0 p90 -74.88 32.15 0.09 Allowed 'General case' 0 CA--C 1.532 0.259 0 N-CA-C 112.616 0.599 . . . . 0.0 112.616 -178.85 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -78.86 -152.82 0.06 Allowed 'General case' 0 C--N 1.331 -0.227 0 C-N-CA 121.136 -0.226 . . . . 0.0 110.46 179.273 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 17.0 tttp -165.17 94.07 0.63 Allowed 'General case' 0 C--N 1.333 -0.126 0 C-N-CA 120.711 -0.395 . . . . 0.0 111.661 -179.919 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' ILE . . . . . 0.518 ' HB ' ' CE ' ' A' ' 33' ' ' LYS . 0.2 OUTLIER -49.14 131.83 7.1 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.576 179.252 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' GLN . . . . . 0.445 ' NE2' ' NZ ' ' A' ' 36' ' ' LYS . 0.0 OUTLIER -120.54 0.77 10.55 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.467 -0.333 . . . . 0.0 111.715 -179.426 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 176.44 -145.67 7.59 Favored Glycine 0 N--CA 1.451 -0.343 0 C-N-CA 120.428 -0.891 . . . . 0.0 112.889 180.0 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' THR . . . . . 0.497 ' HA ' ' HA ' ' A' ' 33' ' ' LYS . 1.2 p -127.01 149.45 49.89 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.06 0.457 . . . . 0.0 111.303 -179.749 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' CYS . . . . . 0.403 ' HB3' ' H ' ' A' ' 28' ' ' TYR . 8.5 t -89.64 -85.48 0.21 Allowed 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.672 -0.694 . . . . 0.0 111.146 -179.737 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' TYR . . . . . 0.403 ' H ' ' HB3' ' A' ' 27' ' ' CYS . 8.5 m-85 -61.37 -158.23 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.564 -179.641 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 81.8 mtt180 -48.56 -38.39 20.41 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-N 116.018 -0.537 . . . . 0.0 111.349 -179.73 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 157.54 17.5 0.04 OUTLIER Glycine 0 N--CA 1.452 -0.283 0 C-N-CA 120.725 -0.75 . . . . 0.0 112.674 179.919 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 3.0 mttt -95.62 -28.2 14.95 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.872 0.368 . . . . 0.0 110.814 179.874 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -118.13 149.66 40.67 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.121 -0.49 . . . . 0.0 111.044 -179.979 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . 0.557 ' HZ3' ' HB2' ' A' ' 35' ' ' CYS . 0.0 OUTLIER -97.44 145.52 26.11 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.892 -0.594 . . . . 0.0 110.883 -179.992 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -97.65 119.88 37.02 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.944 179.9 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' CYS . . . . . 0.557 ' HB2' ' HZ3' ' A' ' 33' ' ' LYS . 0.0 OUTLIER -114.55 160.94 18.69 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.728 -0.669 . . . . 0.0 111.261 -179.615 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . 0.458 ' NZ ' ' N ' ' A' ' 36' ' ' LYS . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.051 0 CA-C-O 118.271 -0.871 . . . . 0.0 111.001 -179.996 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 . . . . . 0 N--CA 1.486 1.355 0 CA-C-O 120.799 0.333 . . . . 0.0 111.183 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -60.31 125.5 23.93 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.568 179.9 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' TYR . . . . . 0.427 ' HB3' ' SG ' ' A' ' 34' ' ' CYS . 1.4 t80 -56.52 145.44 28.01 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.882 -179.794 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 4.1 m120 -66.11 84.36 0.09 Allowed 'General case' 0 N--CA 1.45 -0.457 0 CA-C-O 121.135 0.493 . . . . 0.0 110.905 -179.995 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -102.26 -69.21 0.79 Allowed 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.579 -0.737 . . . . 0.0 110.776 -179.838 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 10.3 p -53.73 -21.27 4.68 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 115.777 -0.647 . . . . 0.0 111.282 179.893 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 22.5 p -45.32 -37.58 4.97 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-N 115.928 -0.578 . . . . 0.0 111.255 -179.939 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 2.8 m -112.03 -20.55 11.92 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.9 -179.949 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 118.01 49.15 0.38 Allowed Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.838 -0.696 . . . . 0.0 112.512 179.998 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -101.99 -173.24 27.71 Favored Glycine 0 N--CA 1.451 -0.301 0 C-N-CA 120.679 -0.772 . . . . 0.0 112.497 -179.999 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -149.46 137.52 20.52 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.694 0.283 . . . . 0.0 110.567 179.885 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . 0.543 ' HA ' ' O ' ' A' ' 33' ' ' LYS . 0.0 OUTLIER -89.58 110.68 21.52 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.001 0.429 . . . . 0.0 111.533 -179.63 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 1.6 mp -105.11 122.12 45.22 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.789 -0.641 . . . . 0.0 110.1 179.249 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' TYR . . . . . 0.785 ' HA ' ' HA ' ' A' ' 32' ' ' ALA . 31.9 m-85 -49.68 -33.32 15.4 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.07 -179.443 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 34.2 t -99.01 166.91 11.05 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.387 179.338 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -52.94 141.06 22.99 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.449 -0.341 . . . . 0.0 110.718 179.851 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . 0.513 ' SG ' ' HB ' ' A' ' 23' ' ' ILE . 39.5 m -45.5 132.01 6.22 Favored Pre-proline 0 C--N 1.33 -0.26 0 CA-C-N 116.063 -0.517 . . . . 0.0 111.914 -179.416 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . 0.456 ' HG2' ' H ' ' A' ' 19' ' ' ILE . 68.6 Cg_endo -81.49 -70.04 0.01 OUTLIER 'Trans proline' 0 N--CA 1.459 -0.503 0 C-N-CA 122.691 2.261 . . . . 0.0 112.261 179.624 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' ILE . . . . . 0.472 HG21 ' OG1' ' A' ' 21' ' ' THR . 0.3 OUTLIER -56.59 -173.24 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.534 0.334 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.639 179.759 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' PHE . . . . . 0.46 ' H ' HG13 ' A' ' 19' ' ' ILE . 27.9 p90 -74.51 25.91 0.08 Allowed 'General case' 0 C--N 1.331 -0.213 0 N-CA-C 112.073 0.397 . . . . 0.0 112.073 -179.626 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' THR . . . . . 0.562 ' HB ' ' SG ' ' A' ' 35' ' ' CYS . 0.9 OUTLIER -76.74 -163.04 0.3 Allowed 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 120.518 0.199 . . . . 0.0 110.763 179.711 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . 0.426 ' H ' ' HB ' ' A' ' 21' ' ' THR . 8.9 tttt -163.6 108.23 1.04 Allowed 'General case' 0 C--O 1.231 0.132 0 CA-C-O 120.843 0.354 . . . . 0.0 110.844 -179.97 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' ILE . . . . . 0.86 HG13 ' HB3' ' A' ' 33' ' ' LYS . 0.0 OUTLIER -68.93 139.57 20.29 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 CA-C-O 121.076 0.465 . . . . 0.0 110.755 179.891 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' GLN . . . . . 0.84 ' HB2' ' HE3' ' A' ' 36' ' ' LYS . 0.4 OUTLIER -105.19 -44.95 4.63 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.727 -0.67 . . . . 0.0 110.568 179.23 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -151.88 -149.48 5.1 Favored Glycine 0 N--CA 1.452 -0.292 0 C-N-CA 120.989 -0.624 . . . . 0.0 112.251 179.917 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -110.54 148.34 32.33 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.053 0.454 . . . . 0.0 111.277 -179.931 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' CYS . . . . . 0.449 ' HB2' ' HB3' ' A' ' 12' ' ' CYS . 0.0 OUTLIER -83.44 -91.3 0.08 Allowed 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.741 -0.663 . . . . 0.0 111.133 -179.694 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 29.4 m-85 -61.49 -156.18 0.01 OUTLIER 'General case' 0 CA--C 1.531 0.229 0 CA-C-N 116.066 -0.516 . . . . 0.0 111.764 -179.701 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -49.17 -39.55 29.69 Favored 'General case' 0 C--O 1.232 0.139 0 CA-C-N 115.917 -0.583 . . . . 0.0 111.314 -179.83 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 155.65 48.15 0.01 OUTLIER Glycine 0 N--CA 1.452 -0.257 0 C-N-CA 120.744 -0.741 . . . . 0.0 112.549 -179.975 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 5.9 mptt -120.04 -44.21 2.51 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.86 0.362 . . . . 0.0 110.881 179.999 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . 0.785 ' HA ' ' HA ' ' A' ' 14' ' ' TYR . . . -105.98 146.66 29.76 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.987 179.977 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . 0.86 ' HB3' HG13 ' A' ' 23' ' ' ILE . 2.7 mtpp -95.77 120.66 36.42 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.079 -179.932 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' CYS . . . . . 0.597 ' SG ' ' HE2' ' A' ' 36' ' ' LYS . 0.1 OUTLIER -69.74 111.7 5.69 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.213 179.287 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' CYS . . . . . 0.562 ' SG ' ' HB ' ' A' ' 21' ' ' THR . 3.3 t -116.16 146.93 41.89 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.233 -179.427 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . 0.84 ' HE3' ' HB2' ' A' ' 24' ' ' GLN . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.043 0 CA-C-O 118.23 -0.89 . . . . 0.0 110.887 179.827 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.486 1.34 0 CA-C-O 120.834 0.35 . . . . 0.0 111.143 . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -60.32 116.46 4.28 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.902 -179.991 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 5.2 t80 -65.55 160.17 22.98 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.594 179.852 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -68.91 85.63 0.33 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.1 0.476 . . . . 0.0 110.822 179.883 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' CYS . . . . . 0.665 ' HA ' ' HG2' ' A' ' 36' ' ' LYS . 0.0 OUTLIER -109.53 -79.05 0.58 Allowed 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.641 -0.709 . . . . 0.0 110.556 179.941 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . 0.414 HG23 ' O ' ' A' ' 6' ' ' VAL . 11.9 p -54.26 -16.82 1.56 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.188 0 CA-C-N 115.959 -0.564 . . . . 0.0 111.15 179.62 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -45.08 -53.63 7.7 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.925 -0.58 . . . . 0.0 111.342 -179.859 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 5.5 p -106.32 -5.06 19.36 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.982 179.995 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 118.37 51.14 0.32 Allowed Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.786 -0.721 . . . . 0.0 112.501 -179.964 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -96.88 -178.26 34.91 Favored Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.735 -0.745 . . . . 0.0 112.476 -179.973 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 6.1 tt0 -146.51 131.75 18.45 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.815 0.341 . . . . 0.0 110.826 179.948 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . 0.474 ' HB3' ' HB2' ' A' ' 27' ' ' CYS . 0.0 OUTLIER -102.62 131.02 49.67 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.951 -179.893 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 3.0 mt -133.03 158.15 43.46 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.006 -179.949 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 29.2 m-85 -82.41 -8.47 59.62 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.212 -179.848 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 98.7 p -117.65 169.08 9.86 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.386 -0.37 . . . . 0.0 111.085 -179.833 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -54.94 147.68 14.94 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.07 -0.513 . . . . 0.0 111.115 179.947 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . 0.425 ' HA ' ' HD3' ' A' ' 18' ' ' PRO . 0.1 OUTLIER -45.26 131.26 5.85 Favored Pre-proline 0 C--N 1.33 -0.265 0 CA-C-N 115.856 -0.611 . . . . 0.0 111.306 -179.855 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . 0.425 ' HD3' ' HA ' ' A' ' 17' ' ' CYS . 40.9 Cg_endo -90.8 -79.98 0.0 OUTLIER 'Trans proline' 0 N--CA 1.455 -0.767 0 C-N-CA 122.995 2.463 . . . . 0.0 112.64 -179.782 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' ILE . . . . . 0.564 HG21 ' OG1' ' A' ' 21' ' ' THR . 3.7 tt -56.6 -168.3 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.536 0.432 0 CA-C-N 116.376 -0.375 . . . . 0.0 111.758 -179.873 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' PHE . . . . . 0.544 ' H ' HG12 ' A' ' 19' ' ' ILE . 0.8 OUTLIER -75.69 33.97 0.12 Allowed 'General case' 0 CA--C 1.531 0.223 0 N-CA-C 112.083 0.401 . . . . 0.0 112.083 -179.492 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' THR . . . . . 0.564 ' OG1' HG21 ' A' ' 19' ' ' ILE . 0.1 OUTLIER -90.25 180.0 5.77 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.74 0.305 . . . . 0.0 110.695 179.263 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . 0.456 ' HE2' HE22 ' A' ' 24' ' ' GLN . 1.6 ptmm? -135.68 136.39 40.86 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.332 -0.394 . . . . 0.0 110.408 179.554 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' ILE . . . . . 0.472 ' HB ' ' HE3' ' A' ' 33' ' ' LYS . 0.1 OUTLIER -89.9 126.35 42.78 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.836 -179.715 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' GLN . . . . . 0.677 ' HB2' ' HE2' ' A' ' 36' ' ' LYS . 0.0 OUTLIER -104.08 -59.81 1.67 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.607 -0.724 . . . . 0.0 111.157 -179.703 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -141.45 -132.98 2.84 Favored Glycine 0 C--N 1.332 0.329 0 C-N-CA 120.673 -0.775 . . . . 0.0 112.904 -179.702 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 15.9 p -126.04 149.76 48.63 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.05 0.452 . . . . 0.0 111.234 -179.786 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' CYS . . . . . 0.474 ' HB2' ' HB3' ' A' ' 12' ' ' CYS . 0.7 OUTLIER -95.27 -78.06 0.46 Allowed 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.678 -0.692 . . . . 0.0 111.158 -179.738 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 17.6 m-85 -60.94 -164.65 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.504 -179.658 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 4.3 mtm180 -50.1 -36.97 31.76 Favored 'General case' 0 C--N 1.333 -0.143 0 CA-C-N 115.964 -0.562 . . . . 0.0 111.279 -179.936 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 153.74 43.61 0.02 OUTLIER Glycine 0 N--CA 1.452 -0.294 0 C-N-CA 120.751 -0.738 . . . . 0.0 112.556 179.949 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -122.54 -21.22 5.78 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.841 0.353 . . . . 0.0 110.947 179.967 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -127.63 143.94 51.12 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.123 -0.49 . . . . 0.0 111.036 179.992 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . 0.472 ' HE3' ' HB ' ' A' ' 23' ' ' ILE . 0.0 OUTLIER -96.1 134.66 38.89 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.877 179.998 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' CYS . . . . . 0.45 ' HB2' ' SG ' ' A' ' 27' ' ' CYS . 0.0 OUTLIER -79.16 141.49 37.18 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.139 -179.739 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' CYS . . . . . 0.416 ' SG ' ' HE3' ' A' ' 33' ' ' LYS . 0.8 OUTLIER -134.79 129.95 35.37 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.905 179.946 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . 0.677 ' HE2' ' HB2' ' A' ' 24' ' ' GLN . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.079 0 CA-C-O 118.256 -0.878 . . . . 0.0 110.874 179.942 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.486 1.371 0 CA-C-O 120.851 0.357 . . . . 0.0 111.248 . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' HIS . . . . . 0.46 ' HE2' HG21 ' A' ' 6' ' ' VAL . 1.9 t-80 -59.83 113.29 2.2 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.602 179.881 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 4.4 t80 -62.75 166.72 5.19 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.744 179.995 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' ASN . . . . . 0.439 ' ND2' ' HB2' ' A' ' 7' ' ' SER . 26.0 t-20 -81.89 78.49 8.6 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 121.409 0.623 . . . . 0.0 110.765 179.862 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 0.3 OUTLIER -106.23 -56.51 2.18 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.168 -0.924 . . . . 0.0 110.241 179.897 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . 0.46 HG21 ' HE2' ' A' ' 2' ' ' HIS . 60.9 t -54.99 -12.89 0.74 Allowed 'Isoleucine or valine' 0 CA--C 1.53 0.208 0 CA-C-N 115.754 -0.657 . . . . 0.0 111.105 179.168 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' SER . . . . . 0.439 ' HB2' ' ND2' ' A' ' 4' ' ' ASN . 6.2 t -34.38 -50.22 0.41 Allowed 'General case' 0 N--CA 1.464 0.266 0 CA-C-N 115.821 -0.627 . . . . 0.0 111.833 -179.831 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 28.2 t -107.75 -19.74 13.44 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.863 -179.96 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 136.39 34.85 0.22 Allowed Glycine 0 N--CA 1.45 -0.37 0 C-N-CA 120.828 -0.701 . . . . 0.0 112.321 -179.93 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -65.89 176.75 15.67 Favored Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.796 -0.716 . . . . 0.0 112.477 -179.995 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -144.84 142.51 29.99 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.84 0.352 . . . . 0.0 110.965 -179.967 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 3.2 m -106.18 125.24 50.76 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.079 -0.509 . . . . 0.0 110.704 179.876 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . 0.481 ' O ' ' HG3' ' A' ' 33' ' ' LYS . 3.6 mp -135.14 151.84 51.06 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.275 -0.421 . . . . 0.0 111.046 -179.842 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 11.8 m-85 -77.74 -3.96 43.89 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.881 179.942 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 15.7 t -122.3 173.85 7.36 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.007 -179.997 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -54.78 144.18 23.18 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.279 -179.987 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . 0.514 ' SG ' ' HE3' ' A' ' 33' ' ' LYS . 71.7 m -45.78 139.45 5.07 Favored Pre-proline 0 C--N 1.331 -0.228 0 CA-C-N 115.824 -0.626 . . . . 0.0 111.551 -179.792 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . 0.478 ' HG2' ' H ' ' A' ' 19' ' ' ILE . 68.1 Cg_endo -76.43 -83.3 0.0 OUTLIER 'Trans proline' 0 C--N 1.347 0.452 0 C-N-CA 122.498 2.132 . . . . 0.0 112.289 179.853 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' ILE . . . . . 0.591 HG13 ' H ' ' A' ' 20' ' ' PHE . 0.8 OUTLIER -56.53 -171.18 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.535 0.391 0 CA-C-O 120.859 0.362 . . . . 0.0 111.619 179.884 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' PHE . . . . . 0.591 ' H ' HG13 ' A' ' 19' ' ' ILE . 3.8 p90 -69.96 15.48 0.08 Allowed 'General case' 0 CA--C 1.533 0.291 0 N-CA-C 111.982 0.364 . . . . 0.0 111.982 -179.664 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' THR . . . . . 0.63 ' HB ' ' SG ' ' A' ' 35' ' ' CYS . 0.6 OUTLIER -63.15 -172.71 0.05 OUTLIER 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 120.851 0.358 . . . . 0.0 111.268 179.809 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -151.54 118.07 5.7 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.066 179.945 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' ILE . . . . . 0.496 ' H ' HG21 ' A' ' 23' ' ' ILE . 0.2 OUTLIER -64.76 120.67 12.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.735 179.99 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' GLN . . . . . 0.554 ' HB2' ' NZ ' ' A' ' 36' ' ' LYS . 0.0 OUTLIER -88.39 -28.84 20.69 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.552 179.922 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -177.47 -130.28 1.36 Allowed Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 121.026 -0.607 . . . . 0.0 112.219 179.998 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' THR . . . . . 0.616 ' HA ' ' HA ' ' A' ' 33' ' ' LYS . 0.6 OUTLIER -116.79 145.74 43.32 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.9 0.381 . . . . 0.0 111.037 179.831 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 25.5 t -94.37 -78.47 0.44 Allowed 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.839 -179.87 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' TYR . . . . . 0.5 ' HB3' ' NZ ' ' A' ' 31' ' ' LYS . 22.7 m-85 -60.12 -176.92 0.05 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.842 -0.617 . . . . 0.0 111.039 -179.979 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . 0.404 HH11 ' HD3' ' A' ' 29' ' ' ARG . 7.0 mmt-85 -50.31 -24.41 2.93 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.218 -179.988 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 153.65 32.75 0.03 OUTLIER Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.885 -0.674 . . . . 0.0 112.342 179.873 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . 0.5 ' NZ ' ' HB3' ' A' ' 28' ' ' TYR . 2.0 mttp -111.17 -35.76 5.8 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.759 0.314 . . . . 0.0 110.927 -179.968 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . 0.466 ' HB2' ' CD2' ' A' ' 28' ' ' TYR . . . -128.86 153.79 47.11 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.299 -0.41 . . . . 0.0 110.995 -179.983 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . 0.616 ' HA ' ' HA ' ' A' ' 26' ' ' THR . 0.0 OUTLIER -92.81 144.94 24.79 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.938 -179.869 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -88.36 128.18 35.5 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.456 179.86 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' CYS . . . . . 0.63 ' SG ' ' HB ' ' A' ' 21' ' ' THR . 2.5 t -130.06 150.17 51.45 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.195 -179.54 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . 0.554 ' NZ ' ' HB2' ' A' ' 24' ' ' GLN . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.044 0 CA-C-O 118.284 -0.865 . . . . 0.0 110.959 179.999 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.487 1.386 0 CA-C-O 120.699 0.285 . . . . 0.0 111.1 . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 6.8 t-80 -60.18 105.61 0.43 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.71 179.854 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 7.8 t80 -60.57 164.48 4.5 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.714 179.78 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 1.1 t30 -71.18 85.32 0.75 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.075 0.464 . . . . 0.0 110.51 179.683 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' CYS . . . . . 0.558 ' HA ' ' HG2' ' A' ' 36' ' ' LYS . 0.1 OUTLIER -102.54 -72.43 0.69 Allowed 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.686 -0.688 . . . . 0.0 110.668 -179.865 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 13.9 p -53.9 -19.74 3.32 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-N 115.973 -0.558 . . . . 0.0 111.132 179.723 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 3.3 p -45.13 -44.28 10.48 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 115.938 -0.574 . . . . 0.0 111.402 -179.972 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 3.1 p -113.89 1.06 14.63 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.974 -179.948 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 103.94 44.6 1.61 Allowed Glycine 0 N--CA 1.451 -0.334 0 C-N-CA 120.736 -0.745 . . . . 0.0 112.181 -179.846 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -85.99 -176.18 49.99 Favored Glycine 0 N--CA 1.45 -0.394 0 C-N-CA 120.795 -0.717 . . . . 0.0 112.499 -179.881 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 5.0 mp0 -147.91 150.13 33.51 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.753 0.311 . . . . 0.0 110.797 179.985 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -108.18 129.56 55.18 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.911 179.969 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . 0.561 ' HB2' ' NZ ' ' A' ' 33' ' ' LYS . 3.9 mm? -121.15 157.26 30.56 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.959 -179.847 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 60.0 m-85 -82.9 -18.91 38.51 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.78 179.852 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -126.88 -175.58 3.46 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.864 -179.946 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -51.06 140.16 16.4 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.064 -0.516 . . . . 0.0 111.14 179.915 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . 0.606 ' SG ' ' HE3' ' A' ' 33' ' ' LYS . 82.9 m -45.52 137.89 5.25 Favored Pre-proline 0 C--N 1.331 -0.21 0 CA-C-N 116.081 -0.509 . . . . 0.0 111.555 -179.782 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . 0.429 ' HD3' ' HA ' ' A' ' 17' ' ' CYS . 50.7 Cg_endo -89.75 -73.34 0.0 OUTLIER 'Trans proline' 0 N--CA 1.454 -0.796 0 C-N-CA 122.957 2.438 . . . . 0.0 112.231 179.802 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' ILE . . . . . 0.596 HG13 ' H ' ' A' ' 20' ' ' PHE . 0.7 OUTLIER -56.47 -173.45 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.534 0.338 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.456 179.738 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' PHE . . . . . 0.596 ' H ' HG13 ' A' ' 19' ' ' ILE . 2.1 p90 -78.1 40.03 0.32 Allowed 'General case' 0 C--N 1.332 -0.196 0 CA-C-N 116.563 -0.29 . . . . 0.0 111.594 -179.753 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' THR . . . . . 0.581 ' HB ' ' SG ' ' A' ' 35' ' ' CYS . 0.7 OUTLIER -89.48 -161.01 0.73 Allowed 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.567 -0.288 . . . . 0.0 110.631 179.448 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . 0.469 ' H ' ' HB ' ' A' ' 21' ' ' THR . 15.8 tttt -159.07 108.91 1.95 Allowed 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 120.721 0.296 . . . . 0.0 111.399 -179.953 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' ILE . . . . . 0.627 ' HB ' ' HE3' ' A' ' 33' ' ' LYS . 0.2 OUTLIER -60.39 126.61 18.51 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.226 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.735 179.592 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' GLN . . . . . 0.526 ' HB2' ' HE2' ' A' ' 36' ' ' LYS . 0.1 OUTLIER -111.66 -56.49 2.38 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.042 -0.527 . . . . 0.0 110.882 179.894 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -140.75 -160.96 8.5 Favored Glycine 0 N--CA 1.452 -0.29 0 C-N-CA 120.814 -0.708 . . . . 0.0 112.337 179.857 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -92.65 147.9 22.5 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.985 0.421 . . . . 0.0 111.231 179.917 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' CYS . . . . . 0.477 ' HB3' ' H ' ' A' ' 28' ' ' TYR . 0.1 OUTLIER -93.18 -92.71 0.16 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.951 -0.568 . . . . 0.0 111.002 -179.898 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' TYR . . . . . 0.477 ' H ' ' HB3' ' A' ' 27' ' ' CYS . 15.4 m-85 -61.24 -160.49 0.01 OUTLIER 'General case' 0 CA--C 1.53 0.209 0 CA-C-O 120.985 0.422 . . . . 0.0 111.46 -179.878 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 14.6 ttm-85 -50.08 -36.4 29.24 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 116.012 -0.54 . . . . 0.0 111.298 -179.905 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 154.44 34.08 0.03 OUTLIER Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.634 -0.793 . . . . 0.0 112.592 -179.974 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 31.8 mmtt -110.82 -20.58 12.42 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.924 0.392 . . . . 0.0 110.822 179.944 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -136.55 145.18 44.73 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.862 179.975 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . 0.627 ' HE3' ' HB ' ' A' ' 23' ' ' ILE . 0.1 OUTLIER -93.29 130.25 39.09 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.284 -0.416 . . . . 0.0 111.006 -179.799 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -69.27 127.67 33.89 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.547 179.679 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' CYS . . . . . 0.581 ' SG ' ' HB ' ' A' ' 21' ' ' THR . 6.8 t -131.44 132.78 44.58 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.169 -179.649 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . 0.558 ' HG2' ' HA ' ' A' ' 5' ' ' CYS . 0.0 OUTLIER . . . . . 0 C--O 1.25 1.083 0 CA-C-O 118.23 -0.891 . . . . 0.0 110.94 179.951 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.485 1.323 0 CA-C-O 120.921 0.391 . . . . 0.0 111.302 . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 9.7 t-80 -60.95 105.93 0.53 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.076 -0.511 . . . . 0.0 111.104 -179.986 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 5.6 t80 -65.09 169.47 5.41 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.824 179.76 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' ASN . . . . . 0.4 HD21 ' HG ' ' A' ' 7' ' ' SER . 1.1 m120 -74.88 81.33 2.14 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 121.181 0.515 . . . . 0.0 110.532 179.71 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 1.2 m -111.64 -64.14 1.33 Allowed 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.482 -0.781 . . . . 0.0 111.086 -179.527 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 9.4 p -54.25 -15.0 0.98 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.215 0 CA-C-N 115.942 -0.572 . . . . 0.0 111.324 179.833 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' SER . . . . . 0.4 ' HG ' HD21 ' A' ' 4' ' ' ASN . 0.2 OUTLIER -44.96 -53.31 7.81 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.914 -0.585 . . . . 0.0 111.592 -179.785 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -96.5 -22.26 17.21 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.395 -0.366 . . . . 0.0 111.072 -179.791 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 133.77 45.6 0.11 Allowed Glycine 0 N--CA 1.452 -0.275 0 C-N-CA 120.887 -0.673 . . . . 0.0 112.257 -179.957 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -99.71 174.27 26.66 Favored Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.784 -0.722 . . . . 0.0 112.731 -179.738 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 3.0 tp60 -149.29 154.43 39.01 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.778 0.323 . . . . 0.0 110.702 179.922 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . 0.456 ' HB3' ' HB2' ' A' ' 27' ' ' CYS . 0.0 OUTLIER -105.12 133.7 49.46 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.853 179.968 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 3.4 mp -135.5 157.35 47.11 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.198 -0.456 . . . . 0.0 111.155 -179.672 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 22.9 m-85 -74.6 -10.9 59.99 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.882 179.874 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -124.7 -179.7 4.62 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.687 179.992 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -54.75 144.36 22.52 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.165 179.88 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 8.1 m -45.63 142.99 3.21 Favored Pre-proline 0 C--N 1.331 -0.202 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.34 -179.876 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . 0.482 ' HG2' ' H ' ' A' ' 19' ' ' ILE . 74.4 Cg_endo -79.05 -80.7 0.0 OUTLIER 'Trans proline' 0 C--N 1.345 0.386 0 C-N-CA 122.541 2.161 . . . . 0.0 112.384 179.997 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' ILE . . . . . 0.482 ' H ' ' HG2' ' A' ' 18' ' ' PRO . 0.9 OUTLIER -56.56 -170.34 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.535 0.402 0 CA-C-N 116.493 -0.321 . . . . 0.0 111.576 179.779 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' PHE . . . . . 0.445 ' N ' HG23 ' A' ' 19' ' ' ILE . 1.3 p90 -76.0 35.56 0.13 Allowed 'General case' 0 N--CA 1.463 0.183 0 CA-C-O 120.711 0.291 . . . . 0.0 111.417 179.987 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' THR . . . . . 0.44 HG23 ' HA ' ' A' ' 36' ' ' LYS . 0.7 OUTLIER -82.09 -165.96 1.13 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.512 -0.313 . . . . 0.0 110.87 179.77 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . 0.759 ' HG3' HE22 ' A' ' 24' ' ' GLN . 0.0 OUTLIER -151.23 130.33 12.65 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.895 0.379 . . . . 0.0 110.479 179.636 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' ILE . . . . . 0.689 HG13 ' HE3' ' A' ' 33' ' ' LYS . 0.0 OUTLIER -81.27 133.12 29.97 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-N 116.158 -0.474 . . . . 0.0 111.206 -179.514 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' GLN . . . . . 0.759 HE22 ' HG3' ' A' ' 22' ' ' LYS . 0.0 OUTLIER -107.75 -66.98 0.99 Allowed 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.581 -0.736 . . . . 0.0 111.088 -179.84 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -132.04 -130.04 3.09 Favored Glycine 0 N--CA 1.452 -0.289 0 C-N-CA 120.769 -0.729 . . . . 0.0 112.56 -179.927 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' THR . . . . . 0.577 ' HA ' ' HA ' ' A' ' 33' ' ' LYS . 44.4 p -125.11 153.67 42.61 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.054 0.455 . . . . 0.0 111.502 -179.807 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' CYS . . . . . 0.456 ' HB2' ' HB3' ' A' ' 12' ' ' CYS . 0.1 OUTLIER -100.56 -84.52 0.43 Allowed 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.558 -0.747 . . . . 0.0 111.299 -179.684 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 22.6 m-85 -61.12 -160.52 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.726 -0.67 . . . . 0.0 111.861 -179.447 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 10.7 ttt85 -49.72 -34.55 19.17 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 115.786 -0.643 . . . . 0.0 111.096 -179.918 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 149.6 22.07 0.07 OUTLIER Glycine 0 N--CA 1.451 -0.357 0 C-N-CA 120.646 -0.787 . . . . 0.0 112.738 179.81 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -98.93 -10.89 22.18 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.755 0.312 . . . . 0.0 110.968 179.881 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -144.51 146.83 32.61 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.288 -0.415 . . . . 0.0 111.156 179.987 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . 0.689 ' HE3' HG13 ' A' ' 23' ' ' ILE . 0.0 OUTLIER -99.86 141.52 32.57 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.789 179.914 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -74.72 144.04 43.87 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.028 -0.533 . . . . 0.0 111.718 -179.404 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' CYS . . . . . 0.469 ' SG ' ' HE2' ' A' ' 33' ' ' LYS . 84.7 m -134.98 143.89 47.09 Favored 'General case' 0 C--N 1.332 -0.154 0 CA-C-N 115.806 -0.634 . . . . 0.0 110.55 179.59 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . 0.643 ' HE2' HE21 ' A' ' 24' ' ' GLN . 0.0 OUTLIER . . . . . 0 C--O 1.248 1.017 0 CA-C-O 118.252 -0.88 . . . . 0.0 111.081 179.962 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 74.7 m-20 . . . . . 0 N--CA 1.486 1.338 0 CA-C-O 120.805 0.336 . . . . 0.0 111.154 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 11.5 t-160 -60.24 96.08 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.059 -0.518 . . . . 0.0 110.943 179.986 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 9.7 t80 -57.51 172.66 0.33 Allowed 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.047 179.946 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 5.1 m120 -77.3 76.91 3.84 Favored 'General case' 0 N--CA 1.448 -0.541 0 CA-C-O 121.248 0.547 . . . . 0.0 110.577 179.778 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -110.08 -64.69 1.23 Allowed 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.384 -0.825 . . . . 0.0 110.392 179.788 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -54.59 -16.84 1.73 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.177 0 CA-C-N 115.915 -0.584 . . . . 0.0 111.1 179.47 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 40.0 t -45.5 -40.46 8.5 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 115.846 -0.615 . . . . 0.0 111.212 -179.984 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -115.16 -0.77 13.17 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.777 179.957 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 113.07 34.7 1.77 Allowed Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 120.798 -0.715 . . . . 0.0 112.551 179.877 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -86.22 170.85 43.51 Favored Glycine 0 N--CA 1.451 -0.359 0 C-N-CA 120.809 -0.71 . . . . 0.0 112.559 -179.946 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -150.12 156.48 41.72 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.823 0.344 . . . . 0.0 110.854 179.977 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 0.2 OUTLIER -75.77 117.02 17.08 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.232 -179.88 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . 0.54 ' HG ' ' HD3' ' A' ' 18' ' ' PRO . 1.5 mm? -102.92 105.9 16.35 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.231 179.238 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 7.3 m-85 -50.82 -20.56 1.33 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.361 -179.714 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -125.55 176.11 7.08 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.805 179.827 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -52.52 146.29 10.13 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.108 -0.496 . . . . 0.0 111.047 179.912 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -45.2 122.07 5.02 Favored Pre-proline 0 C--N 1.33 -0.239 0 CA-C-N 115.939 -0.573 . . . . 0.0 111.255 -179.765 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . 0.54 ' HD3' ' HG ' ' A' ' 13' ' ' LEU . 58.2 Cg_endo -88.43 -72.5 0.0 OUTLIER 'Trans proline' 0 N--CA 1.456 -0.732 0 C-N-CA 122.788 2.326 . . . . 0.0 112.524 -179.829 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' ILE . . . . . 0.667 HG12 ' H ' ' A' ' 20' ' ' PHE . 9.0 tt -55.92 -176.01 0.02 OUTLIER 'Isoleucine or valine' 0 CA--C 1.533 0.306 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.457 179.967 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' PHE . . . . . 0.667 ' H ' HG12 ' A' ' 19' ' ' ILE . 0.6 OUTLIER -76.62 32.17 0.13 Allowed 'General case' 0 C--N 1.33 -0.249 0 N-CA-C 112.032 0.382 . . . . 0.0 112.032 -179.391 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' THR . . . . . 0.507 ' HB ' ' H ' ' A' ' 22' ' ' LYS . 0.9 OUTLIER -83.37 -154.3 0.15 Allowed 'General case' 0 C--N 1.332 -0.161 0 CA-C-O 120.575 0.226 . . . . 0.0 110.693 179.322 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . 0.507 ' H ' ' HB ' ' A' ' 21' ' ' THR . 0.1 OUTLIER -158.01 105.58 1.96 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.546 -0.297 . . . . 0.0 110.675 179.694 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' ILE . . . . . 0.559 ' HB ' ' SG ' ' A' ' 35' ' ' CYS . 0.0 OUTLIER -64.75 137.78 24.33 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.238 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.737 -179.999 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -112.77 -69.84 0.84 Allowed 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.72 179.822 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -127.68 -143.58 5.74 Favored Glycine 0 N--CA 1.45 -0.426 0 C-N-CA 120.92 -0.657 . . . . 0.0 112.487 179.986 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -115.77 143.65 45.09 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.042 0.449 . . . . 0.0 111.429 -179.845 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' CYS . . . . . 0.48 ' HB3' ' H ' ' A' ' 28' ' ' TYR . 2.1 t -81.89 -88.39 0.08 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.805 -0.634 . . . . 0.0 110.629 179.835 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' TYR . . . . . 0.48 ' H ' ' HB3' ' A' ' 27' ' ' CYS . 15.7 m-85 -62.12 -153.41 0.01 OUTLIER 'General case' 0 CA--C 1.532 0.262 0 CA-C-N 116.076 -0.511 . . . . 0.0 111.459 179.824 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -50.17 -35.86 27.95 Favored 'General case' 0 C--N 1.333 -0.119 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.577 -179.766 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 149.5 28.27 0.06 OUTLIER Glycine 0 N--CA 1.452 -0.295 0 C-N-CA 120.585 -0.817 . . . . 0.0 112.699 -179.943 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 1.6 mttp -102.12 -26.31 13.41 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.928 0.394 . . . . 0.0 110.607 179.871 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -122.75 139.74 53.65 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.922 179.943 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . 0.532 ' HE2' HD11 ' A' ' 23' ' ' ILE . 14.5 mtpt -92.59 120.86 33.44 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.363 -0.38 . . . . 0.0 110.743 179.918 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -64.13 111.71 2.68 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.01 -0.541 . . . . 0.0 111.033 -179.822 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' CYS . . . . . 0.559 ' SG ' ' HB ' ' A' ' 23' ' ' ILE . 1.8 m -106.69 138.44 42.86 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.821 -179.896 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.048 0 CA-C-O 118.213 -0.899 . . . . 0.0 111.055 179.72 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 9.1 t70 . . . . . 0 N--CA 1.486 1.372 0 CA-C-O 120.846 0.355 . . . . 0.0 111.161 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -59.95 117.42 5.04 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.794 -179.939 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 2.4 t80 -64.93 156.44 31.11 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.591 179.894 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 6.4 p-10 -72.15 83.94 1.01 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 121.309 0.576 . . . . 0.0 111.324 -179.618 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -97.76 -65.21 0.98 Allowed 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.475 -0.784 . . . . 0.0 110.009 179.38 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . 0.459 HG23 ' O ' ' A' ' 6' ' ' VAL . 14.6 p -53.9 -18.4 2.23 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 115.141 -0.936 . . . . 0.0 111.389 179.676 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 6.8 t -42.19 -48.73 4.89 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 115.975 -0.557 . . . . 0.0 111.532 -179.632 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -111.84 -22.23 11.22 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.375 -0.375 . . . . 0.0 110.794 179.868 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 133.17 53.25 0.08 OUTLIER Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.934 -0.65 . . . . 0.0 112.258 -179.962 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -89.98 -178.54 44.7 Favored Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.823 -0.703 . . . . 0.0 112.69 -179.762 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -149.32 141.19 23.7 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.748 0.309 . . . . 0.0 110.649 -179.962 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -93.2 125.79 37.97 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.912 -179.936 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -123.51 155.18 38.04 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.771 179.867 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 85.8 m-85 -82.47 -31.38 29.41 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.978 -179.808 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -104.1 171.98 7.05 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.793 179.926 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -54.9 149.55 11.38 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.064 -0.517 . . . . 0.0 111.242 -179.931 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . 0.403 ' HA ' ' HD3' ' A' ' 18' ' ' PRO . 0.1 OUTLIER -45.43 123.53 5.68 Favored Pre-proline 0 C--N 1.33 -0.278 0 CA-C-N 115.692 -0.686 . . . . 0.0 111.051 179.932 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . 0.403 ' HD3' ' HA ' ' A' ' 17' ' ' CYS . 42.2 Cg_endo -90.63 -72.96 0.0 OUTLIER 'Trans proline' 0 N--CA 1.456 -0.723 0 C-N-CA 122.876 2.384 . . . . 0.0 112.864 -179.51 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' ILE . . . . . 0.671 HG13 ' H ' ' A' ' 20' ' ' PHE . 1.6 tp -56.13 -170.97 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.536 0.407 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.617 -179.728 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' PHE . . . . . 0.671 ' H ' HG13 ' A' ' 19' ' ' ILE . 4.5 p90 -71.03 23.12 0.04 OUTLIER 'General case' 0 CA--C 1.531 0.236 0 N-CA-C 112.227 0.455 . . . . 0.0 112.227 -179.347 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' THR . . . . . 0.498 ' OG1' HG22 ' A' ' 19' ' ' ILE . 0.8 OUTLIER -81.91 -165.73 1.06 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.537 0.208 . . . . 0.0 110.642 179.406 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 40.0 tttp -161.97 117.31 1.97 Allowed 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 120.876 0.369 . . . . 0.0 111.13 179.928 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' ILE . . . . . 0.425 ' HB ' ' NZ ' ' A' ' 33' ' ' LYS . 0.8 OUTLIER -67.45 135.74 27.94 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.853 179.745 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' GLN . . . . . 0.57 ' HB2' ' NZ ' ' A' ' 36' ' ' LYS . 1.7 mp0 -114.7 -42.43 3.26 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.895 -0.593 . . . . 0.0 110.826 -179.924 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -154.54 -131.32 1.49 Allowed Glycine 0 N--CA 1.451 -0.363 0 C-N-CA 120.899 -0.667 . . . . 0.0 112.371 179.922 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' THR . . . . . 0.583 ' HA ' ' HA ' ' A' ' 33' ' ' LYS . 15.6 p -122.49 141.15 51.95 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.841 0.353 . . . . 0.0 111.177 179.886 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' CYS . . . . . 0.471 ' HB3' ' H ' ' A' ' 28' ' ' TYR . 0.2 OUTLIER -82.99 -91.29 0.08 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.013 -0.54 . . . . 0.0 111.056 -179.842 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' TYR . . . . . 0.471 ' H ' ' HB3' ' A' ' 27' ' ' CYS . 23.7 m-85 -60.94 -168.02 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.166 0 CA-C-O 120.962 0.411 . . . . 0.0 111.206 -179.985 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 5.4 ttt-85 -50.39 -35.86 30.17 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 115.985 -0.552 . . . . 0.0 111.301 -179.938 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 159.66 44.39 0.02 OUTLIER Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.676 -0.773 . . . . 0.0 112.593 179.962 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 9.8 mtpt -119.73 -14.16 9.05 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.896 0.379 . . . . 0.0 110.651 179.798 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -154.35 147.27 24.48 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.668 179.858 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . 0.583 ' HA ' ' HA ' ' A' ' 26' ' ' THR . 0.0 OUTLIER -92.08 146.03 24.05 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.977 0.418 . . . . 0.0 110.937 -179.843 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 0.2 OUTLIER -77.63 135.2 38.09 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.895 -0.593 . . . . 0.0 111.091 -179.74 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 0.9 OUTLIER -136.57 128.97 30.16 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.972 179.88 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . 0.57 ' NZ ' ' HB2' ' A' ' 24' ' ' GLN . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.054 0 CA-C-O 118.245 -0.883 . . . . 0.0 110.748 179.802 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.485 1.325 0 CA-C-O 120.849 0.357 . . . . 0.0 111.032 . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 7.2 t-80 -60.04 107.32 0.61 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.709 179.847 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 2.4 t80 -63.81 167.29 6.18 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.619 179.834 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 1.4 t-20 -80.47 76.91 7.29 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.344 0.592 . . . . 0.0 110.265 179.567 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' CYS . . . . . 0.646 ' HA ' ' HD2' ' A' ' 36' ' ' LYS . 0.0 OUTLIER -101.3 -63.54 1.13 Allowed 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.085 -0.961 . . . . 0.0 110.643 -179.722 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 10.8 p -54.29 -16.91 1.6 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-N 115.827 -0.624 . . . . 0.0 111.134 179.586 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -38.03 -48.61 1.22 Allowed 'General case' 0 N--CA 1.462 0.174 0 CA-C-N 115.788 -0.642 . . . . 0.0 111.89 -179.725 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -109.28 -29.05 8.66 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.433 -0.349 . . . . 0.0 111.095 -179.916 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 142.69 45.52 0.05 OUTLIER Glycine 0 N--CA 1.452 -0.249 0 C-N-CA 120.804 -0.713 . . . . 0.0 112.428 -179.924 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -97.91 169.21 24.08 Favored Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.732 -0.747 . . . . 0.0 112.567 -179.882 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 12.7 mt-30 -143.11 148.86 37.3 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.75 0.31 . . . . 0.0 110.63 179.978 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . 0.484 ' HA ' ' O ' ' A' ' 33' ' ' LYS . 0.0 OUTLIER -103.0 125.11 49.62 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.297 -0.411 . . . . 0.0 111.222 -179.903 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -122.62 143.56 49.68 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.41 179.623 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 26.8 m-85 -60.31 -10.58 4.87 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.351 -0.386 . . . . 0.0 111.261 -179.755 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -114.07 155.69 25.5 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.788 179.613 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -54.95 157.82 3.06 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.284 179.823 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -44.91 112.08 1.42 Allowed Pre-proline 0 C--N 1.327 -0.39 0 CA-C-N 115.452 -0.794 . . . . 0.0 111.2 179.926 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 60.9 Cg_endo -87.78 -72.46 0.0 OUTLIER 'Trans proline' 0 N--CA 1.457 -0.619 0 C-N-CA 122.724 2.282 . . . . 0.0 112.664 -179.839 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' ILE . . . . . 0.549 HG12 ' H ' ' A' ' 20' ' ' PHE . 4.6 tt -56.37 -169.85 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.534 0.34 0 CA-C-N 116.321 -0.4 . . . . 0.0 111.588 -179.979 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' PHE . . . . . 0.549 ' H ' HG12 ' A' ' 19' ' ' ILE . 5.8 p90 -76.64 36.01 0.16 Allowed 'General case' 0 CA--C 1.53 0.179 0 N-CA-C 111.859 0.318 . . . . 0.0 111.859 -179.616 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' THR . . . . . 0.503 ' OG1' HG23 ' A' ' 19' ' ' ILE . 0.3 OUTLIER -88.08 -161.21 0.7 Allowed 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.662 0.268 . . . . 0.0 110.758 179.39 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . 0.456 ' H ' ' HB ' ' A' ' 21' ' ' THR . 1.4 tttm -157.58 103.1 1.91 Allowed 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.86 0.362 . . . . 0.0 111.028 -179.931 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' ILE . . . . . 0.66 HD11 ' HE2' ' A' ' 33' ' ' LYS . 1.4 tp -69.67 131.91 33.63 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.224 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.994 179.745 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' GLN . . . . . 0.497 ' HB2' ' HE3' ' A' ' 36' ' ' LYS . 18.6 mt-30 -114.29 -66.5 1.08 Allowed 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.125 179.346 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -125.52 167.07 17.99 Favored Glycine 0 N--CA 1.449 -0.478 0 CA-C-N 115.511 -0.768 . . . . 0.0 111.401 179.175 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 1.7 p -75.77 154.62 36.19 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 121.261 0.553 . . . . 0.0 111.16 -179.955 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' CYS . . . . . 0.46 ' HB2' ' HB3' ' A' ' 12' ' ' CYS . 5.4 t -84.35 -96.15 0.06 Allowed 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.317 -0.856 . . . . 0.0 111.252 -179.55 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' TYR . . . . . 0.401 ' H ' ' HB3' ' A' ' 27' ' ' CYS . 61.7 m-85 -61.65 -144.06 0.0 OUTLIER 'General case' 0 CA--C 1.534 0.349 0 CA-C-N 115.982 -0.554 . . . . 0.0 111.628 -179.796 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 7.6 mtt180 -48.16 -42.82 30.63 Favored 'General case' 0 C--O 1.232 0.133 0 CA-C-O 120.801 0.334 . . . . 0.0 111.402 -179.625 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 153.39 24.62 0.04 OUTLIER Glycine 0 N--CA 1.451 -0.363 0 C-N-CA 120.767 -0.73 . . . . 0.0 112.566 -179.94 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -99.86 -40.85 7.49 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.75 0.309 . . . . 0.0 110.932 179.953 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -97.76 139.26 33.89 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.887 179.937 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . 0.66 ' HE2' HD11 ' A' ' 23' ' ' ILE . 0.8 OUTLIER -91.63 126.53 36.74 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.914 0.388 . . . . 0.0 110.881 -179.937 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -83.08 104.39 13.24 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.911 -0.586 . . . . 0.0 111.045 179.869 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' CYS . . . . . 0.514 ' SG ' ' HB ' ' A' ' 23' ' ' ILE . 30.4 m -98.24 144.13 28.0 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.742 179.947 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . 0.646 ' HD2' ' HA ' ' A' ' 5' ' ' CYS . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.073 0 CA-C-O 118.198 -0.906 . . . . 0.0 110.872 179.753 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 . . . . . 0 N--CA 1.487 1.399 0 CA-C-O 120.864 0.364 . . . . 0.0 111.185 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 6.0 t-80 -60.15 109.22 0.92 Allowed 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.673 179.942 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 5.7 t80 -57.5 158.8 5.47 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.744 179.962 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -70.24 82.41 0.53 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.215 0.531 . . . . 0.0 110.819 -179.916 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' CYS . . . . . 0.764 ' HA ' ' HG2' ' A' ' 36' ' ' LYS . 0.1 OUTLIER -100.8 -72.96 0.66 Allowed 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.475 -0.784 . . . . 0.0 110.29 179.596 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . 0.477 ' HA ' ' H ' ' A' ' 10' ' ' GLY . 9.9 p -54.0 -17.58 1.83 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 115.621 -0.718 . . . . 0.0 111.247 179.452 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -45.03 -48.65 11.67 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-N 115.834 -0.621 . . . . 0.0 111.443 -179.895 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 55.2 p -115.18 -4.35 12.46 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.94 179.991 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 123.46 53.43 0.2 Allowed Glycine 0 N--CA 1.452 -0.284 0 C-N-CA 120.725 -0.75 . . . . 0.0 112.494 179.886 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . 0.477 ' H ' ' HA ' ' A' ' 6' ' ' VAL . . . -97.09 171.16 26.75 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.804 -0.712 . . . . 0.0 112.467 -179.972 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 6.1 tp-100 -148.6 145.93 28.02 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.806 0.336 . . . . 0.0 110.911 -179.999 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . 0.428 ' HB3' ' HB2' ' A' ' 27' ' ' CYS . 0.1 OUTLIER -100.6 110.71 22.87 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.04 -179.893 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . 0.445 ' O ' ' HG3' ' A' ' 33' ' ' LYS . 11.0 mt -119.67 147.64 44.31 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.918 179.891 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 1.4 m-85 -88.86 16.29 7.12 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.957 179.934 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' SER . . . . . 0.448 ' O ' ' HD3' ' A' ' 33' ' ' LYS . 8.5 p -139.79 158.4 44.15 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.89 179.908 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -48.79 140.66 8.3 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.381 -179.879 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . 0.402 ' HA ' ' HD3' ' A' ' 18' ' ' PRO . 0.2 OUTLIER -45.96 123.88 6.53 Favored Pre-proline 0 C--N 1.332 -0.176 0 CA-C-N 115.888 -0.596 . . . . 0.0 111.379 -179.875 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . 0.402 ' HD3' ' HA ' ' A' ' 17' ' ' CYS . 56.8 Cg_endo -89.38 -73.65 0.0 OUTLIER 'Trans proline' 0 N--CA 1.455 -0.747 0 C-N-CA 122.895 2.396 . . . . 0.0 112.69 -179.812 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' ILE . . . . . 0.662 HG12 ' H ' ' A' ' 20' ' ' PHE . 6.6 tt -56.47 -174.21 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.535 0.375 0 CA-C-N 116.492 -0.322 . . . . 0.0 111.567 -179.894 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' PHE . . . . . 0.662 ' H ' HG12 ' A' ' 19' ' ' ILE . 50.8 p90 -70.1 17.63 0.06 Allowed 'General case' 0 CA--C 1.531 0.224 0 N-CA-C 112.472 0.545 . . . . 0.0 112.472 -179.285 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' THR . . . . . 0.617 ' OG1' HG21 ' A' ' 19' ' ' ILE . 0.7 OUTLIER -74.91 -174.24 2.15 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.744 0.307 . . . . 0.0 110.683 179.417 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . 0.486 ' HG3' ' HZ1' ' A' ' 36' ' ' LYS . 10.0 ptmt -147.31 127.65 13.95 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.999 179.807 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' ILE . . . . . 0.688 ' HB ' ' HE3' ' A' ' 33' ' ' LYS . 0.2 OUTLIER -81.26 119.78 31.56 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.645 179.802 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' GLN . . . . . 0.684 ' HB2' ' HE2' ' A' ' 36' ' ' LYS . 0.9 OUTLIER -95.75 -46.72 6.47 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.763 -179.892 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -152.06 -127.13 1.28 Allowed Glycine 0 N--CA 1.45 -0.391 0 C-N-CA 120.9 -0.667 . . . . 0.0 112.226 179.838 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' THR . . . . . 0.557 ' HA ' ' HA ' ' A' ' 33' ' ' LYS . 17.0 p -131.96 138.76 48.44 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.864 0.364 . . . . 0.0 111.16 179.844 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' CYS . . . . . 0.428 ' HB2' ' HB3' ' A' ' 12' ' ' CYS . 0.1 OUTLIER -71.85 -85.09 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.903 179.995 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 8.5 m-85 -60.84 -168.46 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.193 179.916 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 10.7 tpt180 -50.22 -31.9 15.14 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.049 -0.523 . . . . 0.0 111.148 179.934 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 157.38 36.9 0.02 OUTLIER Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 120.795 -0.717 . . . . 0.0 112.58 179.98 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 1.7 mtpp -113.2 -8.63 13.53 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.804 0.335 . . . . 0.0 110.776 179.886 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -150.86 151.39 32.16 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.288 179.989 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . 0.688 ' HE3' ' HB ' ' A' ' 23' ' ' ILE . 0.0 OUTLIER -97.97 139.59 33.58 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.753 -0.658 . . . . 0.0 110.739 179.827 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 34' ' ' CYS . . . . . 0.467 ' O ' ' HA ' ' A' ' 23' ' ' ILE . 0.0 OUTLIER -87.76 134.26 33.71 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.913 179.981 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 35' ' ' CYS . . . . . 0.573 ' SG ' ' HE3' ' A' ' 33' ' ' LYS . 1.0 OUTLIER -130.94 125.73 34.22 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.169 -179.971 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . 0.764 ' HG2' ' HA ' ' A' ' 5' ' ' CYS . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.047 0 CA-C-O 118.199 -0.905 . . . . 0.0 110.75 179.661 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 N--CA 1.486 1.342 0 CA-C-O 120.827 0.346 . . . . 0.0 111.152 . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 11.7 t-80 -60.36 107.5 0.67 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.109 -179.856 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 10.4 t80 -62.87 160.89 13.74 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.742 179.642 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 6.7 t-20 -64.09 91.58 0.07 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.222 0.534 . . . . 0.0 110.213 179.623 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -119.51 -75.87 0.58 Allowed 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.485 -0.78 . . . . 0.0 109.71 179.928 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . 0.447 ' HA ' ' H ' ' A' ' 10' ' ' GLY . 8.1 p -54.68 -13.72 0.84 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.191 0 CA-C-N 115.76 -0.655 . . . . 0.0 110.688 178.794 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 41.3 t -38.58 -50.89 1.62 Allowed 'General case' 0 N--CA 1.462 0.146 0 CA-C-N 115.76 -0.654 . . . . 0.0 111.288 179.926 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -110.75 -22.95 11.32 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.903 -0.589 . . . . 0.0 110.75 179.957 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 147.88 41.23 0.04 OUTLIER Glycine 0 N--CA 1.452 -0.273 0 C-N-CA 120.736 -0.745 . . . . 0.0 112.536 179.937 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . 0.447 ' H ' ' HA ' ' A' ' 6' ' ' VAL . . . -88.53 170.54 38.78 Favored Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.821 -0.704 . . . . 0.0 112.55 179.993 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -143.74 145.76 32.65 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.787 0.327 . . . . 0.0 110.887 -179.937 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 1.9 m -95.88 134.68 38.58 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.861 179.934 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -122.75 152.22 40.82 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.849 -179.874 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 90.5 m-85 -88.39 4.54 45.92 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.696 179.833 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' SER . . . . . 0.461 ' O ' ' HD2' ' A' ' 33' ' ' LYS . 5.6 t -153.99 -176.22 5.75 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.858 179.954 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -49.8 137.49 16.24 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.048 -0.524 . . . . 0.0 111.38 -179.945 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . 0.433 ' HA ' ' HD3' ' A' ' 18' ' ' PRO . 0.1 OUTLIER -45.86 146.05 2.13 Favored Pre-proline 0 C--N 1.332 -0.183 0 CA-C-N 115.952 -0.567 . . . . 0.0 111.316 179.982 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . 0.433 ' HD3' ' HA ' ' A' ' 17' ' ' CYS . 53.0 Cg_endo -90.94 -80.37 0.0 OUTLIER 'Trans proline' 0 N--CA 1.454 -0.795 0 C-N-CA 122.969 2.446 . . . . 0.0 112.656 -179.754 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' ILE . . . . . 0.61 HG12 ' H ' ' A' ' 20' ' ' PHE . 6.1 tt -56.17 -172.38 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.534 0.346 0 CA-C-N 116.375 -0.375 . . . . 0.0 111.664 -179.866 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' PHE . . . . . 0.61 ' H ' HG12 ' A' ' 19' ' ' ILE . 0.2 OUTLIER -75.84 36.6 0.14 Allowed 'General case' 0 CA--C 1.531 0.236 0 N-CA-C 111.947 0.351 . . . . 0.0 111.947 -179.533 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' THR . . . . . 0.454 ' OG1' HG22 ' A' ' 19' ' ' ILE . 0.0 OUTLIER -85.81 -162.95 0.79 Allowed 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 120.526 0.203 . . . . 0.0 110.657 179.354 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . 0.551 ' HG3' HE22 ' A' ' 24' ' ' GLN . 2.1 pttt -155.66 122.22 5.25 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.937 0.399 . . . . 0.0 111.527 -179.907 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' ILE . . . . . 0.437 ' HB ' ' HE3' ' A' ' 33' ' ' LYS . 0.3 OUTLIER -75.66 125.72 35.6 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.47 179.434 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' GLN . . . . . 0.551 HE22 ' HG3' ' A' ' 22' ' ' LYS . 1.6 mp0 -103.48 -44.07 5.23 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.174 -0.467 . . . . 0.0 111.104 -179.739 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -146.89 -143.69 3.91 Favored Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.739 -0.743 . . . . 0.0 112.627 -179.92 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' THR . . . . . 0.769 ' HA ' ' HA ' ' A' ' 33' ' ' LYS . 0.0 OUTLIER -120.14 140.41 51.13 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.851 0.357 . . . . 0.0 111.217 -179.908 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 41.6 t -85.97 -80.5 0.23 Allowed 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.89 179.913 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 2.9 m-85 -60.27 -173.72 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.813 -0.63 . . . . 0.0 110.943 179.932 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -50.57 -28.13 8.06 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.934 179.772 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 161.76 10.42 0.04 OUTLIER Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.886 -0.673 . . . . 0.0 112.536 179.954 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -96.74 -16.01 21.09 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.754 0.312 . . . . 0.0 111.161 -179.886 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -134.93 150.45 50.4 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.828 179.912 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . 0.769 ' HA ' ' HA ' ' A' ' 26' ' ' THR . 0.0 OUTLIER -108.57 143.1 38.05 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.832 179.9 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -79.09 125.4 29.36 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.637 179.97 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -126.15 140.12 52.82 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.818 -179.896 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . 0.443 ' HE3' ' HB2' ' A' ' 24' ' ' GLN . 0.0 OUTLIER . . . . . 0 C--O 1.248 1.021 0 CA-C-O 118.22 -0.895 . . . . 0.0 110.895 179.798 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.487 1.377 0 CA-C-O 120.8 0.333 . . . . 0.0 111.224 . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 2.0 t-80 -59.98 109.25 0.91 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.844 -179.935 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 9.1 t80 -61.38 167.5 3.24 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.688 179.737 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -77.65 77.27 4.17 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.235 0.541 . . . . 0.0 110.684 179.813 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 0.4 OUTLIER -103.89 -76.29 0.6 Allowed 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.298 -0.865 . . . . 0.0 110.494 179.943 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . 0.56 ' HA ' ' H ' ' A' ' 10' ' ' GLY . 7.5 p -54.13 -17.76 2.04 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.153 0 CA-C-N 116.019 -0.537 . . . . 0.0 111.126 179.579 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -45.34 -59.04 2.89 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 115.834 -0.621 . . . . 0.0 111.552 -179.912 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 52.4 p -98.81 -20.11 17.05 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.367 -0.379 . . . . 0.0 111.245 -179.643 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 144.49 53.81 0.03 OUTLIER Glycine 0 N--CA 1.452 -0.267 0 C-N-CA 120.688 -0.768 . . . . 0.0 112.605 -179.963 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . 0.56 ' H ' ' HA ' ' A' ' 6' ' ' VAL . . . -105.02 159.79 15.53 Favored Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.78 -0.724 . . . . 0.0 112.465 179.924 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 1.2 mt-30 -125.25 153.21 43.54 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.761 0.315 . . . . 0.0 110.909 -179.926 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 3.1 m -118.59 119.7 35.28 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.086 -179.773 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -124.82 159.1 31.81 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.722 179.928 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 34.2 m-85 -88.56 -5.52 58.14 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.341 -0.39 . . . . 0.0 111.165 -179.921 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' SER . . . . . 0.511 ' HG ' ' H ' ' A' ' 16' ' ' ALA . 2.4 t -128.4 -179.3 4.95 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.372 -0.377 . . . . 0.0 110.917 -179.877 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . 0.511 ' H ' ' HG ' ' A' ' 15' ' ' SER . . . -48.84 141.64 7.25 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.087 179.966 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . 0.402 ' HA ' ' HZ1' ' A' ' 33' ' ' LYS . 0.9 OUTLIER -45.63 141.63 3.85 Favored Pre-proline 0 C--N 1.329 -0.318 0 CA-C-N 115.907 -0.588 . . . . 0.0 111.455 -179.756 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 38.9 Cg_endo -89.84 -81.59 0.0 OUTLIER 'Trans proline' 0 N--CA 1.453 -0.885 0 C-N-CA 122.91 2.407 . . . . 0.0 112.357 179.94 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' ILE . . . . . 0.701 HG13 ' H ' ' A' ' 20' ' ' PHE . 4.3 tp -56.57 -173.95 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.535 0.393 0 CA-C-N 116.406 -0.361 . . . . 0.0 111.638 179.976 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' PHE . . . . . 0.701 ' H ' HG13 ' A' ' 19' ' ' ILE . 7.5 p90 -71.62 21.36 0.05 Allowed 'General case' 0 CA--C 1.535 0.371 0 N-CA-C 112.939 0.718 . . . . 0.0 112.939 -178.876 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' THR . . . . . 0.578 ' OG1' HG21 ' A' ' 19' ' ' ILE . 0.2 OUTLIER -75.71 -172.21 1.81 Allowed 'General case' 0 N--CA 1.463 0.187 0 C-N-CA 121.051 -0.259 . . . . 0.0 110.86 179.288 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 6.4 tttp -145.94 111.59 5.53 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 120.789 0.328 . . . . 0.0 111.093 -179.749 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' ILE . . . . . 0.479 ' HB ' ' HE3' ' A' ' 33' ' ' LYS . 0.2 OUTLIER -58.72 123.97 11.91 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.189 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.009 -179.96 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -99.36 -25.6 14.42 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.84 179.923 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -178.74 -116.87 0.52 Allowed Glycine 0 N--CA 1.451 -0.358 0 C-N-CA 120.828 -0.701 . . . . 0.0 112.391 179.957 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' THR . . . . . 0.683 ' HA ' ' HA ' ' A' ' 33' ' ' LYS . 1.0 OUTLIER -133.78 143.57 48.49 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.983 0.42 . . . . 0.0 111.352 -179.961 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 10.4 t -81.9 -79.3 0.18 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.903 -0.59 . . . . 0.0 110.968 179.973 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 11.3 m-85 -61.28 -160.5 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.002 -0.545 . . . . 0.0 111.427 -179.928 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 12.0 mtm180 -50.13 -39.2 42.37 Favored 'General case' 0 C--N 1.332 -0.156 0 CA-C-N 115.997 -0.547 . . . . 0.0 111.18 -179.944 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 159.26 33.16 0.02 OUTLIER Glycine 0 N--CA 1.451 -0.328 0 C-N-CA 120.811 -0.709 . . . . 0.0 112.486 179.937 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 2.0 mmpt? -107.77 -32.08 7.78 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.894 0.378 . . . . 0.0 110.788 -179.971 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -121.3 150.67 41.07 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.013 -0.54 . . . . 0.0 110.875 179.932 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . 0.683 ' HA ' ' HA ' ' A' ' 26' ' ' THR . 0.0 OUTLIER -90.32 145.39 25.01 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.985 -179.872 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 34' ' ' CYS . . . . . 0.416 ' O ' ' HA ' ' A' ' 23' ' ' ILE . 0.0 OUTLIER -95.03 135.7 36.24 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.976 179.948 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 35' ' ' CYS . . . . . 0.572 ' SG ' ' HE3' ' A' ' 33' ' ' LYS . 1.1 m -129.26 140.27 51.51 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.046 -0.525 . . . . 0.0 110.57 179.93 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . 0.542 ' HE3' ' H ' ' A' ' 36' ' ' LYS . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.07 0 CA-C-O 118.179 -0.915 . . . . 0.0 111.063 179.844 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.486 1.354 0 CA-C-O 120.82 0.343 . . . . 0.0 111.302 . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 2.0 t-80 -59.61 109.92 1.02 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.674 179.815 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 6.5 t80 -63.89 160.51 17.44 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.752 179.897 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -71.83 82.77 0.9 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.184 0.516 . . . . 0.0 110.546 179.727 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -99.66 -67.43 0.85 Allowed 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.469 -0.787 . . . . 0.0 110.498 179.948 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 4.2 p -54.78 -15.5 1.31 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.516 179.645 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -42.63 -52.98 4.65 Favored 'General case' 0 N--CA 1.464 0.252 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.518 -179.646 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 10.7 p -101.73 -1.21 33.0 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.903 -179.904 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 112.89 30.36 2.8 Favored Glycine 0 N--CA 1.451 -0.328 0 C-N-CA 120.7 -0.762 . . . . 0.0 112.168 -179.868 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -84.49 165.01 40.31 Favored Glycine 0 N--CA 1.45 -0.388 0 C-N-CA 120.849 -0.691 . . . . 0.0 112.711 -179.869 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -146.38 142.6 28.37 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.643 0.259 . . . . 0.0 110.674 179.94 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . 0.449 ' HA ' ' O ' ' A' ' 33' ' ' LYS . 0.0 OUTLIER -97.1 122.54 40.21 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.887 0.375 . . . . 0.0 111.173 -179.868 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -117.02 147.36 42.4 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.729 179.785 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' TYR . . . . . 0.565 ' HH ' ' HG2' ' A' ' 31' ' ' LYS . 0.1 OUTLIER -51.0 -33.96 27.17 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.059 -0.519 . . . . 0.0 111.4 -179.609 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -108.65 163.26 13.41 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.793 179.957 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -52.86 155.2 2.46 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.543 179.473 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . 0.529 ' SG ' ' HB ' ' A' ' 23' ' ' ILE . 3.1 m -44.93 138.66 4.11 Favored Pre-proline 0 C--N 1.327 -0.41 0 CA-C-N 115.901 -0.591 . . . . 0.0 111.342 -179.573 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . 0.413 ' HD3' ' HA ' ' A' ' 17' ' ' CYS . 50.2 Cg_endo -88.28 -71.87 0.01 OUTLIER 'Trans proline' 0 N--CA 1.454 -0.837 0 C-N-CA 122.996 2.464 . . . . 0.0 111.801 179.62 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' ILE . . . . . 0.484 ' C ' ' H ' ' A' ' 21' ' ' THR . 1.5 tt -56.97 -168.76 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.535 0.396 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.036 179.177 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' PHE . . . . . 0.45 ' H ' ' CG1' ' A' ' 19' ' ' ILE . 2.1 p90 -73.43 23.43 0.07 Allowed 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.583 0.23 . . . . 0.0 111.538 179.917 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' THR . . . . . 0.484 ' H ' ' C ' ' A' ' 19' ' ' ILE . 0.2 OUTLIER -65.23 -169.45 0.05 OUTLIER 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 120.766 0.317 . . . . 0.0 111.116 179.844 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -156.15 111.0 2.88 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.701 179.996 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' ILE . . . . . 0.751 HG13 ' HB3' ' A' ' 33' ' ' LYS . 0.0 OUTLIER -75.9 132.66 32.73 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-O 121.044 0.45 . . . . 0.0 111.202 -179.779 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' GLN . . . . . 0.473 ' NE2' ' HE2' ' A' ' 36' ' ' LYS . 0.3 OUTLIER -92.98 -43.57 8.86 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.719 -0.673 . . . . 0.0 110.37 179.42 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -159.47 -138.76 2.53 Favored Glycine 0 N--CA 1.45 -0.399 0 CA-C-N 115.613 -0.721 . . . . 0.0 112.05 179.942 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' THR . . . . . 0.605 HG22 ' HE3' ' A' ' 33' ' ' LYS . 4.1 p -120.71 145.34 47.58 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 120.89 0.376 . . . . 0.0 111.028 179.775 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -80.89 -88.4 0.08 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.971 -179.929 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 8.0 m-85 -61.23 -161.69 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.231 179.908 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -50.29 -34.38 23.24 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.972 179.956 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 151.93 48.6 0.02 OUTLIER Glycine 0 N--CA 1.452 -0.27 0 C-N-CA 120.801 -0.714 . . . . 0.0 112.466 179.878 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . 0.565 ' HG2' ' HH ' ' A' ' 14' ' ' TYR . 0.0 OUTLIER -116.43 -35.05 4.39 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.769 0.318 . . . . 0.0 110.917 179.968 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -123.79 140.59 52.83 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.221 -179.973 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . 0.751 ' HB3' HG13 ' A' ' 23' ' ' ILE . 1.0 OUTLIER -85.74 130.68 34.5 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.879 -179.953 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -80.82 112.23 18.01 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.534 179.703 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 35' ' ' CYS . . . . . 0.524 ' SG ' ' HB ' ' A' ' 23' ' ' ILE . 68.8 m -113.46 151.37 31.52 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.949 -0.568 . . . . 0.0 110.522 179.982 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . 0.473 ' HE2' ' NE2' ' A' ' 24' ' ' GLN . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.027 0 CA-C-O 118.232 -0.89 . . . . 0.0 110.93 179.704 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 18.4 m-20 . . . . . 0 N--CA 1.486 1.371 0 CA-C-O 120.81 0.338 . . . . 0.0 111.165 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 4.1 t-80 -60.35 110.2 1.19 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.841 -179.984 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 3.4 t80 -58.93 150.77 23.45 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.402 179.623 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' ASN . . . . . 0.496 ' OD1' ' HB2' ' A' ' 7' ' ' SER . 4.4 t30 -64.5 86.41 0.05 OUTLIER 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.274 0.559 . . . . 0.0 110.562 179.947 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' CYS . . . . . 0.456 ' C ' ' H ' ' A' ' 7' ' ' SER . 0.1 OUTLIER -116.82 -74.54 0.6 Allowed 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.449 -0.796 . . . . 0.0 110.103 -179.991 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 5.5 p -55.65 -8.17 0.4 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.192 0 CA-C-N 115.946 -0.57 . . . . 0.0 111.21 178.95 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' SER . . . . . 0.496 ' HB2' ' OD1' ' A' ' 4' ' ' ASN . 2.3 t -31.61 -54.02 0.26 Allowed 'General case' 0 N--CA 1.464 0.227 0 CA-C-N 115.755 -0.657 . . . . 0.0 111.553 -179.702 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -115.34 -40.19 3.47 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.695 -0.684 . . . . 0.0 110.754 179.826 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 178.38 41.48 0.07 OUTLIER Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 120.965 -0.636 . . . . 0.0 112.236 -179.975 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -94.3 162.77 24.9 Favored Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 120.818 -0.706 . . . . 0.0 112.682 -179.798 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 2.1 pt20 -150.25 150.61 31.77 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.736 0.303 . . . . 0.0 110.675 179.988 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . 0.513 ' HB3' ' HB2' ' A' ' 27' ' ' CYS . 0.0 OUTLIER -98.45 114.69 27.15 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.948 0.404 . . . . 0.0 111.384 -179.893 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -99.69 133.99 43.23 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.211 179.429 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER -53.27 -21.92 6.18 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.398 -0.365 . . . . 0.0 111.184 -179.792 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -114.32 159.24 20.44 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.585 179.618 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -53.22 155.87 2.51 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.332 -0.395 . . . . 0.0 111.131 179.891 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -39.6 112.52 0.78 Allowed Pre-proline 0 C--N 1.328 -0.331 0 CA-C-N 115.427 -0.806 . . . . 0.0 111.749 -179.563 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 60.5 Cg_endo -83.56 -72.6 0.01 OUTLIER 'Trans proline' 0 N--CA 1.459 -0.519 0 C-N-CA 122.689 2.26 . . . . 0.0 112.281 179.784 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' ILE . . . . . 0.511 HG23 ' OG1' ' A' ' 21' ' ' THR . 1.2 tt -56.46 -172.8 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.534 0.334 0 CA-C-N 116.408 -0.36 . . . . 0.0 111.375 179.741 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' PHE . . . . . 0.402 ' H ' ' CG1' ' A' ' 19' ' ' ILE . 38.0 p90 -72.92 24.56 0.06 Allowed 'General case' 0 CA--C 1.53 0.205 0 N-CA-C 111.983 0.364 . . . . 0.0 111.983 -179.66 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' THR . . . . . 0.511 ' OG1' HG23 ' A' ' 19' ' ' ILE . 0.8 OUTLIER -76.88 -162.99 0.31 Allowed 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.626 0.25 . . . . 0.0 110.669 179.527 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . 0.459 ' H ' ' HB ' ' A' ' 21' ' ' THR . 8.1 pttp -155.14 111.82 3.24 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.92 0.391 . . . . 0.0 111.0 179.813 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' ILE . . . . . 0.941 HG13 ' HB3' ' A' ' 33' ' ' LYS . 0.0 OUTLIER -74.53 131.41 35.02 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.869 -179.979 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' GLN . . . . . 0.553 ' HB2' ' HZ1' ' A' ' 36' ' ' LYS . 2.2 mp0 -100.56 -39.38 7.94 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.053 -0.522 . . . . 0.0 110.72 179.68 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -157.15 -151.17 5.92 Favored Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.823 -0.703 . . . . 0.0 112.381 -179.986 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' THR . . . . . 0.679 HG22 ' HE3' ' A' ' 33' ' ' LYS . 0.0 OUTLIER -115.24 149.48 37.68 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.012 0.434 . . . . 0.0 111.208 -179.931 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' CYS . . . . . 0.513 ' HB2' ' HB3' ' A' ' 12' ' ' CYS . 0.0 OUTLIER -91.4 -87.59 0.2 Allowed 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.764 -0.653 . . . . 0.0 111.199 -179.891 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 5.0 m-85 -61.08 -164.01 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.496 -179.743 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -50.24 -33.03 18.22 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.952 -0.567 . . . . 0.0 111.199 -179.907 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 151.35 41.12 0.03 OUTLIER Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 120.673 -0.775 . . . . 0.0 112.742 179.851 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 23.5 mtpt -115.57 -24.39 8.33 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.748 0.309 . . . . 0.0 110.975 179.882 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -129.96 141.82 50.72 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.13 179.97 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . 0.941 ' HB3' HG13 ' A' ' 23' ' ' ILE . 1.5 mmpt? -93.99 133.66 37.2 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.05 -179.982 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -77.31 117.56 18.93 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.382 179.574 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 35' ' ' CYS . . . . . 0.556 ' SG ' ' HB ' ' A' ' 23' ' ' ILE . 20.1 m -118.35 146.13 44.61 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.026 -179.579 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . 0.553 ' HZ1' ' HB2' ' A' ' 24' ' ' GLN . 5.2 mtmm . . . . . 0 C--O 1.249 1.037 0 CA-C-O 118.29 -0.862 . . . . 0.0 110.851 179.624 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.486 1.368 0 CA-C-O 120.827 0.346 . . . . 0.0 111.154 . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 8.7 t-80 -60.71 100.82 0.12 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.028 -0.533 . . . . 0.0 111.037 -179.921 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 10.8 t80 -67.2 174.64 3.07 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.717 179.669 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 4' ' ' ASN . . . . . 0.519 ' O ' ' ND2' ' A' ' 4' ' ' ASN . 0.8 OUTLIER -77.1 89.14 3.6 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 121.635 0.731 . . . . 0.0 110.117 179.508 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -118.06 -78.54 0.58 Allowed 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.313 -0.858 . . . . 0.0 109.345 179.954 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . 0.714 ' HA ' ' H ' ' A' ' 10' ' ' GLY . 10.4 p -54.47 -20.27 4.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 115.672 -0.695 . . . . 0.0 110.112 178.248 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 10.4 t -44.86 -43.19 8.59 Favored 'General case' 0 C--O 1.232 0.171 0 CA-C-N 115.29 -0.868 . . . . 0.0 111.406 179.989 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 23.0 p -97.53 -36.37 10.33 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.076 -179.793 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 153.85 50.29 0.01 OUTLIER Glycine 0 N--CA 1.453 -0.218 0 C-N-CA 120.686 -0.768 . . . . 0.0 112.531 -179.937 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . 0.714 ' H ' ' HA ' ' A' ' 6' ' ' VAL . . . -120.9 -177.14 15.63 Favored Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.768 -0.73 . . . . 0.0 112.578 -179.973 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 32.9 mt-30 -147.1 150.83 35.78 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 120.851 0.358 . . . . 0.0 111.138 -179.946 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 3.2 m -96.79 122.67 40.01 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.389 179.483 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 3.3 mt -132.75 159.01 40.94 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.377 -0.374 . . . . 0.0 111.07 -179.681 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 28.2 m-85 -88.34 -9.93 51.12 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.924 -179.923 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 1.6 m -113.56 167.12 10.86 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.134 -179.862 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -52.98 147.3 9.5 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.04 -0.527 . . . . 0.0 111.318 -179.942 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -45.6 120.7 5.07 Favored Pre-proline 0 C--N 1.328 -0.351 0 CA-C-N 115.666 -0.697 . . . . 0.0 111.469 -179.89 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 58.9 Cg_endo -84.01 -75.42 0.0 OUTLIER 'Trans proline' 0 N--CA 1.458 -0.579 0 C-N-CA 122.599 2.2 . . . . 0.0 112.455 179.876 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 19' ' ' ILE . . . . . 0.455 HG21 ' N ' ' A' ' 20' ' ' PHE . 0.3 OUTLIER -56.36 -172.48 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.534 0.34 0 CA-C-N 116.493 -0.322 . . . . 0.0 111.478 179.956 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 20' ' ' PHE . . . . . 0.455 ' N ' HG21 ' A' ' 19' ' ' ILE . 3.0 p90 -75.34 33.5 0.11 Allowed 'General case' 0 CA--C 1.531 0.227 0 N-CA-C 112.113 0.412 . . . . 0.0 112.113 -179.398 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 21' ' ' THR . . . . . 0.406 ' H ' ' C ' ' A' ' 19' ' ' ILE . 0.6 OUTLIER -90.52 -168.95 2.24 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.761 0.315 . . . . 0.0 110.64 179.306 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . 0.513 ' HG3' HE22 ' A' ' 24' ' ' GLN . 11.6 ptpt -151.95 129.86 11.73 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.264 -0.426 . . . . 0.0 110.819 179.649 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 23' ' ' ILE . . . . . 0.694 ' HB ' ' HE3' ' A' ' 33' ' ' LYS . 0.2 OUTLIER -80.76 127.45 39.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.846 -179.811 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 24' ' ' GLN . . . . . 0.515 ' HB2' ' HE2' ' A' ' 36' ' ' LYS . 0.0 OUTLIER -105.68 -35.89 7.25 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.813 -0.63 . . . . 0.0 110.894 -179.734 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -161.21 -128.05 0.92 Allowed Glycine 0 N--CA 1.451 -0.362 0 C-N-CA 120.788 -0.72 . . . . 0.0 112.503 179.974 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 26' ' ' THR . . . . . 0.453 ' HA ' ' HA ' ' A' ' 33' ' ' LYS . 40.9 p -127.72 150.37 49.81 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.992 0.425 . . . . 0.0 111.145 -179.947 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 15.0 t -93.75 -83.59 0.32 Allowed 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.776 -0.647 . . . . 0.0 111.186 -179.671 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 43.2 m-85 -60.85 -169.45 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.59 -179.658 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 12.9 mtp180 -45.92 -44.03 14.34 Favored 'General case' 0 N--CA 1.462 0.135 0 CA-C-N 115.876 -0.602 . . . . 0.0 111.377 -179.866 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 163.1 48.37 0.02 OUTLIER Glycine 0 N--CA 1.452 -0.285 0 C-N-CA 120.635 -0.793 . . . . 0.0 112.649 179.983 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 30.5 mttt -128.97 -18.62 3.73 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.844 0.354 . . . . 0.0 111.009 179.976 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -136.0 147.58 48.04 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.056 179.917 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . 0.694 ' HE3' ' HB ' ' A' ' 23' ' ' ILE . 0.0 OUTLIER -91.58 148.09 22.53 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.815 -179.979 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -94.45 126.27 39.62 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.905 -0.589 . . . . 0.0 111.272 -179.798 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 35' ' ' CYS . . . . . 0.528 ' SG ' ' HE3' ' A' ' 33' ' ' LYS . 0.8 OUTLIER -122.51 143.63 49.59 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.411 179.506 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . 0.515 ' HE2' ' HB2' ' A' ' 24' ' ' GLN . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.058 0 CA-C-O 118.236 -0.888 . . . . 0.0 111.087 -179.894 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.486 1.372 0 CA-C-O 120.802 0.334 . . . . 0.0 111.198 . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 8.6 t-80 -60.47 101.09 0.12 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.889 179.88 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 3' ' ' TYR . . . . . 0.4 ' HB3' ' SG ' ' A' ' 5' ' ' CYS . 2.2 t80 -62.16 163.56 7.99 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.275 179.703 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 19.2 t-20 -79.21 74.36 5.78 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 121.491 0.662 . . . . 0.0 110.525 179.807 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 5' ' ' CYS . . . . . 0.764 ' HA ' ' HG2' ' A' ' 36' ' ' LYS . 0.0 OUTLIER -104.49 -55.83 2.29 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 114.984 -1.007 . . . . 0.0 109.934 179.696 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . 0.514 ' HA ' ' N ' ' A' ' 10' ' ' GLY . 1.6 p -55.68 -8.08 0.39 Allowed 'Isoleucine or valine' 0 CA--C 1.53 0.182 0 CA-C-N 115.713 -0.676 . . . . 0.0 111.404 179.048 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 7' ' ' SER . . . . . 0.434 ' H ' ' C ' ' A' ' 5' ' ' CYS . 4.2 t -35.58 -52.95 0.68 Allowed 'General case' 0 N--CA 1.464 0.24 0 CA-C-N 115.877 -0.602 . . . . 0.0 111.72 -179.472 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 8.6 p -115.04 -10.98 12.17 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.861 -179.942 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 145.16 31.44 0.08 OUTLIER Glycine 0 N--CA 1.45 -0.39 0 C-N-CA 120.854 -0.688 . . . . 0.0 112.304 -179.84 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . 0.514 ' N ' ' HA ' ' A' ' 6' ' ' VAL . . . -62.27 175.38 7.0 Favored Glycine 0 N--CA 1.45 -0.429 0 C-N-CA 120.905 -0.664 . . . . 0.0 112.527 -179.974 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 3.2 pt20 -150.26 156.82 42.28 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.895 0.378 . . . . 0.0 111.175 -179.831 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 3.3 m -128.17 111.61 13.63 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.79 179.864 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . 0.611 HD22 ' HZ3' ' A' ' 33' ' ' LYS . 1.1 pt? -140.14 148.51 41.75 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.97 179.949 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 27.2 m-85 -63.31 -33.01 74.58 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.03 -0.532 . . . . 0.0 111.462 -179.58 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -79.7 148.96 31.35 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.39 -0.368 . . . . 0.0 111.316 -179.682 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . 0.412 ' HA ' ' HD3' ' A' ' 33' ' ' LYS . . . -55.16 154.79 5.34 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.118 179.698 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -41.4 122.9 2.2 Favored Pre-proline 0 C--N 1.327 -0.377 0 CA-C-N 115.397 -0.819 . . . . 0.0 111.786 -179.635 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 59.3 Cg_endo -86.98 -77.14 0.0 OUTLIER 'Trans proline' 0 N--CA 1.456 -0.694 0 C-N-CA 122.771 2.314 . . . . 0.0 112.314 179.609 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 19' ' ' ILE . . . . . 0.484 HG22 ' OG1' ' A' ' 21' ' ' THR . 0.3 OUTLIER -56.54 -171.74 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.535 0.367 0 CA-C-N 116.452 -0.34 . . . . 0.0 111.387 179.727 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 20' ' ' PHE . . . . . 0.438 ' N ' HG21 ' A' ' 19' ' ' ILE . 0.7 OUTLIER -71.25 19.38 0.06 Allowed 'General case' 0 CA--C 1.531 0.238 0 N-CA-C 112.414 0.524 . . . . 0.0 112.414 -179.426 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 21' ' ' THR . . . . . 0.484 ' OG1' HG22 ' A' ' 19' ' ' ILE . 0.3 OUTLIER -73.99 -170.57 0.94 Allowed 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.761 0.315 . . . . 0.0 110.625 179.388 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . 0.463 ' HG2' ' OXT' ' A' ' 36' ' ' LYS . 0.7 OUTLIER -150.76 122.73 8.18 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.79 179.822 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 23' ' ' ILE . . . . . 0.867 ' HB ' ' HE3' ' A' ' 33' ' ' LYS . 0.2 OUTLIER -71.61 130.18 35.2 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-O 120.975 0.416 . . . . 0.0 110.402 179.913 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 24' ' ' GLN . . . . . 0.649 HE22 ' HB3' ' A' ' 34' ' ' CYS . 0.0 OUTLIER -111.95 -4.56 14.5 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.856 -0.611 . . . . 0.0 111.13 -179.298 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 163.82 -135.4 3.77 Favored Glycine 0 N--CA 1.45 -0.412 0 C-N-CA 120.879 -0.677 . . . . 0.0 112.229 -179.993 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 26' ' ' THR . . . . . 0.658 ' HA ' ' HA ' ' A' ' 33' ' ' LYS . 1.2 p -127.3 149.71 49.91 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 121.029 0.442 . . . . 0.0 111.286 179.883 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 27' ' ' CYS . . . . . 0.414 ' HB3' ' H ' ' A' ' 28' ' ' TYR . 4.2 t -88.08 -82.47 0.23 Allowed 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.607 -0.724 . . . . 0.0 111.014 -179.691 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 28' ' ' TYR . . . . . 0.414 ' H ' ' HB3' ' A' ' 27' ' ' CYS . 60.8 m-85 -61.13 -165.95 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.682 -179.841 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -49.22 -42.43 40.39 Favored 'General case' 0 C--N 1.333 -0.139 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.337 -179.813 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 163.94 50.21 0.02 OUTLIER Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.724 -0.75 . . . . 0.0 112.557 179.896 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -124.78 -37.96 2.42 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.78 0.324 . . . . 0.0 110.835 179.948 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -121.54 145.92 47.47 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.887 179.921 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . 0.867 ' HE3' ' HB ' ' A' ' 23' ' ' ILE . 0.0 OUTLIER -94.98 145.56 24.85 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.835 -179.941 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 34' ' ' CYS . . . . . 0.649 ' HB3' HE22 ' A' ' 24' ' ' GLN . 0.0 OUTLIER -90.66 142.96 27.21 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.208 -179.969 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 35' ' ' CYS . . . . . 0.572 ' SG ' ' HE3' ' A' ' 33' ' ' LYS . 1.2 m -138.68 142.07 39.0 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.973 179.933 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . 0.764 ' HG2' ' HA ' ' A' ' 5' ' ' CYS . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.066 0 CA-C-O 118.217 -0.897 . . . . 0.0 110.987 179.803 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 17.9 m-20 . . . . . 0 N--CA 1.486 1.368 0 CA-C-O 120.857 0.36 . . . . 0.0 111.271 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 15.2 t-80 -59.89 104.35 0.29 Allowed 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.936 179.991 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 6.0 t80 -61.15 174.58 0.65 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.958 -0.564 . . . . 0.0 110.693 179.731 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -79.55 79.37 6.03 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 121.264 0.554 . . . . 0.0 110.274 179.569 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -109.21 -65.01 1.18 Allowed 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.3 -0.864 . . . . 0.0 110.691 -179.748 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . 0.484 ' HA ' ' H ' ' A' ' 10' ' ' GLY . 0.3 OUTLIER -53.93 -17.83 1.93 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 115.672 -0.694 . . . . 0.0 111.143 179.923 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -45.46 -35.99 4.14 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-N 115.916 -0.584 . . . . 0.0 111.183 179.899 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -114.89 -13.7 11.95 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.801 179.845 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 123.81 41.58 0.41 Allowed Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.85 -0.691 . . . . 0.0 112.496 -179.973 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . 0.484 ' H ' ' HA ' ' A' ' 6' ' ' VAL . . . -92.23 174.89 37.4 Favored Glycine 0 N--CA 1.452 -0.284 0 C-N-CA 120.785 -0.721 . . . . 0.0 112.417 179.978 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 1.2 tt0 -147.45 150.87 35.44 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.764 0.316 . . . . 0.0 110.874 179.919 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 1.7 m -93.49 139.37 30.8 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.132 -0.485 . . . . 0.0 111.264 -179.71 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . 0.412 ' HG ' ' HD3' ' A' ' 18' ' ' PRO . 3.2 mm? -126.35 142.41 51.54 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.459 179.657 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 2.0 m-85 -74.67 -1.91 23.9 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.396 -0.366 . . . . 0.0 111.209 -179.761 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 15' ' ' SER . . . . . 0.485 ' O ' ' HD2' ' A' ' 33' ' ' LYS . 0.4 OUTLIER -149.91 -179.05 6.83 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.813 179.852 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -44.97 137.18 4.28 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.213 179.984 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . 0.432 ' SG ' ' HD2' ' A' ' 18' ' ' PRO . 0.5 OUTLIER -45.49 141.77 3.61 Favored Pre-proline 0 C--N 1.33 -0.268 0 CA-C-N 115.919 -0.582 . . . . 0.0 111.691 -179.568 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . 0.432 ' HD2' ' SG ' ' A' ' 17' ' ' CYS . 68.3 Cg_endo -79.3 -83.92 0.0 OUTLIER 'Trans proline' 0 C--N 1.348 0.545 0 C-N-CA 122.618 2.212 . . . . 0.0 112.641 -179.982 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 19' ' ' ILE . . . . . 0.513 HG23 ' OG1' ' A' ' 21' ' ' THR . 3.6 tt -56.17 -176.07 0.02 OUTLIER 'Isoleucine or valine' 0 CA--C 1.533 0.308 0 CA-C-O 120.784 0.326 . . . . 0.0 111.593 -179.768 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 20' ' ' PHE . . . . . 0.45 ' H ' HG12 ' A' ' 19' ' ' ILE . 0.4 OUTLIER -76.3 35.19 0.14 Allowed 'General case' 0 C--N 1.331 -0.205 0 N-CA-C 111.996 0.369 . . . . 0.0 111.996 -179.368 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 21' ' ' THR . . . . . 0.513 ' OG1' HG23 ' A' ' 19' ' ' ILE . 0.0 OUTLIER -75.9 -152.46 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.792 -0.185 . . . . 0.0 110.507 179.441 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . 0.42 ' H ' ' HB ' ' A' ' 21' ' ' THR . 8.0 ttmm -160.45 108.59 1.63 Allowed 'General case' 0 C--O 1.231 0.122 0 CA-C-O 120.859 0.361 . . . . 0.0 111.838 -179.744 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 23' ' ' ILE . . . . . 0.609 HD11 ' HB2' ' A' ' 33' ' ' LYS . 0.1 OUTLIER -66.12 133.21 31.29 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.197 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.852 179.344 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 24' ' ' GLN . . . . . 0.663 ' HB2' ' NZ ' ' A' ' 36' ' ' LYS . 0.0 OUTLIER -114.54 -68.53 0.92 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.614 179.537 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -121.98 164.19 15.16 Favored Glycine 0 N--CA 1.452 -0.295 0 C-N-CA 121.032 -0.604 . . . . 0.0 111.931 179.632 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 26' ' ' THR . . . . . 0.589 ' HA ' ' HA ' ' A' ' 33' ' ' LYS . 1.0 OUTLIER -75.5 153.02 37.76 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.07 0.462 . . . . 0.0 111.622 -179.802 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 18.4 t -100.67 -78.74 0.51 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.655 -0.702 . . . . 0.0 110.911 -179.903 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 3.4 m-85 -60.3 -174.69 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.989 179.931 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 20.0 ttm-85 -50.6 -25.86 4.67 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.873 179.783 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 156.26 9.59 0.06 OUTLIER Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.971 -0.633 . . . . 0.0 112.162 179.851 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -98.64 -14.01 20.06 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.685 0.279 . . . . 0.0 111.11 -179.858 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -138.51 141.95 39.35 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.411 -0.359 . . . . 0.0 110.555 179.896 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . 0.609 ' HB2' HD11 ' A' ' 23' ' ' ILE . 0.0 OUTLIER -107.53 141.71 38.55 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.95 0.405 . . . . 0.0 110.776 -179.889 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -84.11 131.27 34.8 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.025 -0.534 . . . . 0.0 111.668 -179.466 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -115.9 156.33 26.36 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 115.774 -0.648 . . . . 0.0 111.089 179.907 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . 0.663 ' NZ ' ' HB2' ' A' ' 24' ' ' GLN . 0.1 OUTLIER . . . . . 0 C--O 1.249 1.051 0 CA-C-O 118.412 -0.804 . . . . 0.0 111.005 -179.792 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.487 1.381 0 CA-C-O 120.78 0.324 . . . . 0.0 111.213 . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 6.3 t-80 -60.28 108.3 0.78 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.853 179.999 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 6.1 t80 -62.51 169.73 2.83 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.986 179.847 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 1.7 m120 -76.01 86.46 2.92 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.083 0.468 . . . . 0.0 110.764 179.89 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -114.93 -74.58 0.61 Allowed 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.652 -0.704 . . . . 0.0 110.441 179.862 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 7.3 p -54.23 -15.34 1.08 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 115.67 -0.695 . . . . 0.0 111.05 179.467 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -44.18 -57.12 3.61 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-N 115.901 -0.59 . . . . 0.0 111.386 -179.932 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 1.2 m -99.81 -27.81 13.44 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.872 179.986 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 147.23 53.09 0.02 OUTLIER Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.78 -0.724 . . . . 0.0 112.432 -179.926 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -121.53 166.86 14.32 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.849 -0.691 . . . . 0.0 112.386 -179.973 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 1.9 tp60 -147.96 151.63 36.14 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.742 0.306 . . . . 0.0 110.398 179.86 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . 0.413 ' HB3' ' HB3' ' A' ' 27' ' ' CYS . 1.6 m -65.58 120.91 13.77 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.865 0.364 . . . . 0.0 111.093 -179.742 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . 0.514 ' HB3' ' O ' ' A' ' 15' ' ' SER . 0.4 OUTLIER -99.74 109.85 22.27 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.934 -0.576 . . . . 0.0 110.478 179.752 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 5.2 m-85 -52.89 -19.96 2.96 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.015 -0.539 . . . . 0.0 111.096 -179.893 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 15' ' ' SER . . . . . 0.514 ' O ' ' HB3' ' A' ' 13' ' ' LEU . 0.7 OUTLIER -133.19 169.94 16.15 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.16 179.368 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -50.75 142.67 10.94 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.568 -0.287 . . . . 0.0 110.743 179.852 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -44.97 126.35 5.33 Favored Pre-proline 0 C--N 1.331 -0.203 0 CA-C-N 116.132 -0.485 . . . . 0.0 111.237 -179.571 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 59.1 Cg_endo -90.05 -72.67 0.0 OUTLIER 'Trans proline' 0 N--CA 1.456 -0.724 0 C-N-CA 122.978 2.452 . . . . 0.0 112.74 -179.554 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 19' ' ' ILE . . . . . 0.763 HG13 ' H ' ' A' ' 20' ' ' PHE . 5.2 tp -56.02 -172.92 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.533 0.292 0 CA-C-N 116.344 -0.389 . . . . 0.0 111.501 -179.86 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 20' ' ' PHE . . . . . 0.763 ' H ' HG13 ' A' ' 19' ' ' ILE . 8.1 p90 -74.47 33.13 0.09 Allowed 'General case' 0 C--N 1.331 -0.205 0 N-CA-C 111.693 0.257 . . . . 0.0 111.693 -179.765 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 21' ' ' THR . . . . . 0.449 ' H ' ' C ' ' A' ' 19' ' ' ILE . 0.6 OUTLIER -81.17 -150.78 0.08 Allowed 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.582 -0.281 . . . . 0.0 110.617 179.447 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . 0.706 ' HG3' HE22 ' A' ' 24' ' ' GLN . 2.6 tptp -167.11 108.71 0.65 Allowed 'General case' 0 C--N 1.332 -0.158 0 CA-C-O 120.798 0.333 . . . . 0.0 110.954 179.991 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 23' ' ' ILE . . . . . 0.683 HG13 ' HE2' ' A' ' 33' ' ' LYS . 0.0 OUTLIER -68.27 138.65 22.11 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.614 179.665 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 24' ' ' GLN . . . . . 0.706 HE22 ' HG3' ' A' ' 22' ' ' LYS . 0.0 OUTLIER -108.94 -69.93 0.83 Allowed 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.842 -179.984 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -131.51 -146.74 5.84 Favored Glycine 0 N--CA 1.451 -0.34 0 CA-C-N 115.689 -0.687 . . . . 0.0 112.159 179.995 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 26' ' ' THR . . . . . 0.613 ' HA ' ' HA ' ' A' ' 33' ' ' LYS . 9.6 p -113.96 147.93 37.75 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 121.012 0.434 . . . . 0.0 111.338 -179.942 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 27' ' ' CYS . . . . . 0.413 ' HB3' ' HB3' ' A' ' 12' ' ' CYS . 51.7 t -94.15 -92.8 0.18 Allowed 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.705 -0.68 . . . . 0.0 111.016 -179.779 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 16.7 m-85 -61.4 -156.29 0.01 OUTLIER 'General case' 0 CA--C 1.53 0.193 0 CA-C-N 115.978 -0.555 . . . . 0.0 111.604 -179.858 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 3.4 mmm-85 -50.59 -43.94 56.71 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 115.978 -0.556 . . . . 0.0 111.364 -179.896 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 161.31 26.68 0.02 OUTLIER Glycine 0 N--CA 1.453 -0.217 0 C-N-CA 120.691 -0.766 . . . . 0.0 112.679 179.992 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -105.26 -15.16 15.13 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.887 0.375 . . . . 0.0 110.694 179.911 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -140.84 126.69 19.26 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.737 -179.993 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . 0.683 ' HE2' HG13 ' A' ' 23' ' ' ILE . 0.0 OUTLIER -93.03 132.04 37.49 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.779 0.324 . . . . 0.0 110.778 179.877 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -55.72 120.16 6.87 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.715 179.82 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 35' ' ' CYS . . . . . 0.512 ' SG ' ' HB ' ' A' ' 23' ' ' ILE . 0.9 OUTLIER -122.2 141.74 51.15 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.017 -179.672 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . 0.458 ' N ' ' HZ1' ' A' ' 36' ' ' LYS . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.028 0 CA-C-O 118.223 -0.894 . . . . 0.0 110.901 179.844 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 19.4 m-20 . . . . . 0 N--CA 1.486 1.357 0 CA-C-O 120.821 0.343 . . . . 0.0 111.027 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 13.9 t-80 -60.91 94.91 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.09 179.841 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 21.0 t80 -65.01 161.53 18.53 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.655 179.572 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -60.75 100.02 0.1 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.347 0.594 . . . . 0.0 110.153 179.509 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 5' ' ' CYS . . . . . 0.714 ' HA ' ' HG2' ' A' ' 36' ' ' LYS . 0.1 OUTLIER -130.34 -82.42 0.54 Allowed 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.545 -0.752 . . . . 0.0 109.918 -179.712 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 7.1 p -54.49 -15.26 1.13 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.183 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.702 178.872 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -44.75 -47.09 10.77 Favored 'General case' 0 C--N 1.333 -0.14 0 CA-C-N 115.669 -0.696 . . . . 0.0 111.519 -179.91 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 3.3 p -114.12 -3.11 13.29 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.288 -0.415 . . . . 0.0 111.11 -179.847 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 124.38 38.23 0.53 Allowed Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 120.678 -0.772 . . . . 0.0 112.617 179.947 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -102.54 169.99 19.88 Favored Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.802 -0.714 . . . . 0.0 112.333 179.925 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -150.34 144.84 25.76 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.866 0.365 . . . . 0.0 110.928 179.9 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . 0.434 ' HB3' ' HB2' ' A' ' 27' ' ' CYS . 0.0 OUTLIER -92.47 136.05 33.54 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.006 179.866 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 1.9 mp -131.51 162.67 29.72 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.847 -179.885 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 59.3 m-85 -79.73 -45.19 19.35 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.944 -179.993 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -89.21 171.67 9.63 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.13 -179.861 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -55.21 152.53 8.01 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.079 -0.509 . . . . 0.0 111.459 179.994 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . 0.401 ' HA ' ' HD3' ' A' ' 18' ' ' PRO . 0.1 OUTLIER -45.36 127.05 6.02 Favored Pre-proline 0 C--N 1.329 -0.289 0 CA-C-N 115.603 -0.726 . . . . 0.0 111.373 -179.988 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . 0.401 ' HD3' ' HA ' ' A' ' 17' ' ' CYS . 57.1 Cg_endo -89.18 -78.62 0.0 OUTLIER 'Trans proline' 0 N--CA 1.456 -0.721 0 C-N-CA 122.758 2.305 . . . . 0.0 112.589 -179.953 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 19' ' ' ILE . . . . . 0.763 HG13 ' H ' ' A' ' 20' ' ' PHE . 5.4 tp -56.45 -171.93 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.535 0.371 0 CA-C-N 116.496 -0.32 . . . . 0.0 111.732 -179.793 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 20' ' ' PHE . . . . . 0.763 ' H ' HG13 ' A' ' 19' ' ' ILE . 2.1 p90 -69.77 19.8 0.04 OUTLIER 'General case' 0 N--CA 1.463 0.222 0 N-CA-C 112.314 0.487 . . . . 0.0 112.314 -179.315 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 21' ' ' THR . . . . . 0.491 ' H ' ' C ' ' A' ' 19' ' ' ILE . 0.6 OUTLIER -73.25 -159.63 0.07 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.567 0.222 . . . . 0.0 110.651 179.473 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . 0.446 ' H ' ' HB ' ' A' ' 21' ' ' THR . 8.8 tptp -160.63 117.82 2.42 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.931 0.396 . . . . 0.0 111.421 -179.948 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 23' ' ' ILE . . . . . 0.556 HD12 ' HG2' ' A' ' 33' ' ' LYS . 0.6 OUTLIER -73.04 131.0 35.51 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.606 179.31 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 24' ' ' GLN . . . . . 0.864 ' HB2' ' HE2' ' A' ' 36' ' ' LYS . 1.7 tp-100 -113.31 -68.63 0.91 Allowed 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.618 179.915 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -126.54 -138.46 4.82 Favored Glycine 0 N--CA 1.45 -0.428 0 C-N-CA 120.847 -0.692 . . . . 0.0 112.074 179.697 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 26' ' ' THR . . . . . 0.651 ' HA ' ' HA ' ' A' ' 33' ' ' LYS . 3.1 p -125.3 146.61 49.48 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 120.932 0.396 . . . . 0.0 111.17 179.93 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 27' ' ' CYS . . . . . 0.434 ' HB2' ' HB3' ' A' ' 12' ' ' CYS . 0.0 OUTLIER -86.44 -81.88 0.21 Allowed 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.808 -0.633 . . . . 0.0 111.169 -179.717 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 24.0 m-85 -61.02 -165.27 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.905 -0.589 . . . . 0.0 111.887 -179.598 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -50.52 -34.48 25.44 Favored 'General case' 0 C--N 1.333 -0.152 0 CA-C-N 115.87 -0.605 . . . . 0.0 111.419 -179.929 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 153.91 41.37 0.02 OUTLIER Glycine 0 N--CA 1.452 -0.235 0 C-N-CA 120.726 -0.75 . . . . 0.0 112.491 -179.915 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 15.2 mttm -116.76 -23.53 8.09 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.841 0.353 . . . . 0.0 110.88 179.923 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -136.33 145.67 45.72 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.911 179.952 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . 0.651 ' HA ' ' HA ' ' A' ' 26' ' ' THR . 0.0 OUTLIER -98.26 138.95 34.78 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.918 -179.875 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -78.07 138.29 38.69 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.753 179.958 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 35' ' ' CYS . . . . . 0.417 ' SG ' ' NZ ' ' A' ' 33' ' ' LYS . 1.2 m -125.88 131.5 52.35 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.965 -179.839 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . 0.864 ' HE2' ' HB2' ' A' ' 24' ' ' GLN . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.054 0 CA-C-O 118.247 -0.882 . . . . 0.0 110.919 179.908 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 6.7 t-80 . . . . . 0 CA--C 1.528 0.11 0 CA-C-O 120.807 0.337 . . . . 0.0 111.089 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 5.2 t80 -63.48 158.66 20.33 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.501 179.573 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -66.57 86.08 0.11 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.079 0.466 . . . . 0.0 110.547 179.813 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -106.86 -74.32 0.66 Allowed 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.616 -0.72 . . . . 0.0 110.867 -179.709 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 6' ' ' VAL . . . . . 0.532 ' HA ' ' H ' ' A' ' 10' ' ' GLY . 12.7 p -53.64 -25.22 11.03 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.228 0 CA-C-N 115.987 -0.551 . . . . 0.0 111.157 179.914 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -45.37 -53.37 8.69 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.835 -0.62 . . . . 0.0 111.34 179.992 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 58.6 m -95.68 -31.24 13.34 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.984 -179.925 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 147.26 54.63 0.02 OUTLIER Glycine 0 N--CA 1.452 -0.276 0 C-N-CA 120.865 -0.683 . . . . 0.0 112.404 179.989 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 10' ' ' GLY . . . . . 0.532 ' H ' ' HA ' ' A' ' 6' ' ' VAL . . . -123.89 174.32 16.77 Favored Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.714 -0.755 . . . . 0.0 112.632 -179.919 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 7.3 tt0 -150.02 156.39 41.6 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.87 0.367 . . . . 0.0 110.918 -179.946 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -98.02 131.06 44.77 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.041 -0.527 . . . . 0.0 111.031 -179.937 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -134.85 134.75 41.09 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.871 179.982 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 40.3 m-85 -59.15 -28.66 66.79 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.119 -179.973 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 47.1 m -107.25 169.45 8.56 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.152 -179.804 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 16' ' ' ALA . . . . . 0.431 ' HA ' ' HD3' ' A' ' 33' ' ' LYS . . . -52.64 154.28 2.74 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 115.984 -0.553 . . . . 0.0 111.464 -179.986 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 17' ' ' CYS . . . . . 0.636 ' SG ' ' HE3' ' A' ' 33' ' ' LYS . 85.3 m -45.33 134.04 5.73 Favored Pre-proline 0 C--N 1.328 -0.347 0 CA-C-N 115.437 -0.802 . . . . 0.0 111.633 -179.748 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 18' ' ' PRO . . . . . 0.503 ' HG2' ' H ' ' A' ' 19' ' ' ILE . 69.7 Cg_endo -77.06 -78.94 0.01 OUTLIER 'Trans proline' 0 C--N 1.347 0.464 0 C-N-CA 122.501 2.134 . . . . 0.0 111.81 179.444 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 19' ' ' ILE . . . . . 0.503 ' H ' ' HG2' ' A' ' 18' ' ' PRO . 2.0 tt -56.63 -172.1 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.534 0.334 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.126 179.351 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 20' ' ' PHE . . . . . 0.406 ' N ' HG23 ' A' ' 19' ' ' ILE . 0.3 OUTLIER -77.94 41.41 0.35 Allowed 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.728 0.299 . . . . 0.0 111.471 -179.926 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 21' ' ' THR . . . . . 0.617 ' HB ' ' SG ' ' A' ' 35' ' ' CYS . 0.4 OUTLIER -89.97 -165.81 1.44 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.471 -0.331 . . . . 0.0 110.905 179.799 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 22' ' ' LYS . . . . . 0.518 ' O ' ' HG2' ' A' ' 22' ' ' LYS . 0.0 OUTLIER -150.13 128.54 12.17 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-O 120.985 0.421 . . . . 0.0 110.719 179.504 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 23' ' ' ILE . . . . . 0.553 HG13 ' HB2' ' A' ' 33' ' ' LYS . 0.1 OUTLIER -78.06 124.45 36.46 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.908 -179.447 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 24' ' ' GLN . . . . . 0.584 ' HB2' ' HE2' ' A' ' 36' ' ' LYS . 3.6 mt-30 -93.8 -57.68 2.48 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.91 179.989 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -136.1 -148.62 5.59 Favored Glycine 0 N--CA 1.452 -0.287 0 C-N-CA 120.919 -0.658 . . . . 0.0 112.486 -179.984 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 26' ' ' THR . . . . . 0.407 ' HA ' ' HA ' ' A' ' 33' ' ' LYS . 0.7 OUTLIER -118.96 147.25 44.26 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.962 0.41 . . . . 0.0 111.241 -179.997 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 9.5 t -83.87 -95.39 0.06 Allowed 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.746 -0.661 . . . . 0.0 110.953 -179.768 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 14.9 m-85 -61.51 -156.61 0.01 OUTLIER 'General case' 0 CA--C 1.53 0.176 0 CA-C-O 120.985 0.422 . . . . 0.0 111.474 179.984 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 1.9 mtp180 -50.06 -35.36 24.84 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-N 116.053 -0.521 . . . . 0.0 111.109 179.983 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 155.64 17.39 0.04 OUTLIER Glycine 0 N--CA 1.452 -0.289 0 C-N-CA 120.727 -0.749 . . . . 0.0 112.5 179.925 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 18.6 tttt -89.67 -24.21 21.66 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.91 0.386 . . . . 0.0 110.531 179.83 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -130.27 144.92 51.66 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.96 -0.564 . . . . 0.0 111.009 179.897 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 33' ' ' LYS . . . . . 0.636 ' HE3' ' SG ' ' A' ' 17' ' ' CYS . 0.0 OUTLIER -102.24 139.66 37.55 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.787 -179.992 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -81.72 125.51 30.7 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.657 179.861 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 35' ' ' CYS . . . . . 0.617 ' SG ' ' HB ' ' A' ' 21' ' ' THR . 4.6 t -127.49 151.53 48.74 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.355 -179.684 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 36' ' ' LYS . . . . . 0.584 ' HE2' ' HB2' ' A' ' 24' ' ' GLN . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.071 0 CA-C-O 118.253 -0.879 . . . . 0.0 110.799 179.953 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 6.5 t-80 . . . . . 0 C--O 1.231 0.128 0 CA-C-O 120.802 0.334 . . . . 0.0 110.853 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 9.0 t80 -54.96 162.14 1.39 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.731 179.732 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 1.2 m120 -72.42 80.49 1.04 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.206 0.527 . . . . 0.0 110.543 179.836 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 3.0 m -98.3 -70.0 0.74 Allowed 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.398 -0.819 . . . . 0.0 110.525 -179.916 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 2.0 p -54.85 -13.52 0.83 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-N 116.081 -0.509 . . . . 0.0 111.153 179.176 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 1.2 t -41.88 -51.7 4.24 Favored 'General case' 0 N--CA 1.462 0.153 0 CA-C-N 115.865 -0.607 . . . . 0.0 111.488 -179.717 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 1.3 m -105.79 -10.0 16.94 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.782 179.951 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 125.53 39.03 0.45 Allowed Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.874 -0.679 . . . . 0.0 112.399 -179.964 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -82.68 170.31 49.96 Favored Glycine 0 N--CA 1.452 -0.294 0 C-N-CA 120.806 -0.711 . . . . 0.0 112.466 -179.998 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -143.5 153.93 43.12 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.817 0.342 . . . . 0.0 110.959 179.968 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 1.9 m -110.13 137.08 48.37 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.947 -179.991 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -136.96 152.13 49.81 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.88 179.996 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 62.9 m-85 -75.6 -14.32 60.37 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.226 -179.797 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 1.9 p -120.61 169.94 9.89 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.977 -179.893 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -51.63 145.55 8.97 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.105 179.948 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER -45.49 142.04 3.49 Favored Pre-proline 0 C--N 1.329 -0.305 0 CA-C-N 115.752 -0.658 . . . . 0.0 111.674 -179.621 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 55.4 Cg_endo -91.01 -75.39 0.0 OUTLIER 'Trans proline' 0 N--CA 1.456 -0.734 0 C-N-CA 123.115 2.543 . . . . 0.0 113.023 -179.686 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 19' ' ' ILE . . . . . 0.457 HG22 ' OG1' ' A' ' 21' ' ' THR . 2.4 tt -56.02 -176.47 0.02 OUTLIER 'Isoleucine or valine' 0 CA--C 1.535 0.382 0 CA-C-O 120.848 0.356 . . . . 0.0 111.903 -179.496 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 4.0 p90 -74.88 32.15 0.09 Allowed 'General case' 0 CA--C 1.532 0.259 0 N-CA-C 112.616 0.599 . . . . 0.0 112.616 -178.85 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 21' ' ' THR . . . . . 0.457 ' OG1' HG22 ' A' ' 19' ' ' ILE . 0.0 OUTLIER -78.86 -152.82 0.06 Allowed 'General case' 0 C--N 1.331 -0.227 0 C-N-CA 121.136 -0.226 . . . . 0.0 110.46 179.273 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 22' ' ' LYS . . . . . 0.444 ' H ' ' HB ' ' A' ' 21' ' ' THR . 17.0 tttp -165.17 94.07 0.63 Allowed 'General case' 0 C--N 1.333 -0.126 0 C-N-CA 120.711 -0.395 . . . . 0.0 111.661 -179.919 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 23' ' ' ILE . . . . . 0.531 ' HB ' ' CE ' ' A' ' 33' ' ' LYS . 0.2 OUTLIER -49.14 131.83 7.1 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.576 179.252 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -120.54 0.77 10.55 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.467 -0.333 . . . . 0.0 111.715 -179.426 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 176.44 -145.67 7.59 Favored Glycine 0 N--CA 1.451 -0.343 0 C-N-CA 120.428 -0.891 . . . . 0.0 112.889 180.0 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 26' ' ' THR . . . . . 0.517 ' HA ' ' HA ' ' A' ' 33' ' ' LYS . 1.2 p -127.01 149.45 49.89 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.06 0.457 . . . . 0.0 111.303 -179.749 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 8.5 t -89.64 -85.48 0.21 Allowed 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.672 -0.694 . . . . 0.0 111.146 -179.737 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 8.5 m-85 -61.37 -158.23 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.564 -179.641 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 81.8 mtt180 -48.56 -38.39 20.41 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-N 116.018 -0.537 . . . . 0.0 111.349 -179.73 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 157.54 17.5 0.04 OUTLIER Glycine 0 N--CA 1.452 -0.283 0 C-N-CA 120.725 -0.75 . . . . 0.0 112.674 179.919 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 3.0 mttt -95.62 -28.2 14.95 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.872 0.368 . . . . 0.0 110.814 179.874 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -118.13 149.66 40.67 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.121 -0.49 . . . . 0.0 111.044 -179.979 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 33' ' ' LYS . . . . . 0.531 ' CE ' ' HB ' ' A' ' 23' ' ' ILE . 0.0 OUTLIER -97.44 145.52 26.11 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.892 -0.594 . . . . 0.0 110.883 -179.992 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -97.65 119.88 37.02 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.944 179.9 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 35' ' ' CYS . . . . . 0.53 ' SG ' ' HE3' ' A' ' 33' ' ' LYS . 0.0 OUTLIER -114.55 160.94 18.69 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.728 -0.669 . . . . 0.0 111.261 -179.615 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 36' ' ' LYS . . . . . 0.727 ' HZ3' ' H ' ' A' ' 36' ' ' LYS . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.051 0 CA-C-O 118.271 -0.871 . . . . 0.0 111.001 -179.996 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.231 0.114 0 CA-C-O 120.886 0.374 . . . . 0.0 110.568 . . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 3' ' ' TYR . . . . . 0.435 ' HB3' ' SG ' ' A' ' 34' ' ' CYS . 1.4 t80 -56.52 145.44 28.01 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.882 -179.794 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 4.1 m120 -66.11 84.36 0.09 Allowed 'General case' 0 N--CA 1.45 -0.457 0 CA-C-O 121.135 0.493 . . . . 0.0 110.905 -179.995 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -102.26 -69.21 0.79 Allowed 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.579 -0.737 . . . . 0.0 110.776 -179.838 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 10.3 p -53.73 -21.27 4.68 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 115.777 -0.647 . . . . 0.0 111.282 179.893 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 22.5 p -45.32 -37.58 4.97 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-N 115.928 -0.578 . . . . 0.0 111.255 -179.939 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 2.8 m -112.03 -20.55 11.92 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.9 -179.949 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 118.01 49.15 0.38 Allowed Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.838 -0.696 . . . . 0.0 112.512 179.998 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -101.99 -173.24 27.71 Favored Glycine 0 N--CA 1.451 -0.301 0 C-N-CA 120.679 -0.772 . . . . 0.0 112.497 -179.999 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -149.46 137.52 20.52 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.694 0.283 . . . . 0.0 110.567 179.885 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 12' ' ' CYS . . . . . 0.553 ' HA ' ' O ' ' A' ' 33' ' ' LYS . 0.0 OUTLIER -89.58 110.68 21.52 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.001 0.429 . . . . 0.0 111.533 -179.63 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 1.6 mp -105.11 122.12 45.22 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.789 -0.641 . . . . 0.0 110.1 179.249 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 14' ' ' TYR . . . . . 0.796 ' HA ' ' HA ' ' A' ' 32' ' ' ALA . 31.9 m-85 -49.68 -33.32 15.4 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.07 -179.443 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 34.2 t -99.01 166.91 11.05 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.387 179.338 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -52.94 141.06 22.99 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.449 -0.341 . . . . 0.0 110.718 179.851 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 17' ' ' CYS . . . . . 0.513 ' SG ' ' HB ' ' A' ' 23' ' ' ILE . 39.5 m -45.5 132.01 6.22 Favored Pre-proline 0 C--N 1.33 -0.26 0 CA-C-N 116.063 -0.517 . . . . 0.0 111.914 -179.416 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 18' ' ' PRO . . . . . 0.427 ' HG2' ' H ' ' A' ' 19' ' ' ILE . 68.6 Cg_endo -81.49 -70.04 0.01 OUTLIER 'Trans proline' 0 N--CA 1.459 -0.503 0 C-N-CA 122.691 2.261 . . . . 0.0 112.261 179.624 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 19' ' ' ILE . . . . . 0.457 HG13 ' H ' ' A' ' 20' ' ' PHE . 0.3 OUTLIER -56.59 -173.24 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.534 0.334 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.639 179.759 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 20' ' ' PHE . . . . . 0.457 ' H ' HG13 ' A' ' 19' ' ' ILE . 27.9 p90 -74.51 25.91 0.08 Allowed 'General case' 0 C--N 1.331 -0.213 0 N-CA-C 112.073 0.397 . . . . 0.0 112.073 -179.626 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 21' ' ' THR . . . . . 0.563 ' HB ' ' SG ' ' A' ' 35' ' ' CYS . 0.9 OUTLIER -76.74 -163.04 0.3 Allowed 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 120.518 0.199 . . . . 0.0 110.763 179.711 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 22' ' ' LYS . . . . . 0.432 ' H ' ' HB ' ' A' ' 21' ' ' THR . 8.9 tttt -163.6 108.23 1.04 Allowed 'General case' 0 C--O 1.231 0.132 0 CA-C-O 120.843 0.354 . . . . 0.0 110.844 -179.97 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 23' ' ' ILE . . . . . 0.889 HG13 ' HB3' ' A' ' 33' ' ' LYS . 0.0 OUTLIER -68.93 139.57 20.29 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 CA-C-O 121.076 0.465 . . . . 0.0 110.755 179.891 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 24' ' ' GLN . . . . . 0.867 ' HB2' ' HE3' ' A' ' 36' ' ' LYS . 0.0 OUTLIER -105.19 -44.95 4.63 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.727 -0.67 . . . . 0.0 110.568 179.23 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -151.88 -149.48 5.1 Favored Glycine 0 N--CA 1.452 -0.292 0 C-N-CA 120.989 -0.624 . . . . 0.0 112.251 179.917 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -110.54 148.34 32.33 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.053 0.454 . . . . 0.0 111.277 -179.931 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 27' ' ' CYS . . . . . 0.442 ' HB2' ' HB3' ' A' ' 12' ' ' CYS . 0.0 OUTLIER -83.44 -91.3 0.08 Allowed 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.741 -0.663 . . . . 0.0 111.133 -179.694 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 28' ' ' TYR . . . . . 0.432 ' H ' ' HB3' ' A' ' 27' ' ' CYS . 29.4 m-85 -61.49 -156.18 0.01 OUTLIER 'General case' 0 CA--C 1.531 0.229 0 CA-C-N 116.066 -0.516 . . . . 0.0 111.764 -179.701 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -49.17 -39.55 29.69 Favored 'General case' 0 C--O 1.232 0.139 0 CA-C-N 115.917 -0.583 . . . . 0.0 111.314 -179.83 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 155.65 48.15 0.01 OUTLIER Glycine 0 N--CA 1.452 -0.257 0 C-N-CA 120.744 -0.741 . . . . 0.0 112.549 -179.975 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 5.9 mptt -120.04 -44.21 2.51 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.86 0.362 . . . . 0.0 110.881 179.999 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 32' ' ' ALA . . . . . 0.796 ' HA ' ' HA ' ' A' ' 14' ' ' TYR . . . -105.98 146.66 29.76 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.987 179.977 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 33' ' ' LYS . . . . . 0.889 ' HB3' HG13 ' A' ' 23' ' ' ILE . 2.7 mtpp -95.77 120.66 36.42 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.079 -179.932 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 34' ' ' CYS . . . . . 0.604 ' SG ' ' HE2' ' A' ' 36' ' ' LYS . 0.1 OUTLIER -69.74 111.7 5.69 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.213 179.287 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 35' ' ' CYS . . . . . 0.563 ' SG ' ' HB ' ' A' ' 21' ' ' THR . 3.3 t -116.16 146.93 41.89 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.233 -179.427 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 36' ' ' LYS . . . . . 0.867 ' HE3' ' HB2' ' A' ' 24' ' ' GLN . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.043 0 CA-C-O 118.23 -0.89 . . . . 0.0 110.887 179.827 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.232 0.16 0 CA-C-O 120.894 0.378 . . . . 0.0 110.902 . . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 5.2 t80 -65.55 160.17 22.98 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.594 179.852 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -68.91 85.63 0.33 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.1 0.476 . . . . 0.0 110.822 179.883 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 5' ' ' CYS . . . . . 0.672 ' HA ' ' HG2' ' A' ' 36' ' ' LYS . 0.0 OUTLIER -109.53 -79.05 0.58 Allowed 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.641 -0.709 . . . . 0.0 110.556 179.941 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 11.9 p -54.26 -16.82 1.56 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.188 0 CA-C-N 115.959 -0.564 . . . . 0.0 111.15 179.62 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -45.08 -53.63 7.7 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.925 -0.58 . . . . 0.0 111.342 -179.859 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 5.5 p -106.32 -5.06 19.36 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.982 179.995 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 118.37 51.14 0.32 Allowed Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.786 -0.721 . . . . 0.0 112.501 -179.964 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -96.88 -178.26 34.91 Favored Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.735 -0.745 . . . . 0.0 112.476 -179.973 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 6.1 tt0 -146.51 131.75 18.45 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.815 0.341 . . . . 0.0 110.826 179.948 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 12' ' ' CYS . . . . . 0.476 ' HB3' ' HB2' ' A' ' 27' ' ' CYS . 0.0 OUTLIER -102.62 131.02 49.67 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.951 -179.893 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 3.0 mt -133.03 158.15 43.46 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.006 -179.949 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 14' ' ' TYR . . . . . 0.453 ' CD1' ' HB2' ' A' ' 32' ' ' ALA . 29.2 m-85 -82.41 -8.47 59.62 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.212 -179.848 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 98.7 p -117.65 169.08 9.86 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.386 -0.37 . . . . 0.0 111.085 -179.833 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -54.94 147.68 14.94 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.07 -0.513 . . . . 0.0 111.115 179.947 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 17' ' ' CYS . . . . . 0.452 ' HA ' ' HD3' ' A' ' 18' ' ' PRO . 0.1 OUTLIER -45.26 131.26 5.85 Favored Pre-proline 0 C--N 1.33 -0.265 0 CA-C-N 115.856 -0.611 . . . . 0.0 111.306 -179.855 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 18' ' ' PRO . . . . . 0.452 ' HD3' ' HA ' ' A' ' 17' ' ' CYS . 40.9 Cg_endo -90.8 -79.98 0.0 OUTLIER 'Trans proline' 0 N--CA 1.455 -0.767 0 C-N-CA 122.995 2.463 . . . . 0.0 112.64 -179.782 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 19' ' ' ILE . . . . . 0.567 HG12 ' H ' ' A' ' 20' ' ' PHE . 3.7 tt -56.6 -168.3 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.536 0.432 0 CA-C-N 116.376 -0.375 . . . . 0.0 111.758 -179.873 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 20' ' ' PHE . . . . . 0.567 ' H ' HG12 ' A' ' 19' ' ' ILE . 0.8 OUTLIER -75.69 33.97 0.12 Allowed 'General case' 0 CA--C 1.531 0.223 0 N-CA-C 112.083 0.401 . . . . 0.0 112.083 -179.492 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 21' ' ' THR . . . . . 0.448 HG22 ' OXT' ' A' ' 36' ' ' LYS . 0.1 OUTLIER -90.25 180.0 5.77 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.74 0.305 . . . . 0.0 110.695 179.263 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 1.6 ptmm? -135.68 136.39 40.86 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.332 -0.394 . . . . 0.0 110.408 179.554 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 23' ' ' ILE . . . . . 0.968 HD13 ' HB2' ' A' ' 33' ' ' LYS . 0.1 OUTLIER -89.9 126.35 42.78 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.836 -179.715 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 24' ' ' GLN . . . . . 0.694 ' HB2' ' HE2' ' A' ' 36' ' ' LYS . 0.3 OUTLIER -104.08 -59.81 1.67 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.607 -0.724 . . . . 0.0 111.157 -179.703 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -141.45 -132.98 2.84 Favored Glycine 0 C--N 1.332 0.329 0 C-N-CA 120.673 -0.775 . . . . 0.0 112.904 -179.702 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 15.9 p -126.04 149.76 48.63 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.05 0.452 . . . . 0.0 111.234 -179.786 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 27' ' ' CYS . . . . . 0.476 ' HB2' ' HB3' ' A' ' 12' ' ' CYS . 0.7 OUTLIER -95.27 -78.06 0.46 Allowed 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.678 -0.692 . . . . 0.0 111.158 -179.738 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 17.6 m-85 -60.94 -164.65 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.504 -179.658 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 4.3 mtm180 -50.1 -36.97 31.76 Favored 'General case' 0 C--N 1.333 -0.143 0 CA-C-N 115.964 -0.562 . . . . 0.0 111.279 -179.936 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 153.74 43.61 0.02 OUTLIER Glycine 0 N--CA 1.452 -0.294 0 C-N-CA 120.751 -0.738 . . . . 0.0 112.556 179.949 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -122.54 -21.22 5.78 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.841 0.353 . . . . 0.0 110.947 179.967 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 32' ' ' ALA . . . . . 0.453 ' HB2' ' CD1' ' A' ' 14' ' ' TYR . . . -127.63 143.94 51.12 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.123 -0.49 . . . . 0.0 111.036 179.992 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 33' ' ' LYS . . . . . 0.968 ' HB2' HD13 ' A' ' 23' ' ' ILE . 0.0 OUTLIER -96.1 134.66 38.89 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.877 179.998 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 34' ' ' CYS . . . . . 0.455 ' HB2' ' SG ' ' A' ' 27' ' ' CYS . 0.0 OUTLIER -79.16 141.49 37.18 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.139 -179.739 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 35' ' ' CYS . . . . . 0.434 ' SG ' ' HE3' ' A' ' 33' ' ' LYS . 0.8 OUTLIER -134.79 129.95 35.37 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.905 179.946 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 36' ' ' LYS . . . . . 0.694 ' HE2' ' HB2' ' A' ' 24' ' ' GLN . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.079 0 CA-C-O 118.256 -0.878 . . . . 0.0 110.874 179.942 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 1.9 t-80 . . . . . 0 C--O 1.232 0.142 0 CA-C-O 120.845 0.355 . . . . 0.0 110.602 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 4.4 t80 -62.75 166.72 5.19 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.744 179.995 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 4' ' ' ASN . . . . . 0.431 ' ND2' ' HB2' ' A' ' 7' ' ' SER . 26.0 t-20 -81.89 78.49 8.6 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 121.409 0.623 . . . . 0.0 110.765 179.862 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 0.3 OUTLIER -106.23 -56.51 2.18 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.168 -0.924 . . . . 0.0 110.241 179.897 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 60.9 t -54.99 -12.89 0.74 Allowed 'Isoleucine or valine' 0 CA--C 1.53 0.208 0 CA-C-N 115.754 -0.657 . . . . 0.0 111.105 179.168 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 7' ' ' SER . . . . . 0.431 ' HB2' ' ND2' ' A' ' 4' ' ' ASN . 6.2 t -34.38 -50.22 0.41 Allowed 'General case' 0 N--CA 1.464 0.266 0 CA-C-N 115.821 -0.627 . . . . 0.0 111.833 -179.831 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 28.2 t -107.75 -19.74 13.44 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.863 -179.96 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 136.39 34.85 0.22 Allowed Glycine 0 N--CA 1.45 -0.37 0 C-N-CA 120.828 -0.701 . . . . 0.0 112.321 -179.93 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -65.89 176.75 15.67 Favored Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.796 -0.716 . . . . 0.0 112.477 -179.995 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -144.84 142.51 29.99 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.84 0.352 . . . . 0.0 110.965 -179.967 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 3.2 m -106.18 125.24 50.76 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.079 -0.509 . . . . 0.0 110.704 179.876 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 13' ' ' LEU . . . . . 0.499 ' O ' ' HG3' ' A' ' 33' ' ' LYS . 3.6 mp -135.14 151.84 51.06 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.275 -0.421 . . . . 0.0 111.046 -179.842 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 14' ' ' TYR . . . . . 0.428 ' CD1' ' HB2' ' A' ' 32' ' ' ALA . 11.8 m-85 -77.74 -3.96 43.89 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.881 179.942 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 15.7 t -122.3 173.85 7.36 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.007 -179.997 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -54.78 144.18 23.18 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.279 -179.987 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 17' ' ' CYS . . . . . 0.509 ' SG ' ' HE3' ' A' ' 33' ' ' LYS . 71.7 m -45.78 139.45 5.07 Favored Pre-proline 0 C--N 1.331 -0.228 0 CA-C-N 115.824 -0.626 . . . . 0.0 111.551 -179.792 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 18' ' ' PRO . . . . . 0.45 ' HG2' ' H ' ' A' ' 19' ' ' ILE . 68.1 Cg_endo -76.43 -83.3 0.0 OUTLIER 'Trans proline' 0 C--N 1.347 0.452 0 C-N-CA 122.498 2.132 . . . . 0.0 112.289 179.853 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 19' ' ' ILE . . . . . 0.604 HG13 ' H ' ' A' ' 20' ' ' PHE . 0.8 OUTLIER -56.53 -171.18 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.535 0.391 0 CA-C-O 120.859 0.362 . . . . 0.0 111.619 179.884 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 20' ' ' PHE . . . . . 0.604 ' H ' HG13 ' A' ' 19' ' ' ILE . 3.8 p90 -69.96 15.48 0.08 Allowed 'General case' 0 CA--C 1.533 0.291 0 N-CA-C 111.982 0.364 . . . . 0.0 111.982 -179.664 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 21' ' ' THR . . . . . 0.632 ' HB ' ' SG ' ' A' ' 35' ' ' CYS . 0.6 OUTLIER -63.15 -172.71 0.05 OUTLIER 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 120.851 0.358 . . . . 0.0 111.268 179.809 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -151.54 118.07 5.7 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.066 179.945 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 23' ' ' ILE . . . . . 0.586 HD12 ' HD2' ' A' ' 33' ' ' LYS . 0.2 OUTLIER -64.76 120.67 12.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.735 179.99 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 24' ' ' GLN . . . . . 0.583 ' HB2' ' HZ2' ' A' ' 36' ' ' LYS . 1.0 OUTLIER -88.39 -28.84 20.69 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.552 179.922 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -177.47 -130.28 1.36 Allowed Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 121.026 -0.607 . . . . 0.0 112.219 179.998 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 26' ' ' THR . . . . . 0.63 ' HA ' ' HA ' ' A' ' 33' ' ' LYS . 0.6 OUTLIER -116.79 145.74 43.32 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.9 0.381 . . . . 0.0 111.037 179.831 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 25.5 t -94.37 -78.47 0.44 Allowed 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.839 -179.87 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 28' ' ' TYR . . . . . 0.509 ' HB3' ' NZ ' ' A' ' 31' ' ' LYS . 22.7 m-85 -60.12 -176.92 0.05 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.842 -0.617 . . . . 0.0 111.039 -179.979 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 29' ' ' ARG . . . . . 0.416 HH11 ' HD3' ' A' ' 29' ' ' ARG . 7.0 mmt-85 -50.31 -24.41 2.93 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.218 -179.988 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 153.65 32.75 0.03 OUTLIER Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.885 -0.674 . . . . 0.0 112.342 179.873 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 31' ' ' LYS . . . . . 0.509 ' NZ ' ' HB3' ' A' ' 28' ' ' TYR . 2.0 mttp -111.17 -35.76 5.8 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.759 0.314 . . . . 0.0 110.927 -179.968 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 32' ' ' ALA . . . . . 0.428 ' HB2' ' CD1' ' A' ' 14' ' ' TYR . . . -128.86 153.79 47.11 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.299 -0.41 . . . . 0.0 110.995 -179.983 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 33' ' ' LYS . . . . . 0.63 ' HA ' ' HA ' ' A' ' 26' ' ' THR . 0.0 OUTLIER -92.81 144.94 24.79 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.938 -179.869 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -88.36 128.18 35.5 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.456 179.86 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 35' ' ' CYS . . . . . 0.632 ' SG ' ' HB ' ' A' ' 21' ' ' THR . 2.5 t -130.06 150.17 51.45 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.195 -179.54 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 36' ' ' LYS . . . . . 0.583 ' HZ2' ' HB2' ' A' ' 24' ' ' GLN . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.044 0 CA-C-O 118.284 -0.865 . . . . 0.0 110.959 179.999 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 6.8 t-80 . . . . . 0 C--O 1.232 0.146 0 CA-C-O 120.874 0.369 . . . . 0.0 110.71 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 7.8 t80 -60.57 164.48 4.5 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.714 179.78 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 1.1 t30 -71.18 85.32 0.75 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.075 0.464 . . . . 0.0 110.51 179.683 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 5' ' ' CYS . . . . . 0.586 ' HA ' ' HG2' ' A' ' 36' ' ' LYS . 0.1 OUTLIER -102.54 -72.43 0.69 Allowed 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.686 -0.688 . . . . 0.0 110.668 -179.865 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 13.9 p -53.9 -19.74 3.32 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-N 115.973 -0.558 . . . . 0.0 111.132 179.723 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 3.3 p -45.13 -44.28 10.48 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 115.938 -0.574 . . . . 0.0 111.402 -179.972 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 3.1 p -113.89 1.06 14.63 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.974 -179.948 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 103.94 44.6 1.61 Allowed Glycine 0 N--CA 1.451 -0.334 0 C-N-CA 120.736 -0.745 . . . . 0.0 112.181 -179.846 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -85.99 -176.18 49.99 Favored Glycine 0 N--CA 1.45 -0.394 0 C-N-CA 120.795 -0.717 . . . . 0.0 112.499 -179.881 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 5.0 mp0 -147.91 150.13 33.51 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.753 0.311 . . . . 0.0 110.797 179.985 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 12' ' ' CYS . . . . . 0.415 ' C ' HD22 ' A' ' 13' ' ' LEU . 0.1 OUTLIER -108.18 129.56 55.18 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.911 179.969 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 13' ' ' LEU . . . . . 0.57 ' HB2' ' NZ ' ' A' ' 33' ' ' LYS . 3.9 mm? -121.15 157.26 30.56 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.959 -179.847 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 60.0 m-85 -82.9 -18.91 38.51 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.78 179.852 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -126.88 -175.58 3.46 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.864 -179.946 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -51.06 140.16 16.4 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.064 -0.516 . . . . 0.0 111.14 179.915 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 17' ' ' CYS . . . . . 0.617 ' SG ' ' HE3' ' A' ' 33' ' ' LYS . 82.9 m -45.52 137.89 5.25 Favored Pre-proline 0 C--N 1.331 -0.21 0 CA-C-N 116.081 -0.509 . . . . 0.0 111.555 -179.782 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 18' ' ' PRO . . . . . 0.456 ' HD3' ' HA ' ' A' ' 17' ' ' CYS . 50.7 Cg_endo -89.75 -73.34 0.0 OUTLIER 'Trans proline' 0 N--CA 1.454 -0.796 0 C-N-CA 122.957 2.438 . . . . 0.0 112.231 179.802 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 19' ' ' ILE . . . . . 0.612 HG13 ' H ' ' A' ' 20' ' ' PHE . 0.7 OUTLIER -56.47 -173.45 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.534 0.338 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.456 179.738 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 20' ' ' PHE . . . . . 0.612 ' H ' HG13 ' A' ' 19' ' ' ILE . 2.1 p90 -78.1 40.03 0.32 Allowed 'General case' 0 C--N 1.332 -0.196 0 CA-C-N 116.563 -0.29 . . . . 0.0 111.594 -179.753 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 21' ' ' THR . . . . . 0.58 ' HB ' ' SG ' ' A' ' 35' ' ' CYS . 0.7 OUTLIER -89.48 -161.01 0.73 Allowed 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.567 -0.288 . . . . 0.0 110.631 179.448 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 22' ' ' LYS . . . . . 0.409 ' H ' ' HB ' ' A' ' 21' ' ' THR . 15.8 tttt -159.07 108.91 1.95 Allowed 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 120.721 0.296 . . . . 0.0 111.399 -179.953 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 23' ' ' ILE . . . . . 0.933 HD13 ' HB2' ' A' ' 33' ' ' LYS . 0.2 OUTLIER -60.39 126.61 18.51 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.226 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.735 179.592 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 24' ' ' GLN . . . . . 0.533 ' HB2' ' HE2' ' A' ' 36' ' ' LYS . 1.5 tp60 -111.66 -56.49 2.38 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.042 -0.527 . . . . 0.0 110.882 179.894 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -140.75 -160.96 8.5 Favored Glycine 0 N--CA 1.452 -0.29 0 C-N-CA 120.814 -0.708 . . . . 0.0 112.337 179.857 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -92.65 147.9 22.5 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.985 0.421 . . . . 0.0 111.231 179.917 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 27' ' ' CYS . . . . . 0.423 ' HB3' ' H ' ' A' ' 28' ' ' TYR . 0.1 OUTLIER -93.18 -92.71 0.16 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.951 -0.568 . . . . 0.0 111.002 -179.898 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 28' ' ' TYR . . . . . 0.423 ' H ' ' HB3' ' A' ' 27' ' ' CYS . 15.4 m-85 -61.24 -160.49 0.01 OUTLIER 'General case' 0 CA--C 1.53 0.209 0 CA-C-O 120.985 0.422 . . . . 0.0 111.46 -179.878 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 14.6 ttm-85 -50.08 -36.4 29.24 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 116.012 -0.54 . . . . 0.0 111.298 -179.905 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 154.44 34.08 0.03 OUTLIER Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.634 -0.793 . . . . 0.0 112.592 -179.974 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 31.8 mmtt -110.82 -20.58 12.42 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.924 0.392 . . . . 0.0 110.822 179.944 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -136.55 145.18 44.73 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.862 179.975 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 33' ' ' LYS . . . . . 0.933 ' HB2' HD13 ' A' ' 23' ' ' ILE . 0.1 OUTLIER -93.29 130.25 39.09 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.284 -0.416 . . . . 0.0 111.006 -179.799 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -69.27 127.67 33.89 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.547 179.679 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 35' ' ' CYS . . . . . 0.58 ' SG ' ' HB ' ' A' ' 21' ' ' THR . 6.8 t -131.44 132.78 44.58 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.169 -179.649 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 36' ' ' LYS . . . . . 0.586 ' HG2' ' HA ' ' A' ' 5' ' ' CYS . 0.0 OUTLIER . . . . . 0 C--O 1.25 1.083 0 CA-C-O 118.23 -0.891 . . . . 0.0 110.94 179.951 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 9.7 t-80 . . . . . 0 C--O 1.232 0.159 0 CA-C-O 120.873 0.368 . . . . 0.0 111.104 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 5.6 t80 -65.09 169.47 5.41 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.824 179.76 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 1.3 m-80 -74.88 81.33 2.14 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 121.181 0.515 . . . . 0.0 110.532 179.71 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 1.2 m -111.64 -64.14 1.33 Allowed 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.482 -0.781 . . . . 0.0 111.086 -179.527 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 9.4 p -54.25 -15.0 0.98 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.215 0 CA-C-N 115.942 -0.572 . . . . 0.0 111.324 179.833 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -44.96 -53.31 7.81 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.914 -0.585 . . . . 0.0 111.592 -179.785 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -96.5 -22.26 17.21 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.395 -0.366 . . . . 0.0 111.072 -179.791 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 133.77 45.6 0.11 Allowed Glycine 0 N--CA 1.452 -0.275 0 C-N-CA 120.887 -0.673 . . . . 0.0 112.257 -179.957 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -99.71 174.27 26.66 Favored Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.784 -0.722 . . . . 0.0 112.731 -179.738 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 3.0 tp60 -149.29 154.43 39.01 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.778 0.323 . . . . 0.0 110.702 179.922 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 12' ' ' CYS . . . . . 0.453 ' HB3' ' HB2' ' A' ' 27' ' ' CYS . 0.0 OUTLIER -105.12 133.7 49.46 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.853 179.968 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 13' ' ' LEU . . . . . 0.496 HD13 ' HD3' ' A' ' 18' ' ' PRO . 3.4 mp -135.5 157.35 47.11 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.198 -0.456 . . . . 0.0 111.155 -179.672 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 14' ' ' TYR . . . . . 0.454 ' CD1' ' HB2' ' A' ' 32' ' ' ALA . 22.9 m-85 -74.6 -10.9 59.99 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.882 179.874 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -124.7 -179.7 4.62 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.687 179.992 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -54.75 144.36 22.52 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.165 179.88 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 8.1 m -45.63 142.99 3.21 Favored Pre-proline 0 C--N 1.331 -0.202 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.34 -179.876 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 18' ' ' PRO . . . . . 0.496 ' HD3' HD13 ' A' ' 13' ' ' LEU . 74.4 Cg_endo -79.05 -80.7 0.0 OUTLIER 'Trans proline' 0 C--N 1.345 0.386 0 C-N-CA 122.541 2.161 . . . . 0.0 112.384 179.997 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 19' ' ' ILE . . . . . 0.463 ' H ' ' HG2' ' A' ' 18' ' ' PRO . 0.9 OUTLIER -56.56 -170.34 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.535 0.402 0 CA-C-N 116.493 -0.321 . . . . 0.0 111.576 179.779 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 20' ' ' PHE . . . . . 0.454 ' N ' HG23 ' A' ' 19' ' ' ILE . 1.3 p90 -76.0 35.56 0.13 Allowed 'General case' 0 N--CA 1.463 0.183 0 CA-C-O 120.711 0.291 . . . . 0.0 111.417 179.987 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 21' ' ' THR . . . . . 0.407 ' H ' ' C ' ' A' ' 19' ' ' ILE . 0.7 OUTLIER -82.09 -165.96 1.13 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.512 -0.313 . . . . 0.0 110.87 179.77 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 22' ' ' LYS . . . . . 0.536 ' HG2' ' O ' ' A' ' 36' ' ' LYS . 0.0 OUTLIER -151.23 130.33 12.65 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.895 0.379 . . . . 0.0 110.479 179.636 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 23' ' ' ILE . . . . . 0.701 HG13 ' HB2' ' A' ' 33' ' ' LYS . 0.0 OUTLIER -81.27 133.12 29.97 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-N 116.158 -0.474 . . . . 0.0 111.206 -179.514 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 24' ' ' GLN . . . . . 0.547 ' HB2' ' HE2' ' A' ' 36' ' ' LYS . 0.6 OUTLIER -107.75 -66.98 0.99 Allowed 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.581 -0.736 . . . . 0.0 111.088 -179.84 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -132.04 -130.04 3.09 Favored Glycine 0 N--CA 1.452 -0.289 0 C-N-CA 120.769 -0.729 . . . . 0.0 112.56 -179.927 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 26' ' ' THR . . . . . 0.591 ' HA ' ' HA ' ' A' ' 33' ' ' LYS . 44.4 p -125.11 153.67 42.61 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.054 0.455 . . . . 0.0 111.502 -179.807 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 27' ' ' CYS . . . . . 0.453 ' HB2' ' HB3' ' A' ' 12' ' ' CYS . 0.1 OUTLIER -100.56 -84.52 0.43 Allowed 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.558 -0.747 . . . . 0.0 111.299 -179.684 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 22.6 m-85 -61.12 -160.52 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.726 -0.67 . . . . 0.0 111.861 -179.447 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 10.7 ttt85 -49.72 -34.55 19.17 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 115.786 -0.643 . . . . 0.0 111.096 -179.918 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 149.6 22.07 0.07 OUTLIER Glycine 0 N--CA 1.451 -0.357 0 C-N-CA 120.646 -0.787 . . . . 0.0 112.738 179.81 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -98.93 -10.89 22.18 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.755 0.312 . . . . 0.0 110.968 179.881 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 32' ' ' ALA . . . . . 0.454 ' HB2' ' CD1' ' A' ' 14' ' ' TYR . . . -144.51 146.83 32.61 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.288 -0.415 . . . . 0.0 111.156 179.987 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 33' ' ' LYS . . . . . 0.701 ' HB2' HG13 ' A' ' 23' ' ' ILE . 0.0 OUTLIER -99.86 141.52 32.57 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.789 179.914 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -74.72 144.04 43.87 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.028 -0.533 . . . . 0.0 111.718 -179.404 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 35' ' ' CYS . . . . . 0.493 ' SG ' ' HE2' ' A' ' 33' ' ' LYS . 84.7 m -134.98 143.89 47.09 Favored 'General case' 0 C--N 1.332 -0.154 0 CA-C-N 115.806 -0.634 . . . . 0.0 110.55 179.59 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 36' ' ' LYS . . . . . 0.547 ' HE2' ' HB2' ' A' ' 24' ' ' GLN . 0.0 OUTLIER . . . . . 0 C--O 1.248 1.017 0 CA-C-O 118.252 -0.88 . . . . 0.0 111.081 179.962 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 11.5 t-160 . . . . . 0 C--O 1.232 0.162 0 CA-C-O 120.772 0.32 . . . . 0.0 110.943 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 9.7 t80 -57.51 172.66 0.33 Allowed 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.047 179.946 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 5.1 m120 -77.3 76.91 3.84 Favored 'General case' 0 N--CA 1.448 -0.541 0 CA-C-O 121.248 0.547 . . . . 0.0 110.577 179.778 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -110.08 -64.69 1.23 Allowed 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.384 -0.825 . . . . 0.0 110.392 179.788 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -54.59 -16.84 1.73 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.177 0 CA-C-N 115.915 -0.584 . . . . 0.0 111.1 179.47 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 40.0 t -45.5 -40.46 8.5 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 115.846 -0.615 . . . . 0.0 111.212 -179.984 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -115.16 -0.77 13.17 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.777 179.957 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 113.07 34.7 1.77 Allowed Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 120.798 -0.715 . . . . 0.0 112.551 179.877 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -86.22 170.85 43.51 Favored Glycine 0 N--CA 1.451 -0.359 0 C-N-CA 120.809 -0.71 . . . . 0.0 112.559 -179.946 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -150.12 156.48 41.72 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.823 0.344 . . . . 0.0 110.854 179.977 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 0.2 OUTLIER -75.77 117.02 17.08 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.232 -179.88 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 13' ' ' LEU . . . . . 0.566 ' HG ' ' HD3' ' A' ' 18' ' ' PRO . 1.5 mm? -102.92 105.9 16.35 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.231 179.238 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 7.3 m-85 -50.82 -20.56 1.33 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.361 -179.714 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -125.55 176.11 7.08 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.805 179.827 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -52.52 146.29 10.13 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.108 -0.496 . . . . 0.0 111.047 179.912 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 17' ' ' CYS . . . . . 0.416 ' HA ' ' HD3' ' A' ' 18' ' ' PRO . 0.0 OUTLIER -45.2 122.07 5.02 Favored Pre-proline 0 C--N 1.33 -0.239 0 CA-C-N 115.939 -0.573 . . . . 0.0 111.255 -179.765 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 18' ' ' PRO . . . . . 0.566 ' HD3' ' HG ' ' A' ' 13' ' ' LEU . 58.2 Cg_endo -88.43 -72.5 0.0 OUTLIER 'Trans proline' 0 N--CA 1.456 -0.732 0 C-N-CA 122.788 2.326 . . . . 0.0 112.524 -179.829 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 19' ' ' ILE . . . . . 0.701 HG12 ' H ' ' A' ' 20' ' ' PHE . 9.0 tt -55.92 -176.01 0.02 OUTLIER 'Isoleucine or valine' 0 CA--C 1.533 0.306 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.457 179.967 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 20' ' ' PHE . . . . . 0.701 ' H ' HG12 ' A' ' 19' ' ' ILE . 0.6 OUTLIER -76.62 32.17 0.13 Allowed 'General case' 0 C--N 1.33 -0.249 0 N-CA-C 112.032 0.382 . . . . 0.0 112.032 -179.391 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 21' ' ' THR . . . . . 0.44 ' HB ' ' H ' ' A' ' 22' ' ' LYS . 0.9 OUTLIER -83.37 -154.3 0.15 Allowed 'General case' 0 C--N 1.332 -0.161 0 CA-C-O 120.575 0.226 . . . . 0.0 110.693 179.322 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 22' ' ' LYS . . . . . 0.44 ' H ' ' HB ' ' A' ' 21' ' ' THR . 0.1 OUTLIER -158.01 105.58 1.96 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.546 -0.297 . . . . 0.0 110.675 179.694 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 23' ' ' ILE . . . . . 0.564 ' HB ' ' SG ' ' A' ' 35' ' ' CYS . 0.0 OUTLIER -64.75 137.78 24.33 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.238 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.737 -179.999 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -112.77 -69.84 0.84 Allowed 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.72 179.822 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -127.68 -143.58 5.74 Favored Glycine 0 N--CA 1.45 -0.426 0 C-N-CA 120.92 -0.657 . . . . 0.0 112.487 179.986 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -115.77 143.65 45.09 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.042 0.449 . . . . 0.0 111.429 -179.845 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 27' ' ' CYS . . . . . 0.435 ' HB3' ' H ' ' A' ' 28' ' ' TYR . 2.1 t -81.89 -88.39 0.08 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.805 -0.634 . . . . 0.0 110.629 179.835 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 28' ' ' TYR . . . . . 0.435 ' H ' ' HB3' ' A' ' 27' ' ' CYS . 15.7 m-85 -62.12 -153.41 0.01 OUTLIER 'General case' 0 CA--C 1.532 0.262 0 CA-C-N 116.076 -0.511 . . . . 0.0 111.459 179.824 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -50.17 -35.86 27.95 Favored 'General case' 0 C--N 1.333 -0.119 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.577 -179.766 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 149.5 28.27 0.06 OUTLIER Glycine 0 N--CA 1.452 -0.295 0 C-N-CA 120.585 -0.817 . . . . 0.0 112.699 -179.943 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 1.6 mttp -102.12 -26.31 13.41 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.928 0.394 . . . . 0.0 110.607 179.871 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -122.75 139.74 53.65 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.922 179.943 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 33' ' ' LYS . . . . . 0.476 ' HE2' HG13 ' A' ' 23' ' ' ILE . 14.5 mtpt -92.59 120.86 33.44 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.363 -0.38 . . . . 0.0 110.743 179.918 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -64.13 111.71 2.68 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.01 -0.541 . . . . 0.0 111.033 -179.822 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 35' ' ' CYS . . . . . 0.564 ' SG ' ' HB ' ' A' ' 23' ' ' ILE . 1.8 m -106.69 138.44 42.86 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.821 -179.896 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.048 0 CA-C-O 118.213 -0.899 . . . . 0.0 111.055 179.72 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 C--O 1.232 0.158 0 CA-C-O 120.881 0.372 . . . . 0.0 110.794 . . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 2.4 t80 -64.93 156.44 31.11 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.591 179.894 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 6.4 p-10 -72.15 83.94 1.01 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 121.309 0.576 . . . . 0.0 111.324 -179.618 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 5' ' ' CYS . . . . . 0.416 ' HA ' ' HG2' ' A' ' 36' ' ' LYS . 0.0 OUTLIER -97.76 -65.21 0.98 Allowed 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.475 -0.784 . . . . 0.0 110.009 179.38 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 14.6 p -53.9 -18.4 2.23 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 115.141 -0.936 . . . . 0.0 111.389 179.676 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 6.8 t -42.19 -48.73 4.89 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 115.975 -0.557 . . . . 0.0 111.532 -179.632 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -111.84 -22.23 11.22 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.375 -0.375 . . . . 0.0 110.794 179.868 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 133.17 53.25 0.08 OUTLIER Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.934 -0.65 . . . . 0.0 112.258 -179.962 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -89.98 -178.54 44.7 Favored Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.823 -0.703 . . . . 0.0 112.69 -179.762 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -149.32 141.19 23.7 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.748 0.309 . . . . 0.0 110.649 -179.962 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -93.2 125.79 37.97 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.912 -179.936 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -123.51 155.18 38.04 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.771 179.867 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 85.8 m-85 -82.47 -31.38 29.41 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.978 -179.808 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -104.1 171.98 7.05 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.793 179.926 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -54.9 149.55 11.38 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.064 -0.517 . . . . 0.0 111.242 -179.931 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 17' ' ' CYS . . . . . 0.425 ' HA ' ' HD3' ' A' ' 18' ' ' PRO . 0.1 OUTLIER -45.43 123.53 5.68 Favored Pre-proline 0 C--N 1.33 -0.278 0 CA-C-N 115.692 -0.686 . . . . 0.0 111.051 179.932 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 18' ' ' PRO . . . . . 0.425 ' HD3' ' HA ' ' A' ' 17' ' ' CYS . 42.2 Cg_endo -90.63 -72.96 0.0 OUTLIER 'Trans proline' 0 N--CA 1.456 -0.723 0 C-N-CA 122.876 2.384 . . . . 0.0 112.864 -179.51 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 19' ' ' ILE . . . . . 0.659 HG13 ' H ' ' A' ' 20' ' ' PHE . 1.6 tp -56.13 -170.97 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.536 0.407 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.617 -179.728 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 20' ' ' PHE . . . . . 0.659 ' H ' HG13 ' A' ' 19' ' ' ILE . 4.5 p90 -71.03 23.12 0.04 OUTLIER 'General case' 0 CA--C 1.531 0.236 0 N-CA-C 112.227 0.455 . . . . 0.0 112.227 -179.347 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 21' ' ' THR . . . . . 0.451 ' H ' ' C ' ' A' ' 19' ' ' ILE . 0.8 OUTLIER -81.91 -165.73 1.06 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.537 0.208 . . . . 0.0 110.642 179.406 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 22' ' ' LYS . . . . . 0.405 ' H ' ' HB ' ' A' ' 21' ' ' THR . 40.0 tttp -161.97 117.31 1.97 Allowed 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 120.876 0.369 . . . . 0.0 111.13 179.928 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 23' ' ' ILE . . . . . 0.431 ' HB ' ' NZ ' ' A' ' 33' ' ' LYS . 0.8 OUTLIER -67.45 135.74 27.94 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.853 179.745 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 24' ' ' GLN . . . . . 0.58 ' HB2' ' NZ ' ' A' ' 36' ' ' LYS . 1.7 mp0 -114.7 -42.43 3.26 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.895 -0.593 . . . . 0.0 110.826 -179.924 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -154.54 -131.32 1.49 Allowed Glycine 0 N--CA 1.451 -0.363 0 C-N-CA 120.899 -0.667 . . . . 0.0 112.371 179.922 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 26' ' ' THR . . . . . 0.601 ' HA ' ' HA ' ' A' ' 33' ' ' LYS . 15.6 p -122.49 141.15 51.95 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.841 0.353 . . . . 0.0 111.177 179.886 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 27' ' ' CYS . . . . . 0.466 ' HB3' ' H ' ' A' ' 28' ' ' TYR . 0.2 OUTLIER -82.99 -91.29 0.08 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.013 -0.54 . . . . 0.0 111.056 -179.842 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 28' ' ' TYR . . . . . 0.466 ' H ' ' HB3' ' A' ' 27' ' ' CYS . 23.7 m-85 -60.94 -168.02 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.166 0 CA-C-O 120.962 0.411 . . . . 0.0 111.206 -179.985 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 5.4 ttt-85 -50.39 -35.86 30.17 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 115.985 -0.552 . . . . 0.0 111.301 -179.938 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 159.66 44.39 0.02 OUTLIER Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.676 -0.773 . . . . 0.0 112.593 179.962 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 9.8 mtpt -119.73 -14.16 9.05 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.896 0.379 . . . . 0.0 110.651 179.798 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -154.35 147.27 24.48 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.668 179.858 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 33' ' ' LYS . . . . . 0.601 ' HA ' ' HA ' ' A' ' 26' ' ' THR . 0.0 OUTLIER -92.08 146.03 24.05 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.977 0.418 . . . . 0.0 110.937 -179.843 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 0.2 OUTLIER -77.63 135.2 38.09 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.895 -0.593 . . . . 0.0 111.091 -179.74 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 0.9 OUTLIER -136.57 128.97 30.16 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.972 179.88 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 36' ' ' LYS . . . . . 0.58 ' NZ ' ' HB2' ' A' ' 24' ' ' GLN . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.054 0 CA-C-O 118.245 -0.883 . . . . 0.0 110.748 179.802 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 7.2 t-80 . . . . . 0 C--O 1.231 0.117 0 CA-C-O 120.855 0.36 . . . . 0.0 110.709 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 2.4 t80 -63.81 167.29 6.18 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.619 179.834 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 1.4 t-20 -80.47 76.91 7.29 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.344 0.592 . . . . 0.0 110.265 179.567 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 5' ' ' CYS . . . . . 0.645 ' HA ' ' HD2' ' A' ' 36' ' ' LYS . 0.0 OUTLIER -101.3 -63.54 1.13 Allowed 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.085 -0.961 . . . . 0.0 110.643 -179.722 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 10.8 p -54.29 -16.91 1.6 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-N 115.827 -0.624 . . . . 0.0 111.134 179.586 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -38.03 -48.61 1.22 Allowed 'General case' 0 N--CA 1.462 0.174 0 CA-C-N 115.788 -0.642 . . . . 0.0 111.89 -179.725 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -109.28 -29.05 8.66 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.433 -0.349 . . . . 0.0 111.095 -179.916 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 142.69 45.52 0.05 OUTLIER Glycine 0 N--CA 1.452 -0.249 0 C-N-CA 120.804 -0.713 . . . . 0.0 112.428 -179.924 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -97.91 169.21 24.08 Favored Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.732 -0.747 . . . . 0.0 112.567 -179.882 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 12.7 mt-30 -143.11 148.86 37.3 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.75 0.31 . . . . 0.0 110.63 179.978 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 12' ' ' CYS . . . . . 0.494 ' HA ' ' O ' ' A' ' 33' ' ' LYS . 0.0 OUTLIER -103.0 125.11 49.62 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.297 -0.411 . . . . 0.0 111.222 -179.903 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -122.62 143.56 49.68 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.41 179.623 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 26.8 m-85 -60.31 -10.58 4.87 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.351 -0.386 . . . . 0.0 111.261 -179.755 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -114.07 155.69 25.5 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.788 179.613 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -54.95 157.82 3.06 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.284 179.823 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 17' ' ' CYS . . . . . 0.434 ' HB2' HG22 ' A' ' 23' ' ' ILE . 0.1 OUTLIER -44.91 112.08 1.42 Allowed Pre-proline 0 C--N 1.327 -0.39 0 CA-C-N 115.452 -0.794 . . . . 0.0 111.2 179.926 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 60.9 Cg_endo -87.78 -72.46 0.0 OUTLIER 'Trans proline' 0 N--CA 1.457 -0.619 0 C-N-CA 122.724 2.282 . . . . 0.0 112.664 -179.839 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 19' ' ' ILE . . . . . 0.587 HG12 ' H ' ' A' ' 20' ' ' PHE . 4.6 tt -56.37 -169.85 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.534 0.34 0 CA-C-N 116.321 -0.4 . . . . 0.0 111.588 -179.979 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 20' ' ' PHE . . . . . 0.587 ' H ' HG12 ' A' ' 19' ' ' ILE . 5.8 p90 -76.64 36.01 0.16 Allowed 'General case' 0 CA--C 1.53 0.179 0 N-CA-C 111.859 0.318 . . . . 0.0 111.859 -179.616 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 21' ' ' THR . . . . . 0.436 ' HB ' ' HB3' ' A' ' 35' ' ' CYS . 0.3 OUTLIER -88.08 -161.21 0.7 Allowed 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.662 0.268 . . . . 0.0 110.758 179.39 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 22' ' ' LYS . . . . . 0.422 ' H ' ' HB ' ' A' ' 21' ' ' THR . 1.4 tttm -157.58 103.1 1.91 Allowed 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.86 0.362 . . . . 0.0 111.028 -179.931 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 23' ' ' ILE . . . . . 0.524 HD13 ' HB3' ' A' ' 33' ' ' LYS . 1.4 tp -69.67 131.91 33.63 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.224 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.994 179.745 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 24' ' ' GLN . . . . . 0.502 ' HB2' ' HE3' ' A' ' 36' ' ' LYS . 18.6 mt-30 -114.29 -66.5 1.08 Allowed 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.125 179.346 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -125.52 167.07 17.99 Favored Glycine 0 N--CA 1.449 -0.478 0 CA-C-N 115.511 -0.768 . . . . 0.0 111.401 179.175 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 1.7 p -75.77 154.62 36.19 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 121.261 0.553 . . . . 0.0 111.16 -179.955 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 27' ' ' CYS . . . . . 0.493 ' HB3' ' H ' ' A' ' 28' ' ' TYR . 5.4 t -84.35 -96.15 0.06 Allowed 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.317 -0.856 . . . . 0.0 111.252 -179.55 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 28' ' ' TYR . . . . . 0.493 ' H ' ' HB3' ' A' ' 27' ' ' CYS . 61.7 m-85 -61.65 -144.06 0.0 OUTLIER 'General case' 0 CA--C 1.534 0.349 0 CA-C-N 115.982 -0.554 . . . . 0.0 111.628 -179.796 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 29' ' ' ARG . . . . . 0.403 ' HD2' HH11 ' A' ' 29' ' ' ARG . 7.6 mtt180 -48.16 -42.82 30.63 Favored 'General case' 0 C--O 1.232 0.133 0 CA-C-O 120.801 0.334 . . . . 0.0 111.402 -179.625 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 153.39 24.62 0.04 OUTLIER Glycine 0 N--CA 1.451 -0.363 0 C-N-CA 120.767 -0.73 . . . . 0.0 112.566 -179.94 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -99.86 -40.85 7.49 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.75 0.309 . . . . 0.0 110.932 179.953 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -97.76 139.26 33.89 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.887 179.937 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 33' ' ' LYS . . . . . 0.524 ' HB3' HD13 ' A' ' 23' ' ' ILE . 0.8 OUTLIER -91.63 126.53 36.74 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.914 0.388 . . . . 0.0 110.881 -179.937 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -83.08 104.39 13.24 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.911 -0.586 . . . . 0.0 111.045 179.869 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 35' ' ' CYS . . . . . 0.519 ' SG ' ' HB ' ' A' ' 23' ' ' ILE . 30.4 m -98.24 144.13 28.0 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.742 179.947 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 36' ' ' LYS . . . . . 0.645 ' HD2' ' HA ' ' A' ' 5' ' ' CYS . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.073 0 CA-C-O 118.198 -0.906 . . . . 0.0 110.872 179.753 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 6.0 t-80 . . . . . 0 C--O 1.231 0.121 0 CA-C-O 120.857 0.361 . . . . 0.0 110.673 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 5.7 t80 -57.5 158.8 5.47 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.744 179.962 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -70.24 82.41 0.53 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.215 0.531 . . . . 0.0 110.819 -179.916 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 5' ' ' CYS . . . . . 0.794 ' HA ' ' HG2' ' A' ' 36' ' ' LYS . 0.1 OUTLIER -100.8 -72.96 0.66 Allowed 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.475 -0.784 . . . . 0.0 110.29 179.596 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 6' ' ' VAL . . . . . 0.525 ' HA ' ' H ' ' A' ' 10' ' ' GLY . 9.9 p -54.0 -17.58 1.83 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 115.621 -0.718 . . . . 0.0 111.247 179.452 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -45.03 -48.65 11.67 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-N 115.834 -0.621 . . . . 0.0 111.443 -179.895 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 55.2 p -115.18 -4.35 12.46 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.94 179.991 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 123.46 53.43 0.2 Allowed Glycine 0 N--CA 1.452 -0.284 0 C-N-CA 120.725 -0.75 . . . . 0.0 112.494 179.886 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 10' ' ' GLY . . . . . 0.525 ' H ' ' HA ' ' A' ' 6' ' ' VAL . . . -97.09 171.16 26.75 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.804 -0.712 . . . . 0.0 112.467 -179.972 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 6.1 tp-100 -148.6 145.93 28.02 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.806 0.336 . . . . 0.0 110.911 -179.999 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 12' ' ' CYS . . . . . 0.458 ' HB3' ' HB2' ' A' ' 27' ' ' CYS . 0.1 OUTLIER -100.6 110.71 22.87 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.04 -179.893 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 13' ' ' LEU . . . . . 0.46 ' O ' ' HG3' ' A' ' 33' ' ' LYS . 11.0 mt -119.67 147.64 44.31 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.918 179.891 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 1.4 m-85 -88.86 16.29 7.12 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.957 179.934 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 15' ' ' SER . . . . . 0.452 ' O ' ' HD3' ' A' ' 33' ' ' LYS . 8.5 p -139.79 158.4 44.15 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.89 179.908 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -48.79 140.66 8.3 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.381 -179.879 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 17' ' ' CYS . . . . . 0.43 ' HA ' ' HD3' ' A' ' 18' ' ' PRO . 0.2 OUTLIER -45.96 123.88 6.53 Favored Pre-proline 0 C--N 1.332 -0.176 0 CA-C-N 115.888 -0.596 . . . . 0.0 111.379 -179.875 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 18' ' ' PRO . . . . . 0.43 ' HD3' ' HA ' ' A' ' 17' ' ' CYS . 56.8 Cg_endo -89.38 -73.65 0.0 OUTLIER 'Trans proline' 0 N--CA 1.455 -0.747 0 C-N-CA 122.895 2.396 . . . . 0.0 112.69 -179.812 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 19' ' ' ILE . . . . . 0.667 HG12 ' H ' ' A' ' 20' ' ' PHE . 6.6 tt -56.47 -174.21 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.535 0.375 0 CA-C-N 116.492 -0.322 . . . . 0.0 111.567 -179.894 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 20' ' ' PHE . . . . . 0.667 ' H ' HG12 ' A' ' 19' ' ' ILE . 50.8 p90 -70.1 17.63 0.06 Allowed 'General case' 0 CA--C 1.531 0.224 0 N-CA-C 112.472 0.545 . . . . 0.0 112.472 -179.285 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 21' ' ' THR . . . . . 0.513 ' OG1' HG22 ' A' ' 19' ' ' ILE . 0.7 OUTLIER -74.91 -174.24 2.15 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.744 0.307 . . . . 0.0 110.683 179.417 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 10.0 ptmt -147.31 127.65 13.95 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.999 179.807 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 23' ' ' ILE . . . . . 0.707 ' HB ' ' HE3' ' A' ' 33' ' ' LYS . 0.2 OUTLIER -81.26 119.78 31.56 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.645 179.802 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 24' ' ' GLN . . . . . 0.704 ' HB2' ' HE2' ' A' ' 36' ' ' LYS . 0.5 OUTLIER -95.75 -46.72 6.47 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.763 -179.892 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -152.06 -127.13 1.28 Allowed Glycine 0 N--CA 1.45 -0.391 0 C-N-CA 120.9 -0.667 . . . . 0.0 112.226 179.838 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 26' ' ' THR . . . . . 0.576 ' HA ' ' HA ' ' A' ' 33' ' ' LYS . 17.0 p -131.96 138.76 48.44 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.864 0.364 . . . . 0.0 111.16 179.844 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 27' ' ' CYS . . . . . 0.458 ' HB2' ' HB3' ' A' ' 12' ' ' CYS . 0.1 OUTLIER -71.85 -85.09 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.903 179.995 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 28' ' ' TYR . . . . . 0.414 ' H ' ' HB3' ' A' ' 27' ' ' CYS . 8.5 m-85 -60.84 -168.46 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.193 179.916 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 10.7 tpt180 -50.22 -31.9 15.14 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.049 -0.523 . . . . 0.0 111.148 179.934 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 157.38 36.9 0.02 OUTLIER Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 120.795 -0.717 . . . . 0.0 112.58 179.98 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 1.7 mtpp -113.2 -8.63 13.53 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.804 0.335 . . . . 0.0 110.776 179.886 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -150.86 151.39 32.16 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.288 179.989 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 33' ' ' LYS . . . . . 0.707 ' HE3' ' HB ' ' A' ' 23' ' ' ILE . 0.0 OUTLIER -97.97 139.59 33.58 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.753 -0.658 . . . . 0.0 110.739 179.827 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 34' ' ' CYS . . . . . 0.47 ' O ' ' HA ' ' A' ' 23' ' ' ILE . 0.0 OUTLIER -87.76 134.26 33.71 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.913 179.981 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 35' ' ' CYS . . . . . 0.581 ' SG ' ' HE3' ' A' ' 33' ' ' LYS . 1.0 OUTLIER -130.94 125.73 34.22 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.169 -179.971 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 36' ' ' LYS . . . . . 0.794 ' HG2' ' HA ' ' A' ' 5' ' ' CYS . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.047 0 CA-C-O 118.199 -0.905 . . . . 0.0 110.75 179.661 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 42.2 t60 . . . . . 0 C--O 1.232 0.143 0 CA-C-O 120.801 0.334 . . . . 0.0 111.109 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 10.4 t80 -62.87 160.89 13.74 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.742 179.642 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 4' ' ' ASN . . . . . 0.427 ' O ' ' ND2' ' A' ' 4' ' ' ASN . 0.3 OUTLIER -64.09 91.58 0.07 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.222 0.534 . . . . 0.0 110.213 179.623 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -119.51 -75.87 0.58 Allowed 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.485 -0.78 . . . . 0.0 109.71 179.928 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 6' ' ' VAL . . . . . 0.483 ' HA ' ' H ' ' A' ' 10' ' ' GLY . 8.1 p -54.68 -13.72 0.84 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.191 0 CA-C-N 115.76 -0.655 . . . . 0.0 110.688 178.794 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 41.3 t -38.58 -50.89 1.62 Allowed 'General case' 0 N--CA 1.462 0.146 0 CA-C-N 115.76 -0.654 . . . . 0.0 111.288 179.926 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -110.75 -22.95 11.32 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.903 -0.589 . . . . 0.0 110.75 179.957 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 147.88 41.23 0.04 OUTLIER Glycine 0 N--CA 1.452 -0.273 0 C-N-CA 120.736 -0.745 . . . . 0.0 112.536 179.937 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 10' ' ' GLY . . . . . 0.483 ' H ' ' HA ' ' A' ' 6' ' ' VAL . . . -88.53 170.54 38.78 Favored Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.821 -0.704 . . . . 0.0 112.55 179.993 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -143.74 145.76 32.65 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.787 0.327 . . . . 0.0 110.887 -179.937 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 12' ' ' CYS . . . . . 0.445 ' C ' HD22 ' A' ' 13' ' ' LEU . 1.9 m -95.88 134.68 38.58 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.861 179.934 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 13' ' ' LEU . . . . . 0.445 HD22 ' C ' ' A' ' 12' ' ' CYS . 3.8 mm? -122.75 152.22 40.82 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.849 -179.874 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 90.5 m-85 -88.39 4.54 45.92 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.696 179.833 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 15' ' ' SER . . . . . 0.468 ' O ' ' HD2' ' A' ' 33' ' ' LYS . 5.6 t -153.99 -176.22 5.75 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.858 179.954 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -49.8 137.49 16.24 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.048 -0.524 . . . . 0.0 111.38 -179.945 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 17' ' ' CYS . . . . . 0.406 ' HA ' ' HD3' ' A' ' 18' ' ' PRO . 0.1 OUTLIER -45.86 146.05 2.13 Favored Pre-proline 0 C--N 1.332 -0.183 0 CA-C-N 115.952 -0.567 . . . . 0.0 111.316 179.982 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 18' ' ' PRO . . . . . 0.406 ' HD3' ' HA ' ' A' ' 17' ' ' CYS . 53.0 Cg_endo -90.94 -80.37 0.0 OUTLIER 'Trans proline' 0 N--CA 1.454 -0.795 0 C-N-CA 122.969 2.446 . . . . 0.0 112.656 -179.754 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 19' ' ' ILE . . . . . 0.643 HG12 ' H ' ' A' ' 20' ' ' PHE . 6.1 tt -56.17 -172.38 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.534 0.346 0 CA-C-N 116.375 -0.375 . . . . 0.0 111.664 -179.866 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 20' ' ' PHE . . . . . 0.643 ' H ' HG12 ' A' ' 19' ' ' ILE . 0.2 OUTLIER -75.84 36.6 0.14 Allowed 'General case' 0 CA--C 1.531 0.236 0 N-CA-C 111.947 0.351 . . . . 0.0 111.947 -179.533 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 21' ' ' THR . . . . . 0.432 ' OG1' HG22 ' A' ' 19' ' ' ILE . 0.0 OUTLIER -85.81 -162.95 0.79 Allowed 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 120.526 0.203 . . . . 0.0 110.657 179.354 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 2.1 pttt -155.66 122.22 5.25 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.937 0.399 . . . . 0.0 111.527 -179.907 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 23' ' ' ILE . . . . . 0.463 ' HB ' ' HE3' ' A' ' 33' ' ' LYS . 0.3 OUTLIER -75.66 125.72 35.6 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.47 179.434 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 24' ' ' GLN . . . . . 0.447 ' HA ' HE21 ' A' ' 24' ' ' GLN . 0.0 OUTLIER -103.48 -44.07 5.23 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.174 -0.467 . . . . 0.0 111.104 -179.739 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -146.89 -143.69 3.91 Favored Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.739 -0.743 . . . . 0.0 112.627 -179.92 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 26' ' ' THR . . . . . 0.786 ' HA ' ' HA ' ' A' ' 33' ' ' LYS . 0.0 OUTLIER -120.14 140.41 51.13 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.851 0.357 . . . . 0.0 111.217 -179.908 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 41.6 t -85.97 -80.5 0.23 Allowed 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.89 179.913 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 2.9 m-85 -60.27 -173.72 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.813 -0.63 . . . . 0.0 110.943 179.932 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -50.57 -28.13 8.06 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.934 179.772 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 161.76 10.42 0.04 OUTLIER Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.886 -0.673 . . . . 0.0 112.536 179.954 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -96.74 -16.01 21.09 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.754 0.312 . . . . 0.0 111.161 -179.886 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 32' ' ' ALA . . . . . 0.405 ' O ' HG22 ' A' ' 26' ' ' THR . . . -134.93 150.45 50.4 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.828 179.912 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 33' ' ' LYS . . . . . 0.786 ' HA ' ' HA ' ' A' ' 26' ' ' THR . 0.0 OUTLIER -108.57 143.1 38.05 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.832 179.9 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -79.09 125.4 29.36 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.637 179.97 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -126.15 140.12 52.82 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.818 -179.896 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 36' ' ' LYS . . . . . 0.435 ' HE3' ' HB2' ' A' ' 24' ' ' GLN . 0.0 OUTLIER . . . . . 0 C--O 1.248 1.021 0 CA-C-O 118.22 -0.895 . . . . 0.0 110.895 179.798 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 2.0 t-80 . . . . . 0 C--O 1.232 0.149 0 CA-C-O 120.991 0.424 . . . . 0.0 110.844 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 9.1 t80 -61.38 167.5 3.24 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.688 179.737 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -77.65 77.27 4.17 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.235 0.541 . . . . 0.0 110.684 179.813 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 0.4 OUTLIER -103.89 -76.29 0.6 Allowed 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.298 -0.865 . . . . 0.0 110.494 179.943 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 6' ' ' VAL . . . . . 0.64 ' HA ' ' H ' ' A' ' 10' ' ' GLY . 7.5 p -54.13 -17.76 2.04 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.153 0 CA-C-N 116.019 -0.537 . . . . 0.0 111.126 179.579 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -45.34 -59.04 2.89 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 115.834 -0.621 . . . . 0.0 111.552 -179.912 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 52.4 p -98.81 -20.11 17.05 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.367 -0.379 . . . . 0.0 111.245 -179.643 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 144.49 53.81 0.03 OUTLIER Glycine 0 N--CA 1.452 -0.267 0 C-N-CA 120.688 -0.768 . . . . 0.0 112.605 -179.963 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 10' ' ' GLY . . . . . 0.64 ' H ' ' HA ' ' A' ' 6' ' ' VAL . . . -105.02 159.79 15.53 Favored Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.78 -0.724 . . . . 0.0 112.465 179.924 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 1.2 mt-30 -125.25 153.21 43.54 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.761 0.315 . . . . 0.0 110.909 -179.926 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 12' ' ' CYS . . . . . 0.449 ' C ' HD22 ' A' ' 13' ' ' LEU . 3.1 m -118.59 119.7 35.28 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.086 -179.773 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 13' ' ' LEU . . . . . 0.449 HD22 ' C ' ' A' ' 12' ' ' CYS . 3.2 mm? -124.82 159.1 31.81 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.722 179.928 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 34.2 m-85 -88.56 -5.52 58.14 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.341 -0.39 . . . . 0.0 111.165 -179.921 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 15' ' ' SER . . . . . 0.441 ' O ' ' HD3' ' A' ' 33' ' ' LYS . 2.4 t -128.4 -179.3 4.95 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.372 -0.377 . . . . 0.0 110.917 -179.877 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -48.84 141.64 7.25 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.087 179.966 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 17' ' ' CYS . . . . . 0.419 ' HA ' ' HD3' ' A' ' 18' ' ' PRO . 0.9 OUTLIER -45.63 141.63 3.85 Favored Pre-proline 0 C--N 1.329 -0.318 0 CA-C-N 115.907 -0.588 . . . . 0.0 111.455 -179.756 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 18' ' ' PRO . . . . . 0.419 ' HD3' ' HA ' ' A' ' 17' ' ' CYS . 38.9 Cg_endo -89.84 -81.59 0.0 OUTLIER 'Trans proline' 0 N--CA 1.453 -0.885 0 C-N-CA 122.91 2.407 . . . . 0.0 112.357 179.94 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 19' ' ' ILE . . . . . 0.71 HG13 ' H ' ' A' ' 20' ' ' PHE . 4.3 tp -56.57 -173.95 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.535 0.393 0 CA-C-N 116.406 -0.361 . . . . 0.0 111.638 179.976 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 20' ' ' PHE . . . . . 0.71 ' H ' HG13 ' A' ' 19' ' ' ILE . 7.5 p90 -71.62 21.36 0.05 Allowed 'General case' 0 CA--C 1.535 0.371 0 N-CA-C 112.939 0.718 . . . . 0.0 112.939 -178.876 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 21' ' ' THR . . . . . 0.492 ' OG1' HG22 ' A' ' 19' ' ' ILE . 0.2 OUTLIER -75.71 -172.21 1.81 Allowed 'General case' 0 N--CA 1.463 0.187 0 C-N-CA 121.051 -0.259 . . . . 0.0 110.86 179.288 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 6.4 tttp -145.94 111.59 5.53 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 120.789 0.328 . . . . 0.0 111.093 -179.749 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 23' ' ' ILE . . . . . 0.487 ' HB ' ' HE3' ' A' ' 33' ' ' LYS . 0.2 OUTLIER -58.72 123.97 11.91 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.189 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.009 -179.96 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -99.36 -25.6 14.42 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.84 179.923 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -178.74 -116.87 0.52 Allowed Glycine 0 N--CA 1.451 -0.358 0 C-N-CA 120.828 -0.701 . . . . 0.0 112.391 179.957 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 26' ' ' THR . . . . . 0.707 ' HA ' ' HA ' ' A' ' 33' ' ' LYS . 1.0 OUTLIER -133.78 143.57 48.49 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.983 0.42 . . . . 0.0 111.352 -179.961 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 10.4 t -81.9 -79.3 0.18 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.903 -0.59 . . . . 0.0 110.968 179.973 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 11.3 m-85 -61.28 -160.5 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.002 -0.545 . . . . 0.0 111.427 -179.928 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 12.0 mtm180 -50.13 -39.2 42.37 Favored 'General case' 0 C--N 1.332 -0.156 0 CA-C-N 115.997 -0.547 . . . . 0.0 111.18 -179.944 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 159.26 33.16 0.02 OUTLIER Glycine 0 N--CA 1.451 -0.328 0 C-N-CA 120.811 -0.709 . . . . 0.0 112.486 179.937 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 2.0 mmpt? -107.77 -32.08 7.78 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.894 0.378 . . . . 0.0 110.788 -179.971 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -121.3 150.67 41.07 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.013 -0.54 . . . . 0.0 110.875 179.932 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 33' ' ' LYS . . . . . 0.707 ' HA ' ' HA ' ' A' ' 26' ' ' THR . 0.0 OUTLIER -90.32 145.39 25.01 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.985 -179.872 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 34' ' ' CYS . . . . . 0.416 ' O ' ' HA ' ' A' ' 23' ' ' ILE . 0.0 OUTLIER -95.03 135.7 36.24 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.976 179.948 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 35' ' ' CYS . . . . . 0.579 ' SG ' ' HE3' ' A' ' 33' ' ' LYS . 1.1 m -129.26 140.27 51.51 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.046 -0.525 . . . . 0.0 110.57 179.93 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 36' ' ' LYS . . . . . 0.607 ' HE3' ' H ' ' A' ' 36' ' ' LYS . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.07 0 CA-C-O 118.179 -0.915 . . . . 0.0 111.063 179.844 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 2.0 t-80 . . . . . 0 C--O 1.231 0.125 0 CA-C-O 120.872 0.368 . . . . 0.0 110.674 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 6.5 t80 -63.89 160.51 17.44 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.752 179.897 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -71.83 82.77 0.9 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.184 0.516 . . . . 0.0 110.546 179.727 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -99.66 -67.43 0.85 Allowed 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.469 -0.787 . . . . 0.0 110.498 179.948 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 4.2 p -54.78 -15.5 1.31 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.516 179.645 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -42.63 -52.98 4.65 Favored 'General case' 0 N--CA 1.464 0.252 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.518 -179.646 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 10.7 p -101.73 -1.21 33.0 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.903 -179.904 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 112.89 30.36 2.8 Favored Glycine 0 N--CA 1.451 -0.328 0 C-N-CA 120.7 -0.762 . . . . 0.0 112.168 -179.868 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -84.49 165.01 40.31 Favored Glycine 0 N--CA 1.45 -0.388 0 C-N-CA 120.849 -0.691 . . . . 0.0 112.711 -179.869 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -146.38 142.6 28.37 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.643 0.259 . . . . 0.0 110.674 179.94 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 12' ' ' CYS . . . . . 0.459 ' HA ' ' O ' ' A' ' 33' ' ' LYS . 0.0 OUTLIER -97.1 122.54 40.21 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.887 0.375 . . . . 0.0 111.173 -179.868 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -117.02 147.36 42.4 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.729 179.785 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -51.0 -33.96 27.17 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.059 -0.519 . . . . 0.0 111.4 -179.609 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -108.65 163.26 13.41 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.793 179.957 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -52.86 155.2 2.46 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.543 179.473 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 17' ' ' CYS . . . . . 0.518 ' SG ' ' HB ' ' A' ' 23' ' ' ILE . 3.1 m -44.93 138.66 4.11 Favored Pre-proline 0 C--N 1.327 -0.41 0 CA-C-N 115.901 -0.591 . . . . 0.0 111.342 -179.573 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 18' ' ' PRO . . . . . 0.433 ' HD3' ' HA ' ' A' ' 17' ' ' CYS . 50.2 Cg_endo -88.28 -71.87 0.01 OUTLIER 'Trans proline' 0 N--CA 1.454 -0.837 0 C-N-CA 122.996 2.464 . . . . 0.0 111.801 179.62 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 19' ' ' ILE . . . . . 0.458 ' C ' ' H ' ' A' ' 21' ' ' THR . 1.5 tt -56.97 -168.76 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.535 0.396 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.036 179.177 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 20' ' ' PHE . . . . . 0.45 ' N ' HG23 ' A' ' 19' ' ' ILE . 2.1 p90 -73.43 23.43 0.07 Allowed 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.583 0.23 . . . . 0.0 111.538 179.917 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 21' ' ' THR . . . . . 0.458 ' H ' ' C ' ' A' ' 19' ' ' ILE . 0.2 OUTLIER -65.23 -169.45 0.05 OUTLIER 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 120.766 0.317 . . . . 0.0 111.116 179.844 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -156.15 111.0 2.88 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.701 179.996 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 23' ' ' ILE . . . . . 0.769 HG13 ' HB3' ' A' ' 33' ' ' LYS . 0.0 OUTLIER -75.9 132.66 32.73 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-O 121.044 0.45 . . . . 0.0 111.202 -179.779 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -92.98 -43.57 8.86 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.719 -0.673 . . . . 0.0 110.37 179.42 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -159.47 -138.76 2.53 Favored Glycine 0 N--CA 1.45 -0.399 0 CA-C-N 115.613 -0.721 . . . . 0.0 112.05 179.942 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 26' ' ' THR . . . . . 0.411 HG22 ' HE3' ' A' ' 33' ' ' LYS . 4.1 p -120.71 145.34 47.58 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 120.89 0.376 . . . . 0.0 111.028 179.775 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -80.89 -88.4 0.08 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.971 -179.929 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 8.0 m-85 -61.23 -161.69 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.231 179.908 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -50.29 -34.38 23.24 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.972 179.956 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 151.93 48.6 0.02 OUTLIER Glycine 0 N--CA 1.452 -0.27 0 C-N-CA 120.801 -0.714 . . . . 0.0 112.466 179.878 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -116.43 -35.05 4.39 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.769 0.318 . . . . 0.0 110.917 179.968 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -123.79 140.59 52.83 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.221 -179.973 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 33' ' ' LYS . . . . . 0.769 ' HB3' HG13 ' A' ' 23' ' ' ILE . 1.0 OUTLIER -85.74 130.68 34.5 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.879 -179.953 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -80.82 112.23 18.01 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.534 179.703 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 35' ' ' CYS . . . . . 0.527 ' SG ' ' HB ' ' A' ' 23' ' ' ILE . 68.8 m -113.46 151.37 31.52 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.949 -0.568 . . . . 0.0 110.522 179.982 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 36' ' ' LYS . . . . . 0.437 ' HE3' ' O ' ' A' ' 36' ' ' LYS . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.027 0 CA-C-O 118.232 -0.89 . . . . 0.0 110.93 179.704 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 2' ' ' HIS . . . . . 0.444 ' CE1' HG12 ' A' ' 6' ' ' VAL . 4.1 t-80 . . . . . 0 C--O 1.232 0.152 0 CA-C-O 120.841 0.353 . . . . 0.0 110.841 . . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 3.4 t80 -58.93 150.77 23.45 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.402 179.623 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 4' ' ' ASN . . . . . 0.507 ' OD1' ' HB2' ' A' ' 7' ' ' SER . 4.4 t30 -64.5 86.41 0.05 OUTLIER 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.274 0.559 . . . . 0.0 110.562 179.947 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 5' ' ' CYS . . . . . 0.436 ' HA ' ' HG2' ' A' ' 36' ' ' LYS . 0.1 OUTLIER -116.82 -74.54 0.6 Allowed 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.449 -0.796 . . . . 0.0 110.103 -179.991 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 6' ' ' VAL . . . . . 0.449 ' HA ' ' H ' ' A' ' 10' ' ' GLY . 5.5 p -55.65 -8.17 0.4 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.192 0 CA-C-N 115.946 -0.57 . . . . 0.0 111.21 178.95 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 7' ' ' SER . . . . . 0.507 ' HB2' ' OD1' ' A' ' 4' ' ' ASN . 2.3 t -31.61 -54.02 0.26 Allowed 'General case' 0 N--CA 1.464 0.227 0 CA-C-N 115.755 -0.657 . . . . 0.0 111.553 -179.702 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -115.34 -40.19 3.47 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.695 -0.684 . . . . 0.0 110.754 179.826 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 178.38 41.48 0.07 OUTLIER Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 120.965 -0.636 . . . . 0.0 112.236 -179.975 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 10' ' ' GLY . . . . . 0.449 ' H ' ' HA ' ' A' ' 6' ' ' VAL . . . -94.3 162.77 24.9 Favored Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 120.818 -0.706 . . . . 0.0 112.682 -179.798 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 2.1 pt20 -150.25 150.61 31.77 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.736 0.303 . . . . 0.0 110.675 179.988 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 12' ' ' CYS . . . . . 0.51 ' HB3' ' HB2' ' A' ' 27' ' ' CYS . 0.0 OUTLIER -98.45 114.69 27.15 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.948 0.404 . . . . 0.0 111.384 -179.893 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 13' ' ' LEU . . . . . 0.422 HD22 ' HG3' ' A' ' 18' ' ' PRO . 0.2 OUTLIER -99.69 133.99 43.23 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.211 179.429 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER -53.27 -21.92 6.18 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.398 -0.365 . . . . 0.0 111.184 -179.792 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -114.32 159.24 20.44 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.585 179.618 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -53.22 155.87 2.51 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.332 -0.395 . . . . 0.0 111.131 179.891 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -39.6 112.52 0.78 Allowed Pre-proline 0 C--N 1.328 -0.331 0 CA-C-N 115.427 -0.806 . . . . 0.0 111.749 -179.563 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 18' ' ' PRO . . . . . 0.422 ' HG3' HD22 ' A' ' 13' ' ' LEU . 60.5 Cg_endo -83.56 -72.6 0.01 OUTLIER 'Trans proline' 0 N--CA 1.459 -0.519 0 C-N-CA 122.689 2.26 . . . . 0.0 112.281 179.784 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 19' ' ' ILE . . . . . 0.439 ' C ' ' H ' ' A' ' 21' ' ' THR . 1.2 tt -56.46 -172.8 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.534 0.334 0 CA-C-N 116.408 -0.36 . . . . 0.0 111.375 179.741 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 20' ' ' PHE . . . . . 0.431 ' N ' HG23 ' A' ' 19' ' ' ILE . 38.0 p90 -72.92 24.56 0.06 Allowed 'General case' 0 CA--C 1.53 0.205 0 N-CA-C 111.983 0.364 . . . . 0.0 111.983 -179.66 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 21' ' ' THR . . . . . 0.439 ' H ' ' C ' ' A' ' 19' ' ' ILE . 0.8 OUTLIER -76.88 -162.99 0.31 Allowed 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.626 0.25 . . . . 0.0 110.669 179.527 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 22' ' ' LYS . . . . . 0.402 ' H ' ' HB ' ' A' ' 21' ' ' THR . 8.1 pttp -155.14 111.82 3.24 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.92 0.391 . . . . 0.0 111.0 179.813 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 23' ' ' ILE . . . . . 0.963 HG13 ' HB3' ' A' ' 33' ' ' LYS . 0.0 OUTLIER -74.53 131.41 35.02 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.869 -179.979 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 24' ' ' GLN . . . . . 0.501 ' HA ' ' NE2' ' A' ' 24' ' ' GLN . 0.8 OUTLIER -100.56 -39.38 7.94 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.053 -0.522 . . . . 0.0 110.72 179.68 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -157.15 -151.17 5.92 Favored Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.823 -0.703 . . . . 0.0 112.381 -179.986 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 26' ' ' THR . . . . . 0.871 HG23 ' HE3' ' A' ' 33' ' ' LYS . 0.0 OUTLIER -115.24 149.48 37.68 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.012 0.434 . . . . 0.0 111.208 -179.931 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 27' ' ' CYS . . . . . 0.51 ' HB2' ' HB3' ' A' ' 12' ' ' CYS . 0.0 OUTLIER -91.4 -87.59 0.2 Allowed 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.764 -0.653 . . . . 0.0 111.199 -179.891 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 28' ' ' TYR . . . . . 0.41 ' H ' ' HB3' ' A' ' 27' ' ' CYS . 5.0 m-85 -61.08 -164.01 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.496 -179.743 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -50.24 -33.03 18.22 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.952 -0.567 . . . . 0.0 111.199 -179.907 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 151.35 41.12 0.03 OUTLIER Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 120.673 -0.775 . . . . 0.0 112.742 179.851 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 23.5 mtpt -115.57 -24.39 8.33 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.748 0.309 . . . . 0.0 110.975 179.882 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -129.96 141.82 50.72 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.13 179.97 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 33' ' ' LYS . . . . . 0.963 ' HB3' HG13 ' A' ' 23' ' ' ILE . 1.5 mmpt? -93.99 133.66 37.2 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.05 -179.982 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -77.31 117.56 18.93 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.382 179.574 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 35' ' ' CYS . . . . . 0.563 ' SG ' ' HB ' ' A' ' 23' ' ' ILE . 20.1 m -118.35 146.13 44.61 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.026 -179.579 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 36' ' ' LYS . . . . . 0.491 ' HZ2' ' HB2' ' A' ' 24' ' ' GLN . 5.2 mtmm . . . . . 0 C--O 1.249 1.037 0 CA-C-O 118.29 -0.862 . . . . 0.0 110.851 179.624 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 8.7 t-80 . . . . . 0 C--O 1.232 0.166 0 CA-C-O 121.009 0.433 . . . . 0.0 111.037 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 10.8 t80 -67.2 174.64 3.07 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.717 179.669 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 4' ' ' ASN . . . . . 0.519 ' O ' ' ND2' ' A' ' 4' ' ' ASN . 0.8 OUTLIER -77.1 89.14 3.6 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 121.635 0.731 . . . . 0.0 110.117 179.508 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -118.06 -78.54 0.58 Allowed 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.313 -0.858 . . . . 0.0 109.345 179.954 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 6' ' ' VAL . . . . . 0.793 ' HA ' ' H ' ' A' ' 10' ' ' GLY . 10.4 p -54.47 -20.27 4.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 115.672 -0.695 . . . . 0.0 110.112 178.248 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 10.4 t -44.86 -43.19 8.59 Favored 'General case' 0 C--O 1.232 0.171 0 CA-C-N 115.29 -0.868 . . . . 0.0 111.406 179.989 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 23.0 p -97.53 -36.37 10.33 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.076 -179.793 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 153.85 50.29 0.01 OUTLIER Glycine 0 N--CA 1.453 -0.218 0 C-N-CA 120.686 -0.768 . . . . 0.0 112.531 -179.937 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 10' ' ' GLY . . . . . 0.793 ' H ' ' HA ' ' A' ' 6' ' ' VAL . . . -120.9 -177.14 15.63 Favored Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.768 -0.73 . . . . 0.0 112.578 -179.973 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 32.9 mt-30 -147.1 150.83 35.78 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 120.851 0.358 . . . . 0.0 111.138 -179.946 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 3.2 m -96.79 122.67 40.01 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.389 179.483 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 3.3 mt -132.75 159.01 40.94 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.377 -0.374 . . . . 0.0 111.07 -179.681 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 28.2 m-85 -88.34 -9.93 51.12 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.924 -179.923 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 1.6 m -113.56 167.12 10.86 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.134 -179.862 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -52.98 147.3 9.5 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.04 -0.527 . . . . 0.0 111.318 -179.942 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -45.6 120.7 5.07 Favored Pre-proline 0 C--N 1.328 -0.351 0 CA-C-N 115.666 -0.697 . . . . 0.0 111.469 -179.89 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 58.9 Cg_endo -84.01 -75.42 0.0 OUTLIER 'Trans proline' 0 N--CA 1.458 -0.579 0 C-N-CA 122.599 2.2 . . . . 0.0 112.455 179.876 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 19' ' ' ILE . . . . . 0.476 HG22 ' OG1' ' A' ' 21' ' ' THR . 0.3 OUTLIER -56.36 -172.48 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.534 0.34 0 CA-C-N 116.493 -0.322 . . . . 0.0 111.478 179.956 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 20' ' ' PHE . . . . . 0.426 ' N ' HG23 ' A' ' 19' ' ' ILE . 3.0 p90 -75.34 33.5 0.11 Allowed 'General case' 0 CA--C 1.531 0.227 0 N-CA-C 112.113 0.412 . . . . 0.0 112.113 -179.398 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 21' ' ' THR . . . . . 0.476 ' OG1' HG22 ' A' ' 19' ' ' ILE . 0.6 OUTLIER -90.52 -168.95 2.24 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.761 0.315 . . . . 0.0 110.64 179.306 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 11.6 ptpt -151.95 129.86 11.73 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.264 -0.426 . . . . 0.0 110.819 179.649 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 23' ' ' ILE . . . . . 0.699 ' HB ' ' HE3' ' A' ' 33' ' ' LYS . 0.2 OUTLIER -80.76 127.45 39.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.846 -179.811 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 24' ' ' GLN . . . . . 0.536 ' HB2' ' HE2' ' A' ' 36' ' ' LYS . 0.8 OUTLIER -105.68 -35.89 7.25 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.813 -0.63 . . . . 0.0 110.894 -179.734 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -161.21 -128.05 0.92 Allowed Glycine 0 N--CA 1.451 -0.362 0 C-N-CA 120.788 -0.72 . . . . 0.0 112.503 179.974 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 26' ' ' THR . . . . . 0.472 ' HA ' ' HA ' ' A' ' 33' ' ' LYS . 40.9 p -127.72 150.37 49.81 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.992 0.425 . . . . 0.0 111.145 -179.947 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 15.0 t -93.75 -83.59 0.32 Allowed 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.776 -0.647 . . . . 0.0 111.186 -179.671 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 43.2 m-85 -60.85 -169.45 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.59 -179.658 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 12.9 mtp180 -45.92 -44.03 14.34 Favored 'General case' 0 N--CA 1.462 0.135 0 CA-C-N 115.876 -0.602 . . . . 0.0 111.377 -179.866 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 163.1 48.37 0.02 OUTLIER Glycine 0 N--CA 1.452 -0.285 0 C-N-CA 120.635 -0.793 . . . . 0.0 112.649 179.983 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 30.5 mttt -128.97 -18.62 3.73 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.844 0.354 . . . . 0.0 111.009 179.976 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -136.0 147.58 48.04 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.056 179.917 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 33' ' ' LYS . . . . . 0.699 ' HE3' ' HB ' ' A' ' 23' ' ' ILE . 0.0 OUTLIER -91.58 148.09 22.53 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.815 -179.979 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -94.45 126.27 39.62 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.905 -0.589 . . . . 0.0 111.272 -179.798 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 35' ' ' CYS . . . . . 0.53 ' SG ' ' HE3' ' A' ' 33' ' ' LYS . 0.8 OUTLIER -122.51 143.63 49.59 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.411 179.506 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 36' ' ' LYS . . . . . 0.536 ' HE2' ' HB2' ' A' ' 24' ' ' GLN . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.058 0 CA-C-O 118.236 -0.888 . . . . 0.0 111.087 -179.894 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 8.6 t-80 . . . . . 0 C--O 1.231 0.095 0 CA-C-O 120.845 0.355 . . . . 0.0 110.889 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 3' ' ' TYR . . . . . 0.418 ' HB3' ' SG ' ' A' ' 5' ' ' CYS . 2.2 t80 -62.16 163.56 7.99 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.275 179.703 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 19.2 t-20 -79.21 74.36 5.78 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 121.491 0.662 . . . . 0.0 110.525 179.807 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 5' ' ' CYS . . . . . 0.78 ' HA ' ' HG2' ' A' ' 36' ' ' LYS . 0.0 OUTLIER -104.49 -55.83 2.29 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 114.984 -1.007 . . . . 0.0 109.934 179.696 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 6' ' ' VAL . . . . . 0.53 ' HA ' ' N ' ' A' ' 10' ' ' GLY . 1.6 p -55.68 -8.08 0.39 Allowed 'Isoleucine or valine' 0 CA--C 1.53 0.182 0 CA-C-N 115.713 -0.676 . . . . 0.0 111.404 179.048 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 7' ' ' SER . . . . . 0.422 ' H ' ' C ' ' A' ' 5' ' ' CYS . 4.2 t -35.58 -52.95 0.68 Allowed 'General case' 0 N--CA 1.464 0.24 0 CA-C-N 115.877 -0.602 . . . . 0.0 111.72 -179.472 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 8.6 p -115.04 -10.98 12.17 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.861 -179.942 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 145.16 31.44 0.08 OUTLIER Glycine 0 N--CA 1.45 -0.39 0 C-N-CA 120.854 -0.688 . . . . 0.0 112.304 -179.84 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 10' ' ' GLY . . . . . 0.53 ' N ' ' HA ' ' A' ' 6' ' ' VAL . . . -62.27 175.38 7.0 Favored Glycine 0 N--CA 1.45 -0.429 0 C-N-CA 120.905 -0.664 . . . . 0.0 112.527 -179.974 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 3.2 pt20 -150.26 156.82 42.28 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.895 0.378 . . . . 0.0 111.175 -179.831 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 3.3 m -128.17 111.61 13.63 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.79 179.864 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 1.1 pt? -140.14 148.51 41.75 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.97 179.949 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 27.2 m-85 -63.31 -33.01 74.58 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.03 -0.532 . . . . 0.0 111.462 -179.58 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -79.7 148.96 31.35 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.39 -0.368 . . . . 0.0 111.316 -179.682 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 16' ' ' ALA . . . . . 0.452 ' HA ' ' HD3' ' A' ' 33' ' ' LYS . . . -55.16 154.79 5.34 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.118 179.698 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -41.4 122.9 2.2 Favored Pre-proline 0 C--N 1.327 -0.377 0 CA-C-N 115.397 -0.819 . . . . 0.0 111.786 -179.635 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 59.3 Cg_endo -86.98 -77.14 0.0 OUTLIER 'Trans proline' 0 N--CA 1.456 -0.694 0 C-N-CA 122.771 2.314 . . . . 0.0 112.314 179.609 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 19' ' ' ILE . . . . . 0.483 HG22 ' OG1' ' A' ' 21' ' ' THR . 0.3 OUTLIER -56.54 -171.74 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.535 0.367 0 CA-C-N 116.452 -0.34 . . . . 0.0 111.387 179.727 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 20' ' ' PHE . . . . . 0.448 ' N ' HG23 ' A' ' 19' ' ' ILE . 0.7 OUTLIER -71.25 19.38 0.06 Allowed 'General case' 0 CA--C 1.531 0.238 0 N-CA-C 112.414 0.524 . . . . 0.0 112.414 -179.426 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 21' ' ' THR . . . . . 0.483 ' OG1' HG22 ' A' ' 19' ' ' ILE . 0.3 OUTLIER -73.99 -170.57 0.94 Allowed 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.761 0.315 . . . . 0.0 110.625 179.388 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 22' ' ' LYS . . . . . 0.476 ' HG2' ' OXT' ' A' ' 36' ' ' LYS . 0.7 OUTLIER -150.76 122.73 8.18 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.79 179.822 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 23' ' ' ILE . . . . . 0.883 ' HB ' ' HE3' ' A' ' 33' ' ' LYS . 0.2 OUTLIER -71.61 130.18 35.2 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-O 120.975 0.416 . . . . 0.0 110.402 179.913 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 24' ' ' GLN . . . . . 0.421 HE22 ' CB ' ' A' ' 34' ' ' CYS . 1.0 OUTLIER -111.95 -4.56 14.5 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.856 -0.611 . . . . 0.0 111.13 -179.298 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 163.82 -135.4 3.77 Favored Glycine 0 N--CA 1.45 -0.412 0 C-N-CA 120.879 -0.677 . . . . 0.0 112.229 -179.993 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 26' ' ' THR . . . . . 0.671 ' HA ' ' HA ' ' A' ' 33' ' ' LYS . 1.2 p -127.3 149.71 49.91 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 121.029 0.442 . . . . 0.0 111.286 179.883 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 27' ' ' CYS . . . . . 0.417 ' HB3' ' H ' ' A' ' 28' ' ' TYR . 4.2 t -88.08 -82.47 0.23 Allowed 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.607 -0.724 . . . . 0.0 111.014 -179.691 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 28' ' ' TYR . . . . . 0.417 ' H ' ' HB3' ' A' ' 27' ' ' CYS . 60.8 m-85 -61.13 -165.95 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.682 -179.841 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -49.22 -42.43 40.39 Favored 'General case' 0 C--N 1.333 -0.139 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.337 -179.813 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 163.94 50.21 0.02 OUTLIER Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.724 -0.75 . . . . 0.0 112.557 179.896 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -124.78 -37.96 2.42 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.78 0.324 . . . . 0.0 110.835 179.948 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -121.54 145.92 47.47 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.887 179.921 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 33' ' ' LYS . . . . . 0.883 ' HE3' ' HB ' ' A' ' 23' ' ' ILE . 0.0 OUTLIER -94.98 145.56 24.85 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.835 -179.941 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 34' ' ' CYS . . . . . 0.425 ' O ' ' HA ' ' A' ' 23' ' ' ILE . 0.0 OUTLIER -90.66 142.96 27.21 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.208 -179.969 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 35' ' ' CYS . . . . . 0.577 ' SG ' ' HE3' ' A' ' 33' ' ' LYS . 1.2 m -138.68 142.07 39.0 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.973 179.933 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 36' ' ' LYS . . . . . 0.78 ' HG2' ' HA ' ' A' ' 5' ' ' CYS . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.066 0 CA-C-O 118.217 -0.897 . . . . 0.0 110.987 179.803 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 15.2 t-80 . . . . . 0 C--O 1.231 0.122 0 CA-C-O 120.921 0.391 . . . . 0.0 110.936 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 6.0 t80 -61.15 174.58 0.65 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.958 -0.564 . . . . 0.0 110.693 179.731 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -79.55 79.37 6.03 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 121.264 0.554 . . . . 0.0 110.274 179.569 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -109.21 -65.01 1.18 Allowed 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.3 -0.864 . . . . 0.0 110.691 -179.748 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 6' ' ' VAL . . . . . 0.52 ' HA ' ' H ' ' A' ' 10' ' ' GLY . 0.3 OUTLIER -53.93 -17.83 1.93 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 115.672 -0.694 . . . . 0.0 111.143 179.923 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -45.46 -35.99 4.14 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-N 115.916 -0.584 . . . . 0.0 111.183 179.899 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -114.89 -13.7 11.95 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.801 179.845 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 123.81 41.58 0.41 Allowed Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.85 -0.691 . . . . 0.0 112.496 -179.973 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 10' ' ' GLY . . . . . 0.52 ' H ' ' HA ' ' A' ' 6' ' ' VAL . . . -92.23 174.89 37.4 Favored Glycine 0 N--CA 1.452 -0.284 0 C-N-CA 120.785 -0.721 . . . . 0.0 112.417 179.978 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 1.2 tt0 -147.45 150.87 35.44 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.764 0.316 . . . . 0.0 110.874 179.919 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 12' ' ' CYS . . . . . 0.436 ' C ' HD22 ' A' ' 13' ' ' LEU . 1.7 m -93.49 139.37 30.8 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.132 -0.485 . . . . 0.0 111.264 -179.71 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 13' ' ' LEU . . . . . 0.436 HD22 ' C ' ' A' ' 12' ' ' CYS . 3.2 mm? -126.35 142.41 51.54 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.459 179.657 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 2.0 m-85 -74.67 -1.91 23.9 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.396 -0.366 . . . . 0.0 111.209 -179.761 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 15' ' ' SER . . . . . 0.505 ' O ' ' HD2' ' A' ' 33' ' ' LYS . 0.4 OUTLIER -149.91 -179.05 6.83 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.813 179.852 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -44.97 137.18 4.28 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.213 179.984 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 17' ' ' CYS . . . . . 0.452 ' SG ' ' HD2' ' A' ' 18' ' ' PRO . 0.5 OUTLIER -45.49 141.77 3.61 Favored Pre-proline 0 C--N 1.33 -0.268 0 CA-C-N 115.919 -0.582 . . . . 0.0 111.691 -179.568 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 18' ' ' PRO . . . . . 0.452 ' HD2' ' SG ' ' A' ' 17' ' ' CYS . 68.3 Cg_endo -79.3 -83.92 0.0 OUTLIER 'Trans proline' 0 C--N 1.348 0.545 0 C-N-CA 122.618 2.212 . . . . 0.0 112.641 -179.982 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 19' ' ' ILE . . . . . 0.475 HG12 ' H ' ' A' ' 20' ' ' PHE . 3.6 tt -56.17 -176.07 0.02 OUTLIER 'Isoleucine or valine' 0 CA--C 1.533 0.308 0 CA-C-O 120.784 0.326 . . . . 0.0 111.593 -179.768 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 20' ' ' PHE . . . . . 0.475 ' H ' HG12 ' A' ' 19' ' ' ILE . 0.4 OUTLIER -76.3 35.19 0.14 Allowed 'General case' 0 C--N 1.331 -0.205 0 N-CA-C 111.996 0.369 . . . . 0.0 111.996 -179.368 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 21' ' ' THR . . . . . 0.467 ' HB ' ' H ' ' A' ' 22' ' ' LYS . 0.0 OUTLIER -75.9 -152.46 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.792 -0.185 . . . . 0.0 110.507 179.441 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 22' ' ' LYS . . . . . 0.467 ' H ' ' HB ' ' A' ' 21' ' ' THR . 8.0 ttmm -160.45 108.59 1.63 Allowed 'General case' 0 C--O 1.231 0.122 0 CA-C-O 120.859 0.361 . . . . 0.0 111.838 -179.744 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 23' ' ' ILE . . . . . 0.911 HD13 ' HB2' ' A' ' 33' ' ' LYS . 0.1 OUTLIER -66.12 133.21 31.29 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.197 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.852 179.344 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 24' ' ' GLN . . . . . 0.676 ' HB2' ' NZ ' ' A' ' 36' ' ' LYS . 0.0 OUTLIER -114.54 -68.53 0.92 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.614 179.537 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -121.98 164.19 15.16 Favored Glycine 0 N--CA 1.452 -0.295 0 C-N-CA 121.032 -0.604 . . . . 0.0 111.931 179.632 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 26' ' ' THR . . . . . 0.591 ' HA ' ' HA ' ' A' ' 33' ' ' LYS . 1.0 OUTLIER -75.5 153.02 37.76 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.07 0.462 . . . . 0.0 111.622 -179.802 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 18.4 t -100.67 -78.74 0.51 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.655 -0.702 . . . . 0.0 110.911 -179.903 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 3.4 m-85 -60.3 -174.69 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.989 179.931 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 20.0 ttm-85 -50.6 -25.86 4.67 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.873 179.783 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 156.26 9.59 0.06 OUTLIER Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.971 -0.633 . . . . 0.0 112.162 179.851 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -98.64 -14.01 20.06 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.685 0.279 . . . . 0.0 111.11 -179.858 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -138.51 141.95 39.35 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.411 -0.359 . . . . 0.0 110.555 179.896 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 33' ' ' LYS . . . . . 0.911 ' HB2' HD13 ' A' ' 23' ' ' ILE . 0.0 OUTLIER -107.53 141.71 38.55 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.95 0.405 . . . . 0.0 110.776 -179.889 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -84.11 131.27 34.8 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.025 -0.534 . . . . 0.0 111.668 -179.466 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -115.9 156.33 26.36 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 115.774 -0.648 . . . . 0.0 111.089 179.907 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 36' ' ' LYS . . . . . 0.676 ' NZ ' ' HB2' ' A' ' 24' ' ' GLN . 0.1 OUTLIER . . . . . 0 C--O 1.249 1.051 0 CA-C-O 118.412 -0.804 . . . . 0.0 111.005 -179.792 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 6.3 t-80 . . . . . 0 C--O 1.232 0.151 0 CA-C-O 120.846 0.355 . . . . 0.0 110.853 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 6.1 t80 -62.51 169.73 2.83 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.986 179.847 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 1.1 m-80 -76.01 86.46 2.92 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.083 0.468 . . . . 0.0 110.764 179.89 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -114.93 -74.58 0.61 Allowed 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.652 -0.704 . . . . 0.0 110.441 179.862 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 6' ' ' VAL . . . . . 0.43 ' HA ' ' H ' ' A' ' 10' ' ' GLY . 7.3 p -54.23 -15.34 1.08 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 115.67 -0.695 . . . . 0.0 111.05 179.467 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -44.18 -57.12 3.61 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-N 115.901 -0.59 . . . . 0.0 111.386 -179.932 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 1.2 m -99.81 -27.81 13.44 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.872 179.986 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 147.23 53.09 0.02 OUTLIER Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.78 -0.724 . . . . 0.0 112.432 -179.926 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 10' ' ' GLY . . . . . 0.43 ' H ' ' HA ' ' A' ' 6' ' ' VAL . . . -121.53 166.86 14.32 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.849 -0.691 . . . . 0.0 112.386 -179.973 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 1.9 tp60 -147.96 151.63 36.14 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.742 0.306 . . . . 0.0 110.398 179.86 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 12' ' ' CYS . . . . . 0.423 ' HB3' ' HB3' ' A' ' 27' ' ' CYS . 1.6 m -65.58 120.91 13.77 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.865 0.364 . . . . 0.0 111.093 -179.742 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 13' ' ' LEU . . . . . 0.522 ' HB3' ' O ' ' A' ' 15' ' ' SER . 0.4 OUTLIER -99.74 109.85 22.27 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.934 -0.576 . . . . 0.0 110.478 179.752 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 14' ' ' TYR . . . . . 0.42 ' HA ' ' HB2' ' A' ' 32' ' ' ALA . 5.2 m-85 -52.89 -19.96 2.96 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.015 -0.539 . . . . 0.0 111.096 -179.893 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 15' ' ' SER . . . . . 0.522 ' O ' ' HB3' ' A' ' 13' ' ' LEU . 0.7 OUTLIER -133.19 169.94 16.15 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.16 179.368 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -50.75 142.67 10.94 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.568 -0.287 . . . . 0.0 110.743 179.852 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -44.97 126.35 5.33 Favored Pre-proline 0 C--N 1.331 -0.203 0 CA-C-N 116.132 -0.485 . . . . 0.0 111.237 -179.571 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 59.1 Cg_endo -90.05 -72.67 0.0 OUTLIER 'Trans proline' 0 N--CA 1.456 -0.724 0 C-N-CA 122.978 2.452 . . . . 0.0 112.74 -179.554 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 19' ' ' ILE . . . . . 0.765 HG13 ' H ' ' A' ' 20' ' ' PHE . 5.2 tp -56.02 -172.92 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.533 0.292 0 CA-C-N 116.344 -0.389 . . . . 0.0 111.501 -179.86 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 20' ' ' PHE . . . . . 0.765 ' H ' HG13 ' A' ' 19' ' ' ILE . 8.1 p90 -74.47 33.13 0.09 Allowed 'General case' 0 C--N 1.331 -0.205 0 N-CA-C 111.693 0.257 . . . . 0.0 111.693 -179.765 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 21' ' ' THR . . . . . 0.47 ' HB ' ' H ' ' A' ' 22' ' ' LYS . 0.6 OUTLIER -81.17 -150.78 0.08 Allowed 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.582 -0.281 . . . . 0.0 110.617 179.447 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 22' ' ' LYS . . . . . 0.47 ' H ' ' HB ' ' A' ' 21' ' ' THR . 2.6 tptp -167.11 108.71 0.65 Allowed 'General case' 0 C--N 1.332 -0.158 0 CA-C-O 120.798 0.333 . . . . 0.0 110.954 179.991 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 23' ' ' ILE . . . . . 0.68 HG13 ' HE2' ' A' ' 33' ' ' LYS . 0.0 OUTLIER -68.27 138.65 22.11 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.614 179.665 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -108.94 -69.93 0.83 Allowed 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.842 -179.984 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -131.51 -146.74 5.84 Favored Glycine 0 N--CA 1.451 -0.34 0 CA-C-N 115.689 -0.687 . . . . 0.0 112.159 179.995 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 26' ' ' THR . . . . . 0.62 ' HA ' ' HA ' ' A' ' 33' ' ' LYS . 9.6 p -113.96 147.93 37.75 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 121.012 0.434 . . . . 0.0 111.338 -179.942 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 27' ' ' CYS . . . . . 0.423 ' HB3' ' HB3' ' A' ' 12' ' ' CYS . 51.7 t -94.15 -92.8 0.18 Allowed 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.705 -0.68 . . . . 0.0 111.016 -179.779 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 16.7 m-85 -61.4 -156.29 0.01 OUTLIER 'General case' 0 CA--C 1.53 0.193 0 CA-C-N 115.978 -0.555 . . . . 0.0 111.604 -179.858 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 3.4 mmm-85 -50.59 -43.94 56.71 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 115.978 -0.556 . . . . 0.0 111.364 -179.896 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 161.31 26.68 0.02 OUTLIER Glycine 0 N--CA 1.453 -0.217 0 C-N-CA 120.691 -0.766 . . . . 0.0 112.679 179.992 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -105.26 -15.16 15.13 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.887 0.375 . . . . 0.0 110.694 179.911 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 32' ' ' ALA . . . . . 0.42 ' HB2' ' HA ' ' A' ' 14' ' ' TYR . . . -140.84 126.69 19.26 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.737 -179.993 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 33' ' ' LYS . . . . . 0.68 ' HE2' HG13 ' A' ' 23' ' ' ILE . 0.0 OUTLIER -93.03 132.04 37.49 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.779 0.324 . . . . 0.0 110.778 179.877 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -55.72 120.16 6.87 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.715 179.82 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 35' ' ' CYS . . . . . 0.512 ' SG ' ' HB ' ' A' ' 23' ' ' ILE . 0.9 OUTLIER -122.2 141.74 51.15 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.017 -179.672 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.028 0 CA-C-O 118.223 -0.894 . . . . 0.0 110.901 179.844 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 13.9 t-80 . . . . . 0 C--O 1.232 0.144 0 CA-C-O 120.824 0.345 . . . . 0.0 111.09 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 21.0 t80 -65.01 161.53 18.53 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.655 179.572 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -60.75 100.02 0.1 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.347 0.594 . . . . 0.0 110.153 179.509 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 5' ' ' CYS . . . . . 0.743 ' HA ' ' HG2' ' A' ' 36' ' ' LYS . 0.1 OUTLIER -130.34 -82.42 0.54 Allowed 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.545 -0.752 . . . . 0.0 109.918 -179.712 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 6' ' ' VAL . . . . . 0.428 ' HA ' ' H ' ' A' ' 10' ' ' GLY . 7.1 p -54.49 -15.26 1.13 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.183 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.702 178.872 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -44.75 -47.09 10.77 Favored 'General case' 0 C--N 1.333 -0.14 0 CA-C-N 115.669 -0.696 . . . . 0.0 111.519 -179.91 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 3.3 p -114.12 -3.11 13.29 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.288 -0.415 . . . . 0.0 111.11 -179.847 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 124.38 38.23 0.53 Allowed Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 120.678 -0.772 . . . . 0.0 112.617 179.947 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 10' ' ' GLY . . . . . 0.428 ' H ' ' HA ' ' A' ' 6' ' ' VAL . . . -102.54 169.99 19.88 Favored Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.802 -0.714 . . . . 0.0 112.333 179.925 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -150.34 144.84 25.76 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.866 0.365 . . . . 0.0 110.928 179.9 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 12' ' ' CYS . . . . . 0.465 ' HB3' ' HB2' ' A' ' 27' ' ' CYS . 0.0 OUTLIER -92.47 136.05 33.54 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.006 179.866 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 1.9 mp -131.51 162.67 29.72 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.847 -179.885 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 59.3 m-85 -79.73 -45.19 19.35 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.944 -179.993 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -89.21 171.67 9.63 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.13 -179.861 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -55.21 152.53 8.01 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.079 -0.509 . . . . 0.0 111.459 179.994 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 17' ' ' CYS . . . . . 0.43 ' HA ' ' HD3' ' A' ' 18' ' ' PRO . 0.1 OUTLIER -45.36 127.05 6.02 Favored Pre-proline 0 C--N 1.329 -0.289 0 CA-C-N 115.603 -0.726 . . . . 0.0 111.373 -179.988 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 18' ' ' PRO . . . . . 0.43 ' HD3' ' HA ' ' A' ' 17' ' ' CYS . 57.1 Cg_endo -89.18 -78.62 0.0 OUTLIER 'Trans proline' 0 N--CA 1.456 -0.721 0 C-N-CA 122.758 2.305 . . . . 0.0 112.589 -179.953 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 19' ' ' ILE . . . . . 0.776 HG13 ' H ' ' A' ' 20' ' ' PHE . 5.4 tp -56.45 -171.93 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.535 0.371 0 CA-C-N 116.496 -0.32 . . . . 0.0 111.732 -179.793 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 20' ' ' PHE . . . . . 0.776 ' H ' HG13 ' A' ' 19' ' ' ILE . 2.1 p90 -69.77 19.8 0.04 OUTLIER 'General case' 0 N--CA 1.463 0.222 0 N-CA-C 112.314 0.487 . . . . 0.0 112.314 -179.315 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 21' ' ' THR . . . . . 0.452 ' H ' ' C ' ' A' ' 19' ' ' ILE . 0.6 OUTLIER -73.25 -159.63 0.07 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.567 0.222 . . . . 0.0 110.651 179.473 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 22' ' ' LYS . . . . . 0.405 ' H ' ' HB ' ' A' ' 21' ' ' THR . 8.8 tptp -160.63 117.82 2.42 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.931 0.396 . . . . 0.0 111.421 -179.948 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 23' ' ' ILE . . . . . 0.58 HD12 ' HE3' ' A' ' 33' ' ' LYS . 0.6 OUTLIER -73.04 131.0 35.51 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.606 179.31 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 24' ' ' GLN . . . . . 0.885 ' HB2' ' HE2' ' A' ' 36' ' ' LYS . 5.0 tp60 -113.31 -68.63 0.91 Allowed 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.618 179.915 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -126.54 -138.46 4.82 Favored Glycine 0 N--CA 1.45 -0.428 0 C-N-CA 120.847 -0.692 . . . . 0.0 112.074 179.697 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 26' ' ' THR . . . . . 0.662 ' HA ' ' HA ' ' A' ' 33' ' ' LYS . 3.1 p -125.3 146.61 49.48 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 120.932 0.396 . . . . 0.0 111.17 179.93 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 27' ' ' CYS . . . . . 0.465 ' HB2' ' HB3' ' A' ' 12' ' ' CYS . 0.0 OUTLIER -86.44 -81.88 0.21 Allowed 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.808 -0.633 . . . . 0.0 111.169 -179.717 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 24.0 m-85 -61.02 -165.27 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.905 -0.589 . . . . 0.0 111.887 -179.598 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -50.52 -34.48 25.44 Favored 'General case' 0 C--N 1.333 -0.152 0 CA-C-N 115.87 -0.605 . . . . 0.0 111.419 -179.929 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 153.91 41.37 0.02 OUTLIER Glycine 0 N--CA 1.452 -0.235 0 C-N-CA 120.726 -0.75 . . . . 0.0 112.491 -179.915 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 15.2 mttm -116.76 -23.53 8.09 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.841 0.353 . . . . 0.0 110.88 179.923 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -136.33 145.67 45.72 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.911 179.952 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 33' ' ' LYS . . . . . 0.662 ' HA ' ' HA ' ' A' ' 26' ' ' THR . 0.0 OUTLIER -98.26 138.95 34.78 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.918 -179.875 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -78.07 138.29 38.69 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.753 179.958 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 35' ' ' CYS . . . . . 0.414 ' SG ' ' NZ ' ' A' ' 33' ' ' LYS . 1.2 m -125.88 131.5 52.35 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.965 -179.839 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 36' ' ' LYS . . . . . 0.885 ' HE2' ' HB2' ' A' ' 24' ' ' GLN . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.054 0 CA-C-O 118.247 -0.882 . . . . 0.0 110.919 179.908 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 5.1 m-20 . . . . . 0 N--CA 1.487 1.385 0 CA-C-O 120.864 0.364 . . . . 0.0 111.246 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 6.7 t-80 -60.06 108.05 0.72 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.997 -0.547 . . . . 0.0 111.089 -179.879 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 5.2 t80 -63.48 158.66 20.33 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.501 179.573 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -66.57 86.08 0.11 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.079 0.466 . . . . 0.0 110.547 179.813 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -106.86 -74.32 0.66 Allowed 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.616 -0.72 . . . . 0.0 110.867 -179.709 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 6' ' ' VAL . . . . . 0.532 ' HA ' ' H ' ' A' ' 10' ' ' GLY . 12.7 p -53.64 -25.22 11.03 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.228 0 CA-C-N 115.987 -0.551 . . . . 0.0 111.157 179.914 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -45.37 -53.37 8.69 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.835 -0.62 . . . . 0.0 111.34 179.992 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 58.6 m -95.68 -31.24 13.34 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.984 -179.925 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 147.26 54.63 0.02 OUTLIER Glycine 0 N--CA 1.452 -0.276 0 C-N-CA 120.865 -0.683 . . . . 0.0 112.404 179.989 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 10' ' ' GLY . . . . . 0.532 ' H ' ' HA ' ' A' ' 6' ' ' VAL . . . -123.89 174.32 16.77 Favored Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.714 -0.755 . . . . 0.0 112.632 -179.919 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 7.3 tt0 -150.02 156.39 41.6 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.87 0.367 . . . . 0.0 110.918 -179.946 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -98.02 131.06 44.77 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.041 -0.527 . . . . 0.0 111.031 -179.937 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -134.85 134.75 41.09 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.871 179.982 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 40.3 m-85 -59.15 -28.66 66.79 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.119 -179.973 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 47.1 m -107.25 169.45 8.56 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.152 -179.804 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 16' ' ' ALA . . . . . 0.431 ' HA ' ' HD3' ' A' ' 33' ' ' LYS . . . -52.64 154.28 2.74 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 115.984 -0.553 . . . . 0.0 111.464 -179.986 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 17' ' ' CYS . . . . . 0.636 ' SG ' ' HE3' ' A' ' 33' ' ' LYS . 85.3 m -45.33 134.04 5.73 Favored Pre-proline 0 C--N 1.328 -0.347 0 CA-C-N 115.437 -0.802 . . . . 0.0 111.633 -179.748 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 18' ' ' PRO . . . . . 0.503 ' HG2' ' H ' ' A' ' 19' ' ' ILE . 69.7 Cg_endo -77.06 -78.94 0.01 OUTLIER 'Trans proline' 0 C--N 1.347 0.464 0 C-N-CA 122.501 2.134 . . . . 0.0 111.81 179.444 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 19' ' ' ILE . . . . . 0.503 ' H ' ' HG2' ' A' ' 18' ' ' PRO . 2.0 tt -56.63 -172.1 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.534 0.334 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.126 179.351 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 20' ' ' PHE . . . . . 0.406 ' N ' HG23 ' A' ' 19' ' ' ILE . 0.3 OUTLIER -77.94 41.41 0.35 Allowed 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.728 0.299 . . . . 0.0 111.471 -179.926 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 21' ' ' THR . . . . . 0.617 ' HB ' ' SG ' ' A' ' 35' ' ' CYS . 0.4 OUTLIER -89.97 -165.81 1.44 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.471 -0.331 . . . . 0.0 110.905 179.799 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 22' ' ' LYS . . . . . 0.518 ' O ' ' HG2' ' A' ' 22' ' ' LYS . 0.0 OUTLIER -150.13 128.54 12.17 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-O 120.985 0.421 . . . . 0.0 110.719 179.504 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 23' ' ' ILE . . . . . 0.553 HG13 ' HB2' ' A' ' 33' ' ' LYS . 0.1 OUTLIER -78.06 124.45 36.46 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.908 -179.447 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 24' ' ' GLN . . . . . 0.584 ' HB2' ' HE2' ' A' ' 36' ' ' LYS . 3.6 mt-30 -93.8 -57.68 2.48 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.91 179.989 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -136.1 -148.62 5.59 Favored Glycine 0 N--CA 1.452 -0.287 0 C-N-CA 120.919 -0.658 . . . . 0.0 112.486 -179.984 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 26' ' ' THR . . . . . 0.407 ' HA ' ' HA ' ' A' ' 33' ' ' LYS . 0.7 OUTLIER -118.96 147.25 44.26 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.962 0.41 . . . . 0.0 111.241 -179.997 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 9.5 t -83.87 -95.39 0.06 Allowed 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.746 -0.661 . . . . 0.0 110.953 -179.768 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 14.9 m-85 -61.51 -156.61 0.01 OUTLIER 'General case' 0 CA--C 1.53 0.176 0 CA-C-O 120.985 0.422 . . . . 0.0 111.474 179.984 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 1.9 mtp180 -50.06 -35.36 24.84 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-N 116.053 -0.521 . . . . 0.0 111.109 179.983 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 155.64 17.39 0.04 OUTLIER Glycine 0 N--CA 1.452 -0.289 0 C-N-CA 120.727 -0.749 . . . . 0.0 112.5 179.925 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 18.6 tttt -89.67 -24.21 21.66 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.91 0.386 . . . . 0.0 110.531 179.83 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -130.27 144.92 51.66 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.96 -0.564 . . . . 0.0 111.009 179.897 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 33' ' ' LYS . . . . . 0.636 ' HE3' ' SG ' ' A' ' 17' ' ' CYS . 0.0 OUTLIER -102.24 139.66 37.55 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.787 -179.992 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -81.72 125.51 30.7 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.657 179.861 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 35' ' ' CYS . . . . . 0.617 ' SG ' ' HB ' ' A' ' 21' ' ' THR . 4.6 t -127.49 151.53 48.74 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.355 -179.684 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 36' ' ' LYS . . . . . 0.584 ' HE2' ' HB2' ' A' ' 24' ' ' GLN . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.071 0 CA-C-O 118.253 -0.879 . . . . 0.0 110.799 179.953 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 1.7 t70 . . . . . 0 N--CA 1.486 1.345 0 CA-C-O 120.792 0.33 . . . . 0.0 111.08 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 6.5 t-80 -60.13 109.42 0.97 Allowed 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.853 179.971 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 9.0 t80 -54.96 162.14 1.39 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.731 179.732 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 1.2 m120 -72.42 80.49 1.04 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.206 0.527 . . . . 0.0 110.543 179.836 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 3.0 m -98.3 -70.0 0.74 Allowed 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.398 -0.819 . . . . 0.0 110.525 -179.916 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 2.0 p -54.85 -13.52 0.83 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-N 116.081 -0.509 . . . . 0.0 111.153 179.176 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 1.2 t -41.88 -51.7 4.24 Favored 'General case' 0 N--CA 1.462 0.153 0 CA-C-N 115.865 -0.607 . . . . 0.0 111.488 -179.717 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 1.3 m -105.79 -10.0 16.94 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.782 179.951 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 125.53 39.03 0.45 Allowed Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.874 -0.679 . . . . 0.0 112.399 -179.964 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -82.68 170.31 49.96 Favored Glycine 0 N--CA 1.452 -0.294 0 C-N-CA 120.806 -0.711 . . . . 0.0 112.466 -179.998 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -143.5 153.93 43.12 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.817 0.342 . . . . 0.0 110.959 179.968 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 1.9 m -110.13 137.08 48.37 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.947 -179.991 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -136.96 152.13 49.81 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.88 179.996 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 62.9 m-85 -75.6 -14.32 60.37 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.226 -179.797 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 1.9 p -120.61 169.94 9.89 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.977 -179.893 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -51.63 145.55 8.97 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.105 179.948 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER -45.49 142.04 3.49 Favored Pre-proline 0 C--N 1.329 -0.305 0 CA-C-N 115.752 -0.658 . . . . 0.0 111.674 -179.621 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 55.4 Cg_endo -91.01 -75.39 0.0 OUTLIER 'Trans proline' 0 N--CA 1.456 -0.734 0 C-N-CA 123.115 2.543 . . . . 0.0 113.023 -179.686 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 19' ' ' ILE . . . . . 0.457 HG22 ' OG1' ' A' ' 21' ' ' THR . 2.4 tt -56.02 -176.47 0.02 OUTLIER 'Isoleucine or valine' 0 CA--C 1.535 0.382 0 CA-C-O 120.848 0.356 . . . . 0.0 111.903 -179.496 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 4.0 p90 -74.88 32.15 0.09 Allowed 'General case' 0 CA--C 1.532 0.259 0 N-CA-C 112.616 0.599 . . . . 0.0 112.616 -178.85 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 21' ' ' THR . . . . . 0.457 ' OG1' HG22 ' A' ' 19' ' ' ILE . 0.0 OUTLIER -78.86 -152.82 0.06 Allowed 'General case' 0 C--N 1.331 -0.227 0 C-N-CA 121.136 -0.226 . . . . 0.0 110.46 179.273 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 22' ' ' LYS . . . . . 0.444 ' H ' ' HB ' ' A' ' 21' ' ' THR . 17.0 tttp -165.17 94.07 0.63 Allowed 'General case' 0 C--N 1.333 -0.126 0 C-N-CA 120.711 -0.395 . . . . 0.0 111.661 -179.919 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 23' ' ' ILE . . . . . 0.531 ' HB ' ' CE ' ' A' ' 33' ' ' LYS . 0.2 OUTLIER -49.14 131.83 7.1 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.576 179.252 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -120.54 0.77 10.55 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.467 -0.333 . . . . 0.0 111.715 -179.426 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 176.44 -145.67 7.59 Favored Glycine 0 N--CA 1.451 -0.343 0 C-N-CA 120.428 -0.891 . . . . 0.0 112.889 180.0 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 26' ' ' THR . . . . . 0.517 ' HA ' ' HA ' ' A' ' 33' ' ' LYS . 1.2 p -127.01 149.45 49.89 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.06 0.457 . . . . 0.0 111.303 -179.749 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 8.5 t -89.64 -85.48 0.21 Allowed 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.672 -0.694 . . . . 0.0 111.146 -179.737 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 8.5 m-85 -61.37 -158.23 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.564 -179.641 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 81.8 mtt180 -48.56 -38.39 20.41 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-N 116.018 -0.537 . . . . 0.0 111.349 -179.73 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 157.54 17.5 0.04 OUTLIER Glycine 0 N--CA 1.452 -0.283 0 C-N-CA 120.725 -0.75 . . . . 0.0 112.674 179.919 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 3.0 mttt -95.62 -28.2 14.95 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.872 0.368 . . . . 0.0 110.814 179.874 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -118.13 149.66 40.67 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.121 -0.49 . . . . 0.0 111.044 -179.979 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 33' ' ' LYS . . . . . 0.531 ' CE ' ' HB ' ' A' ' 23' ' ' ILE . 0.0 OUTLIER -97.44 145.52 26.11 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.892 -0.594 . . . . 0.0 110.883 -179.992 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -97.65 119.88 37.02 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.944 179.9 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 35' ' ' CYS . . . . . 0.53 ' SG ' ' HE3' ' A' ' 33' ' ' LYS . 0.0 OUTLIER -114.55 160.94 18.69 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.728 -0.669 . . . . 0.0 111.261 -179.615 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 36' ' ' LYS . . . . . 0.727 ' HZ3' ' H ' ' A' ' 36' ' ' LYS . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.051 0 CA-C-O 118.271 -0.871 . . . . 0.0 111.001 -179.996 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 . . . . . 0 N--CA 1.486 1.355 0 CA-C-O 120.799 0.333 . . . . 0.0 111.183 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -60.31 125.5 23.93 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.568 179.9 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 3' ' ' TYR . . . . . 0.435 ' HB3' ' SG ' ' A' ' 34' ' ' CYS . 1.4 t80 -56.52 145.44 28.01 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.882 -179.794 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 4.1 m120 -66.11 84.36 0.09 Allowed 'General case' 0 N--CA 1.45 -0.457 0 CA-C-O 121.135 0.493 . . . . 0.0 110.905 -179.995 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -102.26 -69.21 0.79 Allowed 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.579 -0.737 . . . . 0.0 110.776 -179.838 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 10.3 p -53.73 -21.27 4.68 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 115.777 -0.647 . . . . 0.0 111.282 179.893 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 22.5 p -45.32 -37.58 4.97 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-N 115.928 -0.578 . . . . 0.0 111.255 -179.939 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 2.8 m -112.03 -20.55 11.92 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.9 -179.949 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 118.01 49.15 0.38 Allowed Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.838 -0.696 . . . . 0.0 112.512 179.998 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -101.99 -173.24 27.71 Favored Glycine 0 N--CA 1.451 -0.301 0 C-N-CA 120.679 -0.772 . . . . 0.0 112.497 -179.999 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -149.46 137.52 20.52 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.694 0.283 . . . . 0.0 110.567 179.885 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 12' ' ' CYS . . . . . 0.553 ' HA ' ' O ' ' A' ' 33' ' ' LYS . 0.0 OUTLIER -89.58 110.68 21.52 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.001 0.429 . . . . 0.0 111.533 -179.63 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 1.6 mp -105.11 122.12 45.22 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.789 -0.641 . . . . 0.0 110.1 179.249 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 14' ' ' TYR . . . . . 0.796 ' HA ' ' HA ' ' A' ' 32' ' ' ALA . 31.9 m-85 -49.68 -33.32 15.4 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.07 -179.443 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 34.2 t -99.01 166.91 11.05 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.387 179.338 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -52.94 141.06 22.99 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.449 -0.341 . . . . 0.0 110.718 179.851 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 17' ' ' CYS . . . . . 0.513 ' SG ' ' HB ' ' A' ' 23' ' ' ILE . 39.5 m -45.5 132.01 6.22 Favored Pre-proline 0 C--N 1.33 -0.26 0 CA-C-N 116.063 -0.517 . . . . 0.0 111.914 -179.416 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 18' ' ' PRO . . . . . 0.427 ' HG2' ' H ' ' A' ' 19' ' ' ILE . 68.6 Cg_endo -81.49 -70.04 0.01 OUTLIER 'Trans proline' 0 N--CA 1.459 -0.503 0 C-N-CA 122.691 2.261 . . . . 0.0 112.261 179.624 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 19' ' ' ILE . . . . . 0.457 HG13 ' H ' ' A' ' 20' ' ' PHE . 0.3 OUTLIER -56.59 -173.24 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.534 0.334 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.639 179.759 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 20' ' ' PHE . . . . . 0.457 ' H ' HG13 ' A' ' 19' ' ' ILE . 27.9 p90 -74.51 25.91 0.08 Allowed 'General case' 0 C--N 1.331 -0.213 0 N-CA-C 112.073 0.397 . . . . 0.0 112.073 -179.626 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 21' ' ' THR . . . . . 0.563 ' HB ' ' SG ' ' A' ' 35' ' ' CYS . 0.9 OUTLIER -76.74 -163.04 0.3 Allowed 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 120.518 0.199 . . . . 0.0 110.763 179.711 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 22' ' ' LYS . . . . . 0.432 ' H ' ' HB ' ' A' ' 21' ' ' THR . 8.9 tttt -163.6 108.23 1.04 Allowed 'General case' 0 C--O 1.231 0.132 0 CA-C-O 120.843 0.354 . . . . 0.0 110.844 -179.97 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 23' ' ' ILE . . . . . 0.889 HG13 ' HB3' ' A' ' 33' ' ' LYS . 0.0 OUTLIER -68.93 139.57 20.29 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 CA-C-O 121.076 0.465 . . . . 0.0 110.755 179.891 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 24' ' ' GLN . . . . . 0.867 ' HB2' ' HE3' ' A' ' 36' ' ' LYS . 0.0 OUTLIER -105.19 -44.95 4.63 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.727 -0.67 . . . . 0.0 110.568 179.23 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -151.88 -149.48 5.1 Favored Glycine 0 N--CA 1.452 -0.292 0 C-N-CA 120.989 -0.624 . . . . 0.0 112.251 179.917 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -110.54 148.34 32.33 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.053 0.454 . . . . 0.0 111.277 -179.931 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 27' ' ' CYS . . . . . 0.442 ' HB2' ' HB3' ' A' ' 12' ' ' CYS . 0.0 OUTLIER -83.44 -91.3 0.08 Allowed 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.741 -0.663 . . . . 0.0 111.133 -179.694 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 28' ' ' TYR . . . . . 0.432 ' H ' ' HB3' ' A' ' 27' ' ' CYS . 29.4 m-85 -61.49 -156.18 0.01 OUTLIER 'General case' 0 CA--C 1.531 0.229 0 CA-C-N 116.066 -0.516 . . . . 0.0 111.764 -179.701 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -49.17 -39.55 29.69 Favored 'General case' 0 C--O 1.232 0.139 0 CA-C-N 115.917 -0.583 . . . . 0.0 111.314 -179.83 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 155.65 48.15 0.01 OUTLIER Glycine 0 N--CA 1.452 -0.257 0 C-N-CA 120.744 -0.741 . . . . 0.0 112.549 -179.975 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 5.9 mptt -120.04 -44.21 2.51 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.86 0.362 . . . . 0.0 110.881 179.999 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 32' ' ' ALA . . . . . 0.796 ' HA ' ' HA ' ' A' ' 14' ' ' TYR . . . -105.98 146.66 29.76 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.987 179.977 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 33' ' ' LYS . . . . . 0.889 ' HB3' HG13 ' A' ' 23' ' ' ILE . 2.7 mtpp -95.77 120.66 36.42 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.079 -179.932 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 34' ' ' CYS . . . . . 0.604 ' SG ' ' HE2' ' A' ' 36' ' ' LYS . 0.1 OUTLIER -69.74 111.7 5.69 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.213 179.287 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 35' ' ' CYS . . . . . 0.563 ' SG ' ' HB ' ' A' ' 21' ' ' THR . 3.3 t -116.16 146.93 41.89 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.233 -179.427 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 36' ' ' LYS . . . . . 0.867 ' HE3' ' HB2' ' A' ' 24' ' ' GLN . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.043 0 CA-C-O 118.23 -0.89 . . . . 0.0 110.887 179.827 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.486 1.34 0 CA-C-O 120.834 0.35 . . . . 0.0 111.143 . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -60.32 116.46 4.28 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.902 -179.991 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 5.2 t80 -65.55 160.17 22.98 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.594 179.852 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -68.91 85.63 0.33 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.1 0.476 . . . . 0.0 110.822 179.883 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 5' ' ' CYS . . . . . 0.672 ' HA ' ' HG2' ' A' ' 36' ' ' LYS . 0.0 OUTLIER -109.53 -79.05 0.58 Allowed 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.641 -0.709 . . . . 0.0 110.556 179.941 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 11.9 p -54.26 -16.82 1.56 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.188 0 CA-C-N 115.959 -0.564 . . . . 0.0 111.15 179.62 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -45.08 -53.63 7.7 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.925 -0.58 . . . . 0.0 111.342 -179.859 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 5.5 p -106.32 -5.06 19.36 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.982 179.995 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 118.37 51.14 0.32 Allowed Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.786 -0.721 . . . . 0.0 112.501 -179.964 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -96.88 -178.26 34.91 Favored Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.735 -0.745 . . . . 0.0 112.476 -179.973 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 6.1 tt0 -146.51 131.75 18.45 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.815 0.341 . . . . 0.0 110.826 179.948 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 12' ' ' CYS . . . . . 0.476 ' HB3' ' HB2' ' A' ' 27' ' ' CYS . 0.0 OUTLIER -102.62 131.02 49.67 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.951 -179.893 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 3.0 mt -133.03 158.15 43.46 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.006 -179.949 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 14' ' ' TYR . . . . . 0.453 ' CD1' ' HB2' ' A' ' 32' ' ' ALA . 29.2 m-85 -82.41 -8.47 59.62 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.212 -179.848 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 98.7 p -117.65 169.08 9.86 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.386 -0.37 . . . . 0.0 111.085 -179.833 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -54.94 147.68 14.94 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.07 -0.513 . . . . 0.0 111.115 179.947 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 17' ' ' CYS . . . . . 0.452 ' HA ' ' HD3' ' A' ' 18' ' ' PRO . 0.1 OUTLIER -45.26 131.26 5.85 Favored Pre-proline 0 C--N 1.33 -0.265 0 CA-C-N 115.856 -0.611 . . . . 0.0 111.306 -179.855 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 18' ' ' PRO . . . . . 0.452 ' HD3' ' HA ' ' A' ' 17' ' ' CYS . 40.9 Cg_endo -90.8 -79.98 0.0 OUTLIER 'Trans proline' 0 N--CA 1.455 -0.767 0 C-N-CA 122.995 2.463 . . . . 0.0 112.64 -179.782 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 19' ' ' ILE . . . . . 0.567 HG12 ' H ' ' A' ' 20' ' ' PHE . 3.7 tt -56.6 -168.3 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.536 0.432 0 CA-C-N 116.376 -0.375 . . . . 0.0 111.758 -179.873 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 20' ' ' PHE . . . . . 0.567 ' H ' HG12 ' A' ' 19' ' ' ILE . 0.8 OUTLIER -75.69 33.97 0.12 Allowed 'General case' 0 CA--C 1.531 0.223 0 N-CA-C 112.083 0.401 . . . . 0.0 112.083 -179.492 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 21' ' ' THR . . . . . 0.448 HG22 ' OXT' ' A' ' 36' ' ' LYS . 0.1 OUTLIER -90.25 180.0 5.77 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.74 0.305 . . . . 0.0 110.695 179.263 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 1.6 ptmm? -135.68 136.39 40.86 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.332 -0.394 . . . . 0.0 110.408 179.554 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 23' ' ' ILE . . . . . 0.968 HD13 ' HB2' ' A' ' 33' ' ' LYS . 0.1 OUTLIER -89.9 126.35 42.78 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.836 -179.715 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 24' ' ' GLN . . . . . 0.694 ' HB2' ' HE2' ' A' ' 36' ' ' LYS . 0.3 OUTLIER -104.08 -59.81 1.67 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.607 -0.724 . . . . 0.0 111.157 -179.703 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -141.45 -132.98 2.84 Favored Glycine 0 C--N 1.332 0.329 0 C-N-CA 120.673 -0.775 . . . . 0.0 112.904 -179.702 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 15.9 p -126.04 149.76 48.63 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.05 0.452 . . . . 0.0 111.234 -179.786 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 27' ' ' CYS . . . . . 0.476 ' HB2' ' HB3' ' A' ' 12' ' ' CYS . 0.7 OUTLIER -95.27 -78.06 0.46 Allowed 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.678 -0.692 . . . . 0.0 111.158 -179.738 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 17.6 m-85 -60.94 -164.65 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.504 -179.658 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 4.3 mtm180 -50.1 -36.97 31.76 Favored 'General case' 0 C--N 1.333 -0.143 0 CA-C-N 115.964 -0.562 . . . . 0.0 111.279 -179.936 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 153.74 43.61 0.02 OUTLIER Glycine 0 N--CA 1.452 -0.294 0 C-N-CA 120.751 -0.738 . . . . 0.0 112.556 179.949 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -122.54 -21.22 5.78 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.841 0.353 . . . . 0.0 110.947 179.967 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 32' ' ' ALA . . . . . 0.453 ' HB2' ' CD1' ' A' ' 14' ' ' TYR . . . -127.63 143.94 51.12 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.123 -0.49 . . . . 0.0 111.036 179.992 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 33' ' ' LYS . . . . . 0.968 ' HB2' HD13 ' A' ' 23' ' ' ILE . 0.0 OUTLIER -96.1 134.66 38.89 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.877 179.998 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 34' ' ' CYS . . . . . 0.455 ' HB2' ' SG ' ' A' ' 27' ' ' CYS . 0.0 OUTLIER -79.16 141.49 37.18 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.139 -179.739 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 35' ' ' CYS . . . . . 0.434 ' SG ' ' HE3' ' A' ' 33' ' ' LYS . 0.8 OUTLIER -134.79 129.95 35.37 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.905 179.946 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 36' ' ' LYS . . . . . 0.694 ' HE2' ' HB2' ' A' ' 24' ' ' GLN . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.079 0 CA-C-O 118.256 -0.878 . . . . 0.0 110.874 179.942 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.486 1.371 0 CA-C-O 120.851 0.357 . . . . 0.0 111.248 . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 1.9 t-80 -59.83 113.29 2.2 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.602 179.881 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 4.4 t80 -62.75 166.72 5.19 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.744 179.995 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 4' ' ' ASN . . . . . 0.431 ' ND2' ' HB2' ' A' ' 7' ' ' SER . 26.0 t-20 -81.89 78.49 8.6 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 121.409 0.623 . . . . 0.0 110.765 179.862 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 0.3 OUTLIER -106.23 -56.51 2.18 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.168 -0.924 . . . . 0.0 110.241 179.897 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 60.9 t -54.99 -12.89 0.74 Allowed 'Isoleucine or valine' 0 CA--C 1.53 0.208 0 CA-C-N 115.754 -0.657 . . . . 0.0 111.105 179.168 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 7' ' ' SER . . . . . 0.431 ' HB2' ' ND2' ' A' ' 4' ' ' ASN . 6.2 t -34.38 -50.22 0.41 Allowed 'General case' 0 N--CA 1.464 0.266 0 CA-C-N 115.821 -0.627 . . . . 0.0 111.833 -179.831 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 28.2 t -107.75 -19.74 13.44 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.863 -179.96 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 136.39 34.85 0.22 Allowed Glycine 0 N--CA 1.45 -0.37 0 C-N-CA 120.828 -0.701 . . . . 0.0 112.321 -179.93 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -65.89 176.75 15.67 Favored Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.796 -0.716 . . . . 0.0 112.477 -179.995 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -144.84 142.51 29.99 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.84 0.352 . . . . 0.0 110.965 -179.967 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 3.2 m -106.18 125.24 50.76 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.079 -0.509 . . . . 0.0 110.704 179.876 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 13' ' ' LEU . . . . . 0.499 ' O ' ' HG3' ' A' ' 33' ' ' LYS . 3.6 mp -135.14 151.84 51.06 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.275 -0.421 . . . . 0.0 111.046 -179.842 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 14' ' ' TYR . . . . . 0.428 ' CD1' ' HB2' ' A' ' 32' ' ' ALA . 11.8 m-85 -77.74 -3.96 43.89 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.881 179.942 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 15.7 t -122.3 173.85 7.36 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.007 -179.997 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -54.78 144.18 23.18 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.279 -179.987 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 17' ' ' CYS . . . . . 0.509 ' SG ' ' HE3' ' A' ' 33' ' ' LYS . 71.7 m -45.78 139.45 5.07 Favored Pre-proline 0 C--N 1.331 -0.228 0 CA-C-N 115.824 -0.626 . . . . 0.0 111.551 -179.792 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 18' ' ' PRO . . . . . 0.45 ' HG2' ' H ' ' A' ' 19' ' ' ILE . 68.1 Cg_endo -76.43 -83.3 0.0 OUTLIER 'Trans proline' 0 C--N 1.347 0.452 0 C-N-CA 122.498 2.132 . . . . 0.0 112.289 179.853 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 19' ' ' ILE . . . . . 0.604 HG13 ' H ' ' A' ' 20' ' ' PHE . 0.8 OUTLIER -56.53 -171.18 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.535 0.391 0 CA-C-O 120.859 0.362 . . . . 0.0 111.619 179.884 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 20' ' ' PHE . . . . . 0.604 ' H ' HG13 ' A' ' 19' ' ' ILE . 3.8 p90 -69.96 15.48 0.08 Allowed 'General case' 0 CA--C 1.533 0.291 0 N-CA-C 111.982 0.364 . . . . 0.0 111.982 -179.664 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 21' ' ' THR . . . . . 0.632 ' HB ' ' SG ' ' A' ' 35' ' ' CYS . 0.6 OUTLIER -63.15 -172.71 0.05 OUTLIER 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 120.851 0.358 . . . . 0.0 111.268 179.809 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -151.54 118.07 5.7 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.066 179.945 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 23' ' ' ILE . . . . . 0.586 HD12 ' HD2' ' A' ' 33' ' ' LYS . 0.2 OUTLIER -64.76 120.67 12.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.735 179.99 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 24' ' ' GLN . . . . . 0.583 ' HB2' ' HZ2' ' A' ' 36' ' ' LYS . 1.0 OUTLIER -88.39 -28.84 20.69 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.552 179.922 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -177.47 -130.28 1.36 Allowed Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 121.026 -0.607 . . . . 0.0 112.219 179.998 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 26' ' ' THR . . . . . 0.63 ' HA ' ' HA ' ' A' ' 33' ' ' LYS . 0.6 OUTLIER -116.79 145.74 43.32 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.9 0.381 . . . . 0.0 111.037 179.831 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 25.5 t -94.37 -78.47 0.44 Allowed 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.839 -179.87 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 28' ' ' TYR . . . . . 0.509 ' HB3' ' NZ ' ' A' ' 31' ' ' LYS . 22.7 m-85 -60.12 -176.92 0.05 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.842 -0.617 . . . . 0.0 111.039 -179.979 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 29' ' ' ARG . . . . . 0.416 HH11 ' HD3' ' A' ' 29' ' ' ARG . 7.0 mmt-85 -50.31 -24.41 2.93 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.218 -179.988 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 153.65 32.75 0.03 OUTLIER Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.885 -0.674 . . . . 0.0 112.342 179.873 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 31' ' ' LYS . . . . . 0.509 ' NZ ' ' HB3' ' A' ' 28' ' ' TYR . 2.0 mttp -111.17 -35.76 5.8 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.759 0.314 . . . . 0.0 110.927 -179.968 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 32' ' ' ALA . . . . . 0.428 ' HB2' ' CD1' ' A' ' 14' ' ' TYR . . . -128.86 153.79 47.11 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.299 -0.41 . . . . 0.0 110.995 -179.983 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 33' ' ' LYS . . . . . 0.63 ' HA ' ' HA ' ' A' ' 26' ' ' THR . 0.0 OUTLIER -92.81 144.94 24.79 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.938 -179.869 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -88.36 128.18 35.5 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.456 179.86 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 35' ' ' CYS . . . . . 0.632 ' SG ' ' HB ' ' A' ' 21' ' ' THR . 2.5 t -130.06 150.17 51.45 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.195 -179.54 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 36' ' ' LYS . . . . . 0.583 ' HZ2' ' HB2' ' A' ' 24' ' ' GLN . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.044 0 CA-C-O 118.284 -0.865 . . . . 0.0 110.959 179.999 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.487 1.386 0 CA-C-O 120.699 0.285 . . . . 0.0 111.1 . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 6.8 t-80 -60.18 105.61 0.43 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.71 179.854 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 7.8 t80 -60.57 164.48 4.5 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.714 179.78 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 1.1 t30 -71.18 85.32 0.75 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.075 0.464 . . . . 0.0 110.51 179.683 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 5' ' ' CYS . . . . . 0.586 ' HA ' ' HG2' ' A' ' 36' ' ' LYS . 0.1 OUTLIER -102.54 -72.43 0.69 Allowed 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.686 -0.688 . . . . 0.0 110.668 -179.865 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 13.9 p -53.9 -19.74 3.32 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-N 115.973 -0.558 . . . . 0.0 111.132 179.723 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 3.3 p -45.13 -44.28 10.48 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 115.938 -0.574 . . . . 0.0 111.402 -179.972 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 3.1 p -113.89 1.06 14.63 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.974 -179.948 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 103.94 44.6 1.61 Allowed Glycine 0 N--CA 1.451 -0.334 0 C-N-CA 120.736 -0.745 . . . . 0.0 112.181 -179.846 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -85.99 -176.18 49.99 Favored Glycine 0 N--CA 1.45 -0.394 0 C-N-CA 120.795 -0.717 . . . . 0.0 112.499 -179.881 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 5.0 mp0 -147.91 150.13 33.51 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.753 0.311 . . . . 0.0 110.797 179.985 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 12' ' ' CYS . . . . . 0.415 ' C ' HD22 ' A' ' 13' ' ' LEU . 0.1 OUTLIER -108.18 129.56 55.18 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.911 179.969 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 13' ' ' LEU . . . . . 0.57 ' HB2' ' NZ ' ' A' ' 33' ' ' LYS . 3.9 mm? -121.15 157.26 30.56 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.959 -179.847 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 60.0 m-85 -82.9 -18.91 38.51 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.78 179.852 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -126.88 -175.58 3.46 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.864 -179.946 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -51.06 140.16 16.4 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.064 -0.516 . . . . 0.0 111.14 179.915 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 17' ' ' CYS . . . . . 0.617 ' SG ' ' HE3' ' A' ' 33' ' ' LYS . 82.9 m -45.52 137.89 5.25 Favored Pre-proline 0 C--N 1.331 -0.21 0 CA-C-N 116.081 -0.509 . . . . 0.0 111.555 -179.782 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 18' ' ' PRO . . . . . 0.456 ' HD3' ' HA ' ' A' ' 17' ' ' CYS . 50.7 Cg_endo -89.75 -73.34 0.0 OUTLIER 'Trans proline' 0 N--CA 1.454 -0.796 0 C-N-CA 122.957 2.438 . . . . 0.0 112.231 179.802 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 19' ' ' ILE . . . . . 0.612 HG13 ' H ' ' A' ' 20' ' ' PHE . 0.7 OUTLIER -56.47 -173.45 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.534 0.338 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.456 179.738 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 20' ' ' PHE . . . . . 0.612 ' H ' HG13 ' A' ' 19' ' ' ILE . 2.1 p90 -78.1 40.03 0.32 Allowed 'General case' 0 C--N 1.332 -0.196 0 CA-C-N 116.563 -0.29 . . . . 0.0 111.594 -179.753 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 21' ' ' THR . . . . . 0.58 ' HB ' ' SG ' ' A' ' 35' ' ' CYS . 0.7 OUTLIER -89.48 -161.01 0.73 Allowed 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.567 -0.288 . . . . 0.0 110.631 179.448 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 22' ' ' LYS . . . . . 0.409 ' H ' ' HB ' ' A' ' 21' ' ' THR . 15.8 tttt -159.07 108.91 1.95 Allowed 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 120.721 0.296 . . . . 0.0 111.399 -179.953 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 23' ' ' ILE . . . . . 0.933 HD13 ' HB2' ' A' ' 33' ' ' LYS . 0.2 OUTLIER -60.39 126.61 18.51 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.226 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.735 179.592 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 24' ' ' GLN . . . . . 0.533 ' HB2' ' HE2' ' A' ' 36' ' ' LYS . 1.5 tp60 -111.66 -56.49 2.38 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.042 -0.527 . . . . 0.0 110.882 179.894 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -140.75 -160.96 8.5 Favored Glycine 0 N--CA 1.452 -0.29 0 C-N-CA 120.814 -0.708 . . . . 0.0 112.337 179.857 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -92.65 147.9 22.5 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.985 0.421 . . . . 0.0 111.231 179.917 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 27' ' ' CYS . . . . . 0.423 ' HB3' ' H ' ' A' ' 28' ' ' TYR . 0.1 OUTLIER -93.18 -92.71 0.16 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.951 -0.568 . . . . 0.0 111.002 -179.898 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 28' ' ' TYR . . . . . 0.423 ' H ' ' HB3' ' A' ' 27' ' ' CYS . 15.4 m-85 -61.24 -160.49 0.01 OUTLIER 'General case' 0 CA--C 1.53 0.209 0 CA-C-O 120.985 0.422 . . . . 0.0 111.46 -179.878 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 14.6 ttm-85 -50.08 -36.4 29.24 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 116.012 -0.54 . . . . 0.0 111.298 -179.905 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 154.44 34.08 0.03 OUTLIER Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.634 -0.793 . . . . 0.0 112.592 -179.974 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 31.8 mmtt -110.82 -20.58 12.42 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.924 0.392 . . . . 0.0 110.822 179.944 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -136.55 145.18 44.73 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.862 179.975 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 33' ' ' LYS . . . . . 0.933 ' HB2' HD13 ' A' ' 23' ' ' ILE . 0.1 OUTLIER -93.29 130.25 39.09 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.284 -0.416 . . . . 0.0 111.006 -179.799 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -69.27 127.67 33.89 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.547 179.679 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 35' ' ' CYS . . . . . 0.58 ' SG ' ' HB ' ' A' ' 21' ' ' THR . 6.8 t -131.44 132.78 44.58 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.169 -179.649 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 36' ' ' LYS . . . . . 0.586 ' HG2' ' HA ' ' A' ' 5' ' ' CYS . 0.0 OUTLIER . . . . . 0 C--O 1.25 1.083 0 CA-C-O 118.23 -0.891 . . . . 0.0 110.94 179.951 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.485 1.323 0 CA-C-O 120.921 0.391 . . . . 0.0 111.302 . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 9.7 t-80 -60.95 105.93 0.53 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.076 -0.511 . . . . 0.0 111.104 -179.986 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 5.6 t80 -65.09 169.47 5.41 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.824 179.76 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 1.3 m-80 -74.88 81.33 2.14 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 121.181 0.515 . . . . 0.0 110.532 179.71 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 1.2 m -111.64 -64.14 1.33 Allowed 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.482 -0.781 . . . . 0.0 111.086 -179.527 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 9.4 p -54.25 -15.0 0.98 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.215 0 CA-C-N 115.942 -0.572 . . . . 0.0 111.324 179.833 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -44.96 -53.31 7.81 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.914 -0.585 . . . . 0.0 111.592 -179.785 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -96.5 -22.26 17.21 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.395 -0.366 . . . . 0.0 111.072 -179.791 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 133.77 45.6 0.11 Allowed Glycine 0 N--CA 1.452 -0.275 0 C-N-CA 120.887 -0.673 . . . . 0.0 112.257 -179.957 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -99.71 174.27 26.66 Favored Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.784 -0.722 . . . . 0.0 112.731 -179.738 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 3.0 tp60 -149.29 154.43 39.01 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.778 0.323 . . . . 0.0 110.702 179.922 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 12' ' ' CYS . . . . . 0.453 ' HB3' ' HB2' ' A' ' 27' ' ' CYS . 0.0 OUTLIER -105.12 133.7 49.46 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.853 179.968 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 13' ' ' LEU . . . . . 0.496 HD13 ' HD3' ' A' ' 18' ' ' PRO . 3.4 mp -135.5 157.35 47.11 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.198 -0.456 . . . . 0.0 111.155 -179.672 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 14' ' ' TYR . . . . . 0.454 ' CD1' ' HB2' ' A' ' 32' ' ' ALA . 22.9 m-85 -74.6 -10.9 59.99 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.882 179.874 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -124.7 -179.7 4.62 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.687 179.992 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -54.75 144.36 22.52 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.165 179.88 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 8.1 m -45.63 142.99 3.21 Favored Pre-proline 0 C--N 1.331 -0.202 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.34 -179.876 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 18' ' ' PRO . . . . . 0.496 ' HD3' HD13 ' A' ' 13' ' ' LEU . 74.4 Cg_endo -79.05 -80.7 0.0 OUTLIER 'Trans proline' 0 C--N 1.345 0.386 0 C-N-CA 122.541 2.161 . . . . 0.0 112.384 179.997 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 19' ' ' ILE . . . . . 0.463 ' H ' ' HG2' ' A' ' 18' ' ' PRO . 0.9 OUTLIER -56.56 -170.34 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.535 0.402 0 CA-C-N 116.493 -0.321 . . . . 0.0 111.576 179.779 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 20' ' ' PHE . . . . . 0.454 ' N ' HG23 ' A' ' 19' ' ' ILE . 1.3 p90 -76.0 35.56 0.13 Allowed 'General case' 0 N--CA 1.463 0.183 0 CA-C-O 120.711 0.291 . . . . 0.0 111.417 179.987 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 21' ' ' THR . . . . . 0.407 ' H ' ' C ' ' A' ' 19' ' ' ILE . 0.7 OUTLIER -82.09 -165.96 1.13 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.512 -0.313 . . . . 0.0 110.87 179.77 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 22' ' ' LYS . . . . . 0.536 ' HG2' ' O ' ' A' ' 36' ' ' LYS . 0.0 OUTLIER -151.23 130.33 12.65 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.895 0.379 . . . . 0.0 110.479 179.636 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 23' ' ' ILE . . . . . 0.701 HG13 ' HB2' ' A' ' 33' ' ' LYS . 0.0 OUTLIER -81.27 133.12 29.97 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-N 116.158 -0.474 . . . . 0.0 111.206 -179.514 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 24' ' ' GLN . . . . . 0.547 ' HB2' ' HE2' ' A' ' 36' ' ' LYS . 0.6 OUTLIER -107.75 -66.98 0.99 Allowed 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.581 -0.736 . . . . 0.0 111.088 -179.84 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -132.04 -130.04 3.09 Favored Glycine 0 N--CA 1.452 -0.289 0 C-N-CA 120.769 -0.729 . . . . 0.0 112.56 -179.927 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 26' ' ' THR . . . . . 0.591 ' HA ' ' HA ' ' A' ' 33' ' ' LYS . 44.4 p -125.11 153.67 42.61 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.054 0.455 . . . . 0.0 111.502 -179.807 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 27' ' ' CYS . . . . . 0.453 ' HB2' ' HB3' ' A' ' 12' ' ' CYS . 0.1 OUTLIER -100.56 -84.52 0.43 Allowed 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.558 -0.747 . . . . 0.0 111.299 -179.684 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 22.6 m-85 -61.12 -160.52 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.726 -0.67 . . . . 0.0 111.861 -179.447 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 10.7 ttt85 -49.72 -34.55 19.17 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 115.786 -0.643 . . . . 0.0 111.096 -179.918 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 149.6 22.07 0.07 OUTLIER Glycine 0 N--CA 1.451 -0.357 0 C-N-CA 120.646 -0.787 . . . . 0.0 112.738 179.81 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -98.93 -10.89 22.18 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.755 0.312 . . . . 0.0 110.968 179.881 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 32' ' ' ALA . . . . . 0.454 ' HB2' ' CD1' ' A' ' 14' ' ' TYR . . . -144.51 146.83 32.61 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.288 -0.415 . . . . 0.0 111.156 179.987 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 33' ' ' LYS . . . . . 0.701 ' HB2' HG13 ' A' ' 23' ' ' ILE . 0.0 OUTLIER -99.86 141.52 32.57 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.789 179.914 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -74.72 144.04 43.87 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.028 -0.533 . . . . 0.0 111.718 -179.404 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 35' ' ' CYS . . . . . 0.493 ' SG ' ' HE2' ' A' ' 33' ' ' LYS . 84.7 m -134.98 143.89 47.09 Favored 'General case' 0 C--N 1.332 -0.154 0 CA-C-N 115.806 -0.634 . . . . 0.0 110.55 179.59 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 36' ' ' LYS . . . . . 0.547 ' HE2' ' HB2' ' A' ' 24' ' ' GLN . 0.0 OUTLIER . . . . . 0 C--O 1.248 1.017 0 CA-C-O 118.252 -0.88 . . . . 0.0 111.081 179.962 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 74.7 m-20 . . . . . 0 N--CA 1.486 1.338 0 CA-C-O 120.805 0.336 . . . . 0.0 111.154 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 11.5 t-160 -60.24 96.08 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.059 -0.518 . . . . 0.0 110.943 179.986 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 9.7 t80 -57.51 172.66 0.33 Allowed 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.047 179.946 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 5.1 m120 -77.3 76.91 3.84 Favored 'General case' 0 N--CA 1.448 -0.541 0 CA-C-O 121.248 0.547 . . . . 0.0 110.577 179.778 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -110.08 -64.69 1.23 Allowed 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.384 -0.825 . . . . 0.0 110.392 179.788 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -54.59 -16.84 1.73 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.177 0 CA-C-N 115.915 -0.584 . . . . 0.0 111.1 179.47 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 40.0 t -45.5 -40.46 8.5 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 115.846 -0.615 . . . . 0.0 111.212 -179.984 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -115.16 -0.77 13.17 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.777 179.957 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 113.07 34.7 1.77 Allowed Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 120.798 -0.715 . . . . 0.0 112.551 179.877 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -86.22 170.85 43.51 Favored Glycine 0 N--CA 1.451 -0.359 0 C-N-CA 120.809 -0.71 . . . . 0.0 112.559 -179.946 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -150.12 156.48 41.72 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.823 0.344 . . . . 0.0 110.854 179.977 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 0.2 OUTLIER -75.77 117.02 17.08 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.232 -179.88 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 13' ' ' LEU . . . . . 0.566 ' HG ' ' HD3' ' A' ' 18' ' ' PRO . 1.5 mm? -102.92 105.9 16.35 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.231 179.238 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 7.3 m-85 -50.82 -20.56 1.33 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.361 -179.714 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -125.55 176.11 7.08 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.805 179.827 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -52.52 146.29 10.13 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.108 -0.496 . . . . 0.0 111.047 179.912 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 17' ' ' CYS . . . . . 0.416 ' HA ' ' HD3' ' A' ' 18' ' ' PRO . 0.0 OUTLIER -45.2 122.07 5.02 Favored Pre-proline 0 C--N 1.33 -0.239 0 CA-C-N 115.939 -0.573 . . . . 0.0 111.255 -179.765 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 18' ' ' PRO . . . . . 0.566 ' HD3' ' HG ' ' A' ' 13' ' ' LEU . 58.2 Cg_endo -88.43 -72.5 0.0 OUTLIER 'Trans proline' 0 N--CA 1.456 -0.732 0 C-N-CA 122.788 2.326 . . . . 0.0 112.524 -179.829 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 19' ' ' ILE . . . . . 0.701 HG12 ' H ' ' A' ' 20' ' ' PHE . 9.0 tt -55.92 -176.01 0.02 OUTLIER 'Isoleucine or valine' 0 CA--C 1.533 0.306 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.457 179.967 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 20' ' ' PHE . . . . . 0.701 ' H ' HG12 ' A' ' 19' ' ' ILE . 0.6 OUTLIER -76.62 32.17 0.13 Allowed 'General case' 0 C--N 1.33 -0.249 0 N-CA-C 112.032 0.382 . . . . 0.0 112.032 -179.391 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 21' ' ' THR . . . . . 0.44 ' HB ' ' H ' ' A' ' 22' ' ' LYS . 0.9 OUTLIER -83.37 -154.3 0.15 Allowed 'General case' 0 C--N 1.332 -0.161 0 CA-C-O 120.575 0.226 . . . . 0.0 110.693 179.322 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 22' ' ' LYS . . . . . 0.44 ' H ' ' HB ' ' A' ' 21' ' ' THR . 0.1 OUTLIER -158.01 105.58 1.96 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.546 -0.297 . . . . 0.0 110.675 179.694 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 23' ' ' ILE . . . . . 0.564 ' HB ' ' SG ' ' A' ' 35' ' ' CYS . 0.0 OUTLIER -64.75 137.78 24.33 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.238 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.737 -179.999 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -112.77 -69.84 0.84 Allowed 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.72 179.822 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -127.68 -143.58 5.74 Favored Glycine 0 N--CA 1.45 -0.426 0 C-N-CA 120.92 -0.657 . . . . 0.0 112.487 179.986 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -115.77 143.65 45.09 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.042 0.449 . . . . 0.0 111.429 -179.845 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 27' ' ' CYS . . . . . 0.435 ' HB3' ' H ' ' A' ' 28' ' ' TYR . 2.1 t -81.89 -88.39 0.08 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.805 -0.634 . . . . 0.0 110.629 179.835 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 28' ' ' TYR . . . . . 0.435 ' H ' ' HB3' ' A' ' 27' ' ' CYS . 15.7 m-85 -62.12 -153.41 0.01 OUTLIER 'General case' 0 CA--C 1.532 0.262 0 CA-C-N 116.076 -0.511 . . . . 0.0 111.459 179.824 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -50.17 -35.86 27.95 Favored 'General case' 0 C--N 1.333 -0.119 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.577 -179.766 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 149.5 28.27 0.06 OUTLIER Glycine 0 N--CA 1.452 -0.295 0 C-N-CA 120.585 -0.817 . . . . 0.0 112.699 -179.943 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 1.6 mttp -102.12 -26.31 13.41 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.928 0.394 . . . . 0.0 110.607 179.871 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -122.75 139.74 53.65 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.922 179.943 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 33' ' ' LYS . . . . . 0.476 ' HE2' HG13 ' A' ' 23' ' ' ILE . 14.5 mtpt -92.59 120.86 33.44 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.363 -0.38 . . . . 0.0 110.743 179.918 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -64.13 111.71 2.68 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.01 -0.541 . . . . 0.0 111.033 -179.822 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 35' ' ' CYS . . . . . 0.564 ' SG ' ' HB ' ' A' ' 23' ' ' ILE . 1.8 m -106.69 138.44 42.86 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.821 -179.896 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.048 0 CA-C-O 118.213 -0.899 . . . . 0.0 111.055 179.72 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 9.1 t70 . . . . . 0 N--CA 1.486 1.372 0 CA-C-O 120.846 0.355 . . . . 0.0 111.161 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -59.95 117.42 5.04 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.794 -179.939 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 2.4 t80 -64.93 156.44 31.11 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.591 179.894 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 6.4 p-10 -72.15 83.94 1.01 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 121.309 0.576 . . . . 0.0 111.324 -179.618 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 5' ' ' CYS . . . . . 0.416 ' HA ' ' HG2' ' A' ' 36' ' ' LYS . 0.0 OUTLIER -97.76 -65.21 0.98 Allowed 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.475 -0.784 . . . . 0.0 110.009 179.38 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 14.6 p -53.9 -18.4 2.23 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 115.141 -0.936 . . . . 0.0 111.389 179.676 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 6.8 t -42.19 -48.73 4.89 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 115.975 -0.557 . . . . 0.0 111.532 -179.632 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -111.84 -22.23 11.22 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.375 -0.375 . . . . 0.0 110.794 179.868 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 133.17 53.25 0.08 OUTLIER Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.934 -0.65 . . . . 0.0 112.258 -179.962 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -89.98 -178.54 44.7 Favored Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.823 -0.703 . . . . 0.0 112.69 -179.762 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -149.32 141.19 23.7 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.748 0.309 . . . . 0.0 110.649 -179.962 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -93.2 125.79 37.97 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.912 -179.936 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -123.51 155.18 38.04 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.771 179.867 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 85.8 m-85 -82.47 -31.38 29.41 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.978 -179.808 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -104.1 171.98 7.05 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.793 179.926 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -54.9 149.55 11.38 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.064 -0.517 . . . . 0.0 111.242 -179.931 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 17' ' ' CYS . . . . . 0.425 ' HA ' ' HD3' ' A' ' 18' ' ' PRO . 0.1 OUTLIER -45.43 123.53 5.68 Favored Pre-proline 0 C--N 1.33 -0.278 0 CA-C-N 115.692 -0.686 . . . . 0.0 111.051 179.932 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 18' ' ' PRO . . . . . 0.425 ' HD3' ' HA ' ' A' ' 17' ' ' CYS . 42.2 Cg_endo -90.63 -72.96 0.0 OUTLIER 'Trans proline' 0 N--CA 1.456 -0.723 0 C-N-CA 122.876 2.384 . . . . 0.0 112.864 -179.51 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 19' ' ' ILE . . . . . 0.659 HG13 ' H ' ' A' ' 20' ' ' PHE . 1.6 tp -56.13 -170.97 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.536 0.407 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.617 -179.728 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 20' ' ' PHE . . . . . 0.659 ' H ' HG13 ' A' ' 19' ' ' ILE . 4.5 p90 -71.03 23.12 0.04 OUTLIER 'General case' 0 CA--C 1.531 0.236 0 N-CA-C 112.227 0.455 . . . . 0.0 112.227 -179.347 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 21' ' ' THR . . . . . 0.451 ' H ' ' C ' ' A' ' 19' ' ' ILE . 0.8 OUTLIER -81.91 -165.73 1.06 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.537 0.208 . . . . 0.0 110.642 179.406 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 22' ' ' LYS . . . . . 0.405 ' H ' ' HB ' ' A' ' 21' ' ' THR . 40.0 tttp -161.97 117.31 1.97 Allowed 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 120.876 0.369 . . . . 0.0 111.13 179.928 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 23' ' ' ILE . . . . . 0.431 ' HB ' ' NZ ' ' A' ' 33' ' ' LYS . 0.8 OUTLIER -67.45 135.74 27.94 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.853 179.745 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 24' ' ' GLN . . . . . 0.58 ' HB2' ' NZ ' ' A' ' 36' ' ' LYS . 1.7 mp0 -114.7 -42.43 3.26 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.895 -0.593 . . . . 0.0 110.826 -179.924 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -154.54 -131.32 1.49 Allowed Glycine 0 N--CA 1.451 -0.363 0 C-N-CA 120.899 -0.667 . . . . 0.0 112.371 179.922 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 26' ' ' THR . . . . . 0.601 ' HA ' ' HA ' ' A' ' 33' ' ' LYS . 15.6 p -122.49 141.15 51.95 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.841 0.353 . . . . 0.0 111.177 179.886 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 27' ' ' CYS . . . . . 0.466 ' HB3' ' H ' ' A' ' 28' ' ' TYR . 0.2 OUTLIER -82.99 -91.29 0.08 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.013 -0.54 . . . . 0.0 111.056 -179.842 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 28' ' ' TYR . . . . . 0.466 ' H ' ' HB3' ' A' ' 27' ' ' CYS . 23.7 m-85 -60.94 -168.02 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.166 0 CA-C-O 120.962 0.411 . . . . 0.0 111.206 -179.985 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 5.4 ttt-85 -50.39 -35.86 30.17 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 115.985 -0.552 . . . . 0.0 111.301 -179.938 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 159.66 44.39 0.02 OUTLIER Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.676 -0.773 . . . . 0.0 112.593 179.962 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 9.8 mtpt -119.73 -14.16 9.05 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.896 0.379 . . . . 0.0 110.651 179.798 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -154.35 147.27 24.48 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.668 179.858 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 33' ' ' LYS . . . . . 0.601 ' HA ' ' HA ' ' A' ' 26' ' ' THR . 0.0 OUTLIER -92.08 146.03 24.05 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.977 0.418 . . . . 0.0 110.937 -179.843 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 0.2 OUTLIER -77.63 135.2 38.09 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.895 -0.593 . . . . 0.0 111.091 -179.74 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 0.9 OUTLIER -136.57 128.97 30.16 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.972 179.88 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 36' ' ' LYS . . . . . 0.58 ' NZ ' ' HB2' ' A' ' 24' ' ' GLN . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.054 0 CA-C-O 118.245 -0.883 . . . . 0.0 110.748 179.802 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.485 1.325 0 CA-C-O 120.849 0.357 . . . . 0.0 111.032 . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 7.2 t-80 -60.04 107.32 0.61 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.709 179.847 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 2.4 t80 -63.81 167.29 6.18 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.619 179.834 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 1.4 t-20 -80.47 76.91 7.29 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.344 0.592 . . . . 0.0 110.265 179.567 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 5' ' ' CYS . . . . . 0.645 ' HA ' ' HD2' ' A' ' 36' ' ' LYS . 0.0 OUTLIER -101.3 -63.54 1.13 Allowed 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.085 -0.961 . . . . 0.0 110.643 -179.722 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 10.8 p -54.29 -16.91 1.6 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-N 115.827 -0.624 . . . . 0.0 111.134 179.586 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -38.03 -48.61 1.22 Allowed 'General case' 0 N--CA 1.462 0.174 0 CA-C-N 115.788 -0.642 . . . . 0.0 111.89 -179.725 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -109.28 -29.05 8.66 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.433 -0.349 . . . . 0.0 111.095 -179.916 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 142.69 45.52 0.05 OUTLIER Glycine 0 N--CA 1.452 -0.249 0 C-N-CA 120.804 -0.713 . . . . 0.0 112.428 -179.924 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -97.91 169.21 24.08 Favored Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.732 -0.747 . . . . 0.0 112.567 -179.882 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 12.7 mt-30 -143.11 148.86 37.3 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.75 0.31 . . . . 0.0 110.63 179.978 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 12' ' ' CYS . . . . . 0.494 ' HA ' ' O ' ' A' ' 33' ' ' LYS . 0.0 OUTLIER -103.0 125.11 49.62 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.297 -0.411 . . . . 0.0 111.222 -179.903 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -122.62 143.56 49.68 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.41 179.623 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 26.8 m-85 -60.31 -10.58 4.87 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.351 -0.386 . . . . 0.0 111.261 -179.755 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -114.07 155.69 25.5 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.788 179.613 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -54.95 157.82 3.06 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.284 179.823 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 17' ' ' CYS . . . . . 0.434 ' HB2' HG22 ' A' ' 23' ' ' ILE . 0.1 OUTLIER -44.91 112.08 1.42 Allowed Pre-proline 0 C--N 1.327 -0.39 0 CA-C-N 115.452 -0.794 . . . . 0.0 111.2 179.926 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 60.9 Cg_endo -87.78 -72.46 0.0 OUTLIER 'Trans proline' 0 N--CA 1.457 -0.619 0 C-N-CA 122.724 2.282 . . . . 0.0 112.664 -179.839 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 19' ' ' ILE . . . . . 0.587 HG12 ' H ' ' A' ' 20' ' ' PHE . 4.6 tt -56.37 -169.85 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.534 0.34 0 CA-C-N 116.321 -0.4 . . . . 0.0 111.588 -179.979 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 20' ' ' PHE . . . . . 0.587 ' H ' HG12 ' A' ' 19' ' ' ILE . 5.8 p90 -76.64 36.01 0.16 Allowed 'General case' 0 CA--C 1.53 0.179 0 N-CA-C 111.859 0.318 . . . . 0.0 111.859 -179.616 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 21' ' ' THR . . . . . 0.436 ' HB ' ' HB3' ' A' ' 35' ' ' CYS . 0.3 OUTLIER -88.08 -161.21 0.7 Allowed 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.662 0.268 . . . . 0.0 110.758 179.39 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 22' ' ' LYS . . . . . 0.422 ' H ' ' HB ' ' A' ' 21' ' ' THR . 1.4 tttm -157.58 103.1 1.91 Allowed 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.86 0.362 . . . . 0.0 111.028 -179.931 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 23' ' ' ILE . . . . . 0.524 HD13 ' HB3' ' A' ' 33' ' ' LYS . 1.4 tp -69.67 131.91 33.63 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.224 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.994 179.745 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 24' ' ' GLN . . . . . 0.502 ' HB2' ' HE3' ' A' ' 36' ' ' LYS . 18.6 mt-30 -114.29 -66.5 1.08 Allowed 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.125 179.346 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -125.52 167.07 17.99 Favored Glycine 0 N--CA 1.449 -0.478 0 CA-C-N 115.511 -0.768 . . . . 0.0 111.401 179.175 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 1.7 p -75.77 154.62 36.19 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 121.261 0.553 . . . . 0.0 111.16 -179.955 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 27' ' ' CYS . . . . . 0.493 ' HB3' ' H ' ' A' ' 28' ' ' TYR . 5.4 t -84.35 -96.15 0.06 Allowed 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.317 -0.856 . . . . 0.0 111.252 -179.55 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 28' ' ' TYR . . . . . 0.493 ' H ' ' HB3' ' A' ' 27' ' ' CYS . 61.7 m-85 -61.65 -144.06 0.0 OUTLIER 'General case' 0 CA--C 1.534 0.349 0 CA-C-N 115.982 -0.554 . . . . 0.0 111.628 -179.796 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 29' ' ' ARG . . . . . 0.403 ' HD2' HH11 ' A' ' 29' ' ' ARG . 7.6 mtt180 -48.16 -42.82 30.63 Favored 'General case' 0 C--O 1.232 0.133 0 CA-C-O 120.801 0.334 . . . . 0.0 111.402 -179.625 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 153.39 24.62 0.04 OUTLIER Glycine 0 N--CA 1.451 -0.363 0 C-N-CA 120.767 -0.73 . . . . 0.0 112.566 -179.94 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -99.86 -40.85 7.49 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.75 0.309 . . . . 0.0 110.932 179.953 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -97.76 139.26 33.89 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.887 179.937 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 33' ' ' LYS . . . . . 0.524 ' HB3' HD13 ' A' ' 23' ' ' ILE . 0.8 OUTLIER -91.63 126.53 36.74 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.914 0.388 . . . . 0.0 110.881 -179.937 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -83.08 104.39 13.24 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.911 -0.586 . . . . 0.0 111.045 179.869 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 35' ' ' CYS . . . . . 0.519 ' SG ' ' HB ' ' A' ' 23' ' ' ILE . 30.4 m -98.24 144.13 28.0 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.742 179.947 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 36' ' ' LYS . . . . . 0.645 ' HD2' ' HA ' ' A' ' 5' ' ' CYS . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.073 0 CA-C-O 118.198 -0.906 . . . . 0.0 110.872 179.753 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 . . . . . 0 N--CA 1.487 1.399 0 CA-C-O 120.864 0.364 . . . . 0.0 111.185 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 6.0 t-80 -60.15 109.22 0.92 Allowed 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.673 179.942 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 5.7 t80 -57.5 158.8 5.47 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.744 179.962 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -70.24 82.41 0.53 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.215 0.531 . . . . 0.0 110.819 -179.916 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 5' ' ' CYS . . . . . 0.794 ' HA ' ' HG2' ' A' ' 36' ' ' LYS . 0.1 OUTLIER -100.8 -72.96 0.66 Allowed 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.475 -0.784 . . . . 0.0 110.29 179.596 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 6' ' ' VAL . . . . . 0.525 ' HA ' ' H ' ' A' ' 10' ' ' GLY . 9.9 p -54.0 -17.58 1.83 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 115.621 -0.718 . . . . 0.0 111.247 179.452 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -45.03 -48.65 11.67 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-N 115.834 -0.621 . . . . 0.0 111.443 -179.895 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 55.2 p -115.18 -4.35 12.46 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.94 179.991 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 123.46 53.43 0.2 Allowed Glycine 0 N--CA 1.452 -0.284 0 C-N-CA 120.725 -0.75 . . . . 0.0 112.494 179.886 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 10' ' ' GLY . . . . . 0.525 ' H ' ' HA ' ' A' ' 6' ' ' VAL . . . -97.09 171.16 26.75 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.804 -0.712 . . . . 0.0 112.467 -179.972 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 6.1 tp-100 -148.6 145.93 28.02 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.806 0.336 . . . . 0.0 110.911 -179.999 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 12' ' ' CYS . . . . . 0.458 ' HB3' ' HB2' ' A' ' 27' ' ' CYS . 0.1 OUTLIER -100.6 110.71 22.87 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.04 -179.893 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 13' ' ' LEU . . . . . 0.46 ' O ' ' HG3' ' A' ' 33' ' ' LYS . 11.0 mt -119.67 147.64 44.31 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.918 179.891 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 1.4 m-85 -88.86 16.29 7.12 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.957 179.934 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 15' ' ' SER . . . . . 0.452 ' O ' ' HD3' ' A' ' 33' ' ' LYS . 8.5 p -139.79 158.4 44.15 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.89 179.908 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -48.79 140.66 8.3 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.381 -179.879 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 17' ' ' CYS . . . . . 0.43 ' HA ' ' HD3' ' A' ' 18' ' ' PRO . 0.2 OUTLIER -45.96 123.88 6.53 Favored Pre-proline 0 C--N 1.332 -0.176 0 CA-C-N 115.888 -0.596 . . . . 0.0 111.379 -179.875 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 18' ' ' PRO . . . . . 0.43 ' HD3' ' HA ' ' A' ' 17' ' ' CYS . 56.8 Cg_endo -89.38 -73.65 0.0 OUTLIER 'Trans proline' 0 N--CA 1.455 -0.747 0 C-N-CA 122.895 2.396 . . . . 0.0 112.69 -179.812 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 19' ' ' ILE . . . . . 0.667 HG12 ' H ' ' A' ' 20' ' ' PHE . 6.6 tt -56.47 -174.21 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.535 0.375 0 CA-C-N 116.492 -0.322 . . . . 0.0 111.567 -179.894 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 20' ' ' PHE . . . . . 0.667 ' H ' HG12 ' A' ' 19' ' ' ILE . 50.8 p90 -70.1 17.63 0.06 Allowed 'General case' 0 CA--C 1.531 0.224 0 N-CA-C 112.472 0.545 . . . . 0.0 112.472 -179.285 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 21' ' ' THR . . . . . 0.513 ' OG1' HG22 ' A' ' 19' ' ' ILE . 0.7 OUTLIER -74.91 -174.24 2.15 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.744 0.307 . . . . 0.0 110.683 179.417 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 10.0 ptmt -147.31 127.65 13.95 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.999 179.807 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 23' ' ' ILE . . . . . 0.707 ' HB ' ' HE3' ' A' ' 33' ' ' LYS . 0.2 OUTLIER -81.26 119.78 31.56 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.645 179.802 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 24' ' ' GLN . . . . . 0.704 ' HB2' ' HE2' ' A' ' 36' ' ' LYS . 0.5 OUTLIER -95.75 -46.72 6.47 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.763 -179.892 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -152.06 -127.13 1.28 Allowed Glycine 0 N--CA 1.45 -0.391 0 C-N-CA 120.9 -0.667 . . . . 0.0 112.226 179.838 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 26' ' ' THR . . . . . 0.576 ' HA ' ' HA ' ' A' ' 33' ' ' LYS . 17.0 p -131.96 138.76 48.44 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.864 0.364 . . . . 0.0 111.16 179.844 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 27' ' ' CYS . . . . . 0.458 ' HB2' ' HB3' ' A' ' 12' ' ' CYS . 0.1 OUTLIER -71.85 -85.09 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.903 179.995 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 28' ' ' TYR . . . . . 0.414 ' H ' ' HB3' ' A' ' 27' ' ' CYS . 8.5 m-85 -60.84 -168.46 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.193 179.916 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 10.7 tpt180 -50.22 -31.9 15.14 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.049 -0.523 . . . . 0.0 111.148 179.934 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 157.38 36.9 0.02 OUTLIER Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 120.795 -0.717 . . . . 0.0 112.58 179.98 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 1.7 mtpp -113.2 -8.63 13.53 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.804 0.335 . . . . 0.0 110.776 179.886 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -150.86 151.39 32.16 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.288 179.989 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 33' ' ' LYS . . . . . 0.707 ' HE3' ' HB ' ' A' ' 23' ' ' ILE . 0.0 OUTLIER -97.97 139.59 33.58 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.753 -0.658 . . . . 0.0 110.739 179.827 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 34' ' ' CYS . . . . . 0.47 ' O ' ' HA ' ' A' ' 23' ' ' ILE . 0.0 OUTLIER -87.76 134.26 33.71 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.913 179.981 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 35' ' ' CYS . . . . . 0.581 ' SG ' ' HE3' ' A' ' 33' ' ' LYS . 1.0 OUTLIER -130.94 125.73 34.22 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.169 -179.971 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 36' ' ' LYS . . . . . 0.794 ' HG2' ' HA ' ' A' ' 5' ' ' CYS . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.047 0 CA-C-O 118.199 -0.905 . . . . 0.0 110.75 179.661 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 N--CA 1.486 1.342 0 CA-C-O 120.827 0.346 . . . . 0.0 111.152 . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 42.2 t60 -60.36 107.5 0.67 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.109 -179.856 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 10.4 t80 -62.87 160.89 13.74 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.742 179.642 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 4' ' ' ASN . . . . . 0.427 ' O ' ' ND2' ' A' ' 4' ' ' ASN . 0.3 OUTLIER -64.09 91.58 0.07 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.222 0.534 . . . . 0.0 110.213 179.623 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -119.51 -75.87 0.58 Allowed 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.485 -0.78 . . . . 0.0 109.71 179.928 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 6' ' ' VAL . . . . . 0.483 ' HA ' ' H ' ' A' ' 10' ' ' GLY . 8.1 p -54.68 -13.72 0.84 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.191 0 CA-C-N 115.76 -0.655 . . . . 0.0 110.688 178.794 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 41.3 t -38.58 -50.89 1.62 Allowed 'General case' 0 N--CA 1.462 0.146 0 CA-C-N 115.76 -0.654 . . . . 0.0 111.288 179.926 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -110.75 -22.95 11.32 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.903 -0.589 . . . . 0.0 110.75 179.957 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 147.88 41.23 0.04 OUTLIER Glycine 0 N--CA 1.452 -0.273 0 C-N-CA 120.736 -0.745 . . . . 0.0 112.536 179.937 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 10' ' ' GLY . . . . . 0.483 ' H ' ' HA ' ' A' ' 6' ' ' VAL . . . -88.53 170.54 38.78 Favored Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.821 -0.704 . . . . 0.0 112.55 179.993 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -143.74 145.76 32.65 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.787 0.327 . . . . 0.0 110.887 -179.937 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 12' ' ' CYS . . . . . 0.445 ' C ' HD22 ' A' ' 13' ' ' LEU . 1.9 m -95.88 134.68 38.58 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.861 179.934 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 13' ' ' LEU . . . . . 0.445 HD22 ' C ' ' A' ' 12' ' ' CYS . 3.8 mm? -122.75 152.22 40.82 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.849 -179.874 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 90.5 m-85 -88.39 4.54 45.92 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.696 179.833 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 15' ' ' SER . . . . . 0.468 ' O ' ' HD2' ' A' ' 33' ' ' LYS . 5.6 t -153.99 -176.22 5.75 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.858 179.954 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -49.8 137.49 16.24 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.048 -0.524 . . . . 0.0 111.38 -179.945 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 17' ' ' CYS . . . . . 0.406 ' HA ' ' HD3' ' A' ' 18' ' ' PRO . 0.1 OUTLIER -45.86 146.05 2.13 Favored Pre-proline 0 C--N 1.332 -0.183 0 CA-C-N 115.952 -0.567 . . . . 0.0 111.316 179.982 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 18' ' ' PRO . . . . . 0.406 ' HD3' ' HA ' ' A' ' 17' ' ' CYS . 53.0 Cg_endo -90.94 -80.37 0.0 OUTLIER 'Trans proline' 0 N--CA 1.454 -0.795 0 C-N-CA 122.969 2.446 . . . . 0.0 112.656 -179.754 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 19' ' ' ILE . . . . . 0.643 HG12 ' H ' ' A' ' 20' ' ' PHE . 6.1 tt -56.17 -172.38 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.534 0.346 0 CA-C-N 116.375 -0.375 . . . . 0.0 111.664 -179.866 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 20' ' ' PHE . . . . . 0.643 ' H ' HG12 ' A' ' 19' ' ' ILE . 0.2 OUTLIER -75.84 36.6 0.14 Allowed 'General case' 0 CA--C 1.531 0.236 0 N-CA-C 111.947 0.351 . . . . 0.0 111.947 -179.533 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 21' ' ' THR . . . . . 0.432 ' OG1' HG22 ' A' ' 19' ' ' ILE . 0.0 OUTLIER -85.81 -162.95 0.79 Allowed 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 120.526 0.203 . . . . 0.0 110.657 179.354 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 2.1 pttt -155.66 122.22 5.25 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.937 0.399 . . . . 0.0 111.527 -179.907 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 23' ' ' ILE . . . . . 0.463 ' HB ' ' HE3' ' A' ' 33' ' ' LYS . 0.3 OUTLIER -75.66 125.72 35.6 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.47 179.434 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 24' ' ' GLN . . . . . 0.447 ' HA ' HE21 ' A' ' 24' ' ' GLN . 0.0 OUTLIER -103.48 -44.07 5.23 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.174 -0.467 . . . . 0.0 111.104 -179.739 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -146.89 -143.69 3.91 Favored Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.739 -0.743 . . . . 0.0 112.627 -179.92 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 26' ' ' THR . . . . . 0.786 ' HA ' ' HA ' ' A' ' 33' ' ' LYS . 0.0 OUTLIER -120.14 140.41 51.13 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.851 0.357 . . . . 0.0 111.217 -179.908 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 41.6 t -85.97 -80.5 0.23 Allowed 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.89 179.913 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 2.9 m-85 -60.27 -173.72 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.813 -0.63 . . . . 0.0 110.943 179.932 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -50.57 -28.13 8.06 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.934 179.772 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 161.76 10.42 0.04 OUTLIER Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.886 -0.673 . . . . 0.0 112.536 179.954 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -96.74 -16.01 21.09 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.754 0.312 . . . . 0.0 111.161 -179.886 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 32' ' ' ALA . . . . . 0.405 ' O ' HG22 ' A' ' 26' ' ' THR . . . -134.93 150.45 50.4 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.828 179.912 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 33' ' ' LYS . . . . . 0.786 ' HA ' ' HA ' ' A' ' 26' ' ' THR . 0.0 OUTLIER -108.57 143.1 38.05 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.832 179.9 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -79.09 125.4 29.36 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.637 179.97 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -126.15 140.12 52.82 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.818 -179.896 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 36' ' ' LYS . . . . . 0.435 ' HE3' ' HB2' ' A' ' 24' ' ' GLN . 0.0 OUTLIER . . . . . 0 C--O 1.248 1.021 0 CA-C-O 118.22 -0.895 . . . . 0.0 110.895 179.798 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.487 1.377 0 CA-C-O 120.8 0.333 . . . . 0.0 111.224 . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 2.0 t-80 -59.98 109.25 0.91 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.844 -179.935 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 9.1 t80 -61.38 167.5 3.24 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.688 179.737 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -77.65 77.27 4.17 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.235 0.541 . . . . 0.0 110.684 179.813 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 0.4 OUTLIER -103.89 -76.29 0.6 Allowed 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.298 -0.865 . . . . 0.0 110.494 179.943 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 6' ' ' VAL . . . . . 0.64 ' HA ' ' H ' ' A' ' 10' ' ' GLY . 7.5 p -54.13 -17.76 2.04 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.153 0 CA-C-N 116.019 -0.537 . . . . 0.0 111.126 179.579 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -45.34 -59.04 2.89 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 115.834 -0.621 . . . . 0.0 111.552 -179.912 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 52.4 p -98.81 -20.11 17.05 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.367 -0.379 . . . . 0.0 111.245 -179.643 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 144.49 53.81 0.03 OUTLIER Glycine 0 N--CA 1.452 -0.267 0 C-N-CA 120.688 -0.768 . . . . 0.0 112.605 -179.963 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 10' ' ' GLY . . . . . 0.64 ' H ' ' HA ' ' A' ' 6' ' ' VAL . . . -105.02 159.79 15.53 Favored Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.78 -0.724 . . . . 0.0 112.465 179.924 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 1.2 mt-30 -125.25 153.21 43.54 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.761 0.315 . . . . 0.0 110.909 -179.926 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 12' ' ' CYS . . . . . 0.449 ' C ' HD22 ' A' ' 13' ' ' LEU . 3.1 m -118.59 119.7 35.28 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.086 -179.773 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 13' ' ' LEU . . . . . 0.449 HD22 ' C ' ' A' ' 12' ' ' CYS . 3.2 mm? -124.82 159.1 31.81 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.722 179.928 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 34.2 m-85 -88.56 -5.52 58.14 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.341 -0.39 . . . . 0.0 111.165 -179.921 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 15' ' ' SER . . . . . 0.441 ' O ' ' HD3' ' A' ' 33' ' ' LYS . 2.4 t -128.4 -179.3 4.95 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.372 -0.377 . . . . 0.0 110.917 -179.877 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -48.84 141.64 7.25 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.087 179.966 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 17' ' ' CYS . . . . . 0.419 ' HA ' ' HD3' ' A' ' 18' ' ' PRO . 0.9 OUTLIER -45.63 141.63 3.85 Favored Pre-proline 0 C--N 1.329 -0.318 0 CA-C-N 115.907 -0.588 . . . . 0.0 111.455 -179.756 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 18' ' ' PRO . . . . . 0.419 ' HD3' ' HA ' ' A' ' 17' ' ' CYS . 38.9 Cg_endo -89.84 -81.59 0.0 OUTLIER 'Trans proline' 0 N--CA 1.453 -0.885 0 C-N-CA 122.91 2.407 . . . . 0.0 112.357 179.94 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 19' ' ' ILE . . . . . 0.71 HG13 ' H ' ' A' ' 20' ' ' PHE . 4.3 tp -56.57 -173.95 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.535 0.393 0 CA-C-N 116.406 -0.361 . . . . 0.0 111.638 179.976 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 20' ' ' PHE . . . . . 0.71 ' H ' HG13 ' A' ' 19' ' ' ILE . 7.5 p90 -71.62 21.36 0.05 Allowed 'General case' 0 CA--C 1.535 0.371 0 N-CA-C 112.939 0.718 . . . . 0.0 112.939 -178.876 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 21' ' ' THR . . . . . 0.492 ' OG1' HG22 ' A' ' 19' ' ' ILE . 0.2 OUTLIER -75.71 -172.21 1.81 Allowed 'General case' 0 N--CA 1.463 0.187 0 C-N-CA 121.051 -0.259 . . . . 0.0 110.86 179.288 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 6.4 tttp -145.94 111.59 5.53 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 120.789 0.328 . . . . 0.0 111.093 -179.749 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 23' ' ' ILE . . . . . 0.487 ' HB ' ' HE3' ' A' ' 33' ' ' LYS . 0.2 OUTLIER -58.72 123.97 11.91 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.189 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.009 -179.96 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -99.36 -25.6 14.42 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.84 179.923 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -178.74 -116.87 0.52 Allowed Glycine 0 N--CA 1.451 -0.358 0 C-N-CA 120.828 -0.701 . . . . 0.0 112.391 179.957 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 26' ' ' THR . . . . . 0.707 ' HA ' ' HA ' ' A' ' 33' ' ' LYS . 1.0 OUTLIER -133.78 143.57 48.49 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.983 0.42 . . . . 0.0 111.352 -179.961 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 10.4 t -81.9 -79.3 0.18 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.903 -0.59 . . . . 0.0 110.968 179.973 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 11.3 m-85 -61.28 -160.5 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.002 -0.545 . . . . 0.0 111.427 -179.928 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 12.0 mtm180 -50.13 -39.2 42.37 Favored 'General case' 0 C--N 1.332 -0.156 0 CA-C-N 115.997 -0.547 . . . . 0.0 111.18 -179.944 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 159.26 33.16 0.02 OUTLIER Glycine 0 N--CA 1.451 -0.328 0 C-N-CA 120.811 -0.709 . . . . 0.0 112.486 179.937 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 2.0 mmpt? -107.77 -32.08 7.78 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.894 0.378 . . . . 0.0 110.788 -179.971 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -121.3 150.67 41.07 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.013 -0.54 . . . . 0.0 110.875 179.932 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 33' ' ' LYS . . . . . 0.707 ' HA ' ' HA ' ' A' ' 26' ' ' THR . 0.0 OUTLIER -90.32 145.39 25.01 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.985 -179.872 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 34' ' ' CYS . . . . . 0.416 ' O ' ' HA ' ' A' ' 23' ' ' ILE . 0.0 OUTLIER -95.03 135.7 36.24 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.976 179.948 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 35' ' ' CYS . . . . . 0.579 ' SG ' ' HE3' ' A' ' 33' ' ' LYS . 1.1 m -129.26 140.27 51.51 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.046 -0.525 . . . . 0.0 110.57 179.93 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 36' ' ' LYS . . . . . 0.607 ' HE3' ' H ' ' A' ' 36' ' ' LYS . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.07 0 CA-C-O 118.179 -0.915 . . . . 0.0 111.063 179.844 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.486 1.354 0 CA-C-O 120.82 0.343 . . . . 0.0 111.302 . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 2.0 t-80 -59.61 109.92 1.02 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.674 179.815 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 6.5 t80 -63.89 160.51 17.44 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.752 179.897 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -71.83 82.77 0.9 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.184 0.516 . . . . 0.0 110.546 179.727 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -99.66 -67.43 0.85 Allowed 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.469 -0.787 . . . . 0.0 110.498 179.948 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 4.2 p -54.78 -15.5 1.31 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.516 179.645 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -42.63 -52.98 4.65 Favored 'General case' 0 N--CA 1.464 0.252 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.518 -179.646 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 10.7 p -101.73 -1.21 33.0 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.903 -179.904 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 112.89 30.36 2.8 Favored Glycine 0 N--CA 1.451 -0.328 0 C-N-CA 120.7 -0.762 . . . . 0.0 112.168 -179.868 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -84.49 165.01 40.31 Favored Glycine 0 N--CA 1.45 -0.388 0 C-N-CA 120.849 -0.691 . . . . 0.0 112.711 -179.869 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -146.38 142.6 28.37 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.643 0.259 . . . . 0.0 110.674 179.94 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 12' ' ' CYS . . . . . 0.459 ' HA ' ' O ' ' A' ' 33' ' ' LYS . 0.0 OUTLIER -97.1 122.54 40.21 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.887 0.375 . . . . 0.0 111.173 -179.868 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -117.02 147.36 42.4 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.729 179.785 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -51.0 -33.96 27.17 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.059 -0.519 . . . . 0.0 111.4 -179.609 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -108.65 163.26 13.41 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.793 179.957 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -52.86 155.2 2.46 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.543 179.473 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 17' ' ' CYS . . . . . 0.518 ' SG ' ' HB ' ' A' ' 23' ' ' ILE . 3.1 m -44.93 138.66 4.11 Favored Pre-proline 0 C--N 1.327 -0.41 0 CA-C-N 115.901 -0.591 . . . . 0.0 111.342 -179.573 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 18' ' ' PRO . . . . . 0.433 ' HD3' ' HA ' ' A' ' 17' ' ' CYS . 50.2 Cg_endo -88.28 -71.87 0.01 OUTLIER 'Trans proline' 0 N--CA 1.454 -0.837 0 C-N-CA 122.996 2.464 . . . . 0.0 111.801 179.62 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 19' ' ' ILE . . . . . 0.458 ' C ' ' H ' ' A' ' 21' ' ' THR . 1.5 tt -56.97 -168.76 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.535 0.396 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.036 179.177 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 20' ' ' PHE . . . . . 0.45 ' N ' HG23 ' A' ' 19' ' ' ILE . 2.1 p90 -73.43 23.43 0.07 Allowed 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.583 0.23 . . . . 0.0 111.538 179.917 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 21' ' ' THR . . . . . 0.458 ' H ' ' C ' ' A' ' 19' ' ' ILE . 0.2 OUTLIER -65.23 -169.45 0.05 OUTLIER 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 120.766 0.317 . . . . 0.0 111.116 179.844 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -156.15 111.0 2.88 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.701 179.996 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 23' ' ' ILE . . . . . 0.769 HG13 ' HB3' ' A' ' 33' ' ' LYS . 0.0 OUTLIER -75.9 132.66 32.73 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-O 121.044 0.45 . . . . 0.0 111.202 -179.779 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -92.98 -43.57 8.86 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.719 -0.673 . . . . 0.0 110.37 179.42 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -159.47 -138.76 2.53 Favored Glycine 0 N--CA 1.45 -0.399 0 CA-C-N 115.613 -0.721 . . . . 0.0 112.05 179.942 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 26' ' ' THR . . . . . 0.411 HG22 ' HE3' ' A' ' 33' ' ' LYS . 4.1 p -120.71 145.34 47.58 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 120.89 0.376 . . . . 0.0 111.028 179.775 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -80.89 -88.4 0.08 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.971 -179.929 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 8.0 m-85 -61.23 -161.69 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.231 179.908 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -50.29 -34.38 23.24 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.972 179.956 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 151.93 48.6 0.02 OUTLIER Glycine 0 N--CA 1.452 -0.27 0 C-N-CA 120.801 -0.714 . . . . 0.0 112.466 179.878 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -116.43 -35.05 4.39 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.769 0.318 . . . . 0.0 110.917 179.968 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -123.79 140.59 52.83 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.221 -179.973 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 33' ' ' LYS . . . . . 0.769 ' HB3' HG13 ' A' ' 23' ' ' ILE . 1.0 OUTLIER -85.74 130.68 34.5 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.879 -179.953 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -80.82 112.23 18.01 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.534 179.703 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 35' ' ' CYS . . . . . 0.527 ' SG ' ' HB ' ' A' ' 23' ' ' ILE . 68.8 m -113.46 151.37 31.52 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.949 -0.568 . . . . 0.0 110.522 179.982 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 36' ' ' LYS . . . . . 0.437 ' HE3' ' O ' ' A' ' 36' ' ' LYS . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.027 0 CA-C-O 118.232 -0.89 . . . . 0.0 110.93 179.704 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 18.4 m-20 . . . . . 0 N--CA 1.486 1.371 0 CA-C-O 120.81 0.338 . . . . 0.0 111.165 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 2' ' ' HIS . . . . . 0.444 ' CE1' HG12 ' A' ' 6' ' ' VAL . 4.1 t-80 -60.35 110.2 1.19 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.841 -179.984 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 3.4 t80 -58.93 150.77 23.45 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.402 179.623 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 4' ' ' ASN . . . . . 0.507 ' OD1' ' HB2' ' A' ' 7' ' ' SER . 4.4 t30 -64.5 86.41 0.05 OUTLIER 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.274 0.559 . . . . 0.0 110.562 179.947 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 5' ' ' CYS . . . . . 0.436 ' HA ' ' HG2' ' A' ' 36' ' ' LYS . 0.1 OUTLIER -116.82 -74.54 0.6 Allowed 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.449 -0.796 . . . . 0.0 110.103 -179.991 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 6' ' ' VAL . . . . . 0.449 ' HA ' ' H ' ' A' ' 10' ' ' GLY . 5.5 p -55.65 -8.17 0.4 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.192 0 CA-C-N 115.946 -0.57 . . . . 0.0 111.21 178.95 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 7' ' ' SER . . . . . 0.507 ' HB2' ' OD1' ' A' ' 4' ' ' ASN . 2.3 t -31.61 -54.02 0.26 Allowed 'General case' 0 N--CA 1.464 0.227 0 CA-C-N 115.755 -0.657 . . . . 0.0 111.553 -179.702 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -115.34 -40.19 3.47 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.695 -0.684 . . . . 0.0 110.754 179.826 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 178.38 41.48 0.07 OUTLIER Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 120.965 -0.636 . . . . 0.0 112.236 -179.975 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 10' ' ' GLY . . . . . 0.449 ' H ' ' HA ' ' A' ' 6' ' ' VAL . . . -94.3 162.77 24.9 Favored Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 120.818 -0.706 . . . . 0.0 112.682 -179.798 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 2.1 pt20 -150.25 150.61 31.77 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.736 0.303 . . . . 0.0 110.675 179.988 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 12' ' ' CYS . . . . . 0.51 ' HB3' ' HB2' ' A' ' 27' ' ' CYS . 0.0 OUTLIER -98.45 114.69 27.15 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.948 0.404 . . . . 0.0 111.384 -179.893 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 13' ' ' LEU . . . . . 0.422 HD22 ' HG3' ' A' ' 18' ' ' PRO . 0.2 OUTLIER -99.69 133.99 43.23 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.211 179.429 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER -53.27 -21.92 6.18 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.398 -0.365 . . . . 0.0 111.184 -179.792 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -114.32 159.24 20.44 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.585 179.618 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -53.22 155.87 2.51 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.332 -0.395 . . . . 0.0 111.131 179.891 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -39.6 112.52 0.78 Allowed Pre-proline 0 C--N 1.328 -0.331 0 CA-C-N 115.427 -0.806 . . . . 0.0 111.749 -179.563 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 18' ' ' PRO . . . . . 0.422 ' HG3' HD22 ' A' ' 13' ' ' LEU . 60.5 Cg_endo -83.56 -72.6 0.01 OUTLIER 'Trans proline' 0 N--CA 1.459 -0.519 0 C-N-CA 122.689 2.26 . . . . 0.0 112.281 179.784 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 19' ' ' ILE . . . . . 0.439 ' C ' ' H ' ' A' ' 21' ' ' THR . 1.2 tt -56.46 -172.8 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.534 0.334 0 CA-C-N 116.408 -0.36 . . . . 0.0 111.375 179.741 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 20' ' ' PHE . . . . . 0.431 ' N ' HG23 ' A' ' 19' ' ' ILE . 38.0 p90 -72.92 24.56 0.06 Allowed 'General case' 0 CA--C 1.53 0.205 0 N-CA-C 111.983 0.364 . . . . 0.0 111.983 -179.66 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 21' ' ' THR . . . . . 0.439 ' H ' ' C ' ' A' ' 19' ' ' ILE . 0.8 OUTLIER -76.88 -162.99 0.31 Allowed 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.626 0.25 . . . . 0.0 110.669 179.527 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 22' ' ' LYS . . . . . 0.402 ' H ' ' HB ' ' A' ' 21' ' ' THR . 8.1 pttp -155.14 111.82 3.24 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.92 0.391 . . . . 0.0 111.0 179.813 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 23' ' ' ILE . . . . . 0.963 HG13 ' HB3' ' A' ' 33' ' ' LYS . 0.0 OUTLIER -74.53 131.41 35.02 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.869 -179.979 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 24' ' ' GLN . . . . . 0.501 ' HA ' ' NE2' ' A' ' 24' ' ' GLN . 0.8 OUTLIER -100.56 -39.38 7.94 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.053 -0.522 . . . . 0.0 110.72 179.68 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -157.15 -151.17 5.92 Favored Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.823 -0.703 . . . . 0.0 112.381 -179.986 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 26' ' ' THR . . . . . 0.871 HG23 ' HE3' ' A' ' 33' ' ' LYS . 0.0 OUTLIER -115.24 149.48 37.68 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.012 0.434 . . . . 0.0 111.208 -179.931 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 27' ' ' CYS . . . . . 0.51 ' HB2' ' HB3' ' A' ' 12' ' ' CYS . 0.0 OUTLIER -91.4 -87.59 0.2 Allowed 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.764 -0.653 . . . . 0.0 111.199 -179.891 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 28' ' ' TYR . . . . . 0.41 ' H ' ' HB3' ' A' ' 27' ' ' CYS . 5.0 m-85 -61.08 -164.01 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.496 -179.743 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -50.24 -33.03 18.22 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.952 -0.567 . . . . 0.0 111.199 -179.907 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 151.35 41.12 0.03 OUTLIER Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 120.673 -0.775 . . . . 0.0 112.742 179.851 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 23.5 mtpt -115.57 -24.39 8.33 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.748 0.309 . . . . 0.0 110.975 179.882 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -129.96 141.82 50.72 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.13 179.97 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 33' ' ' LYS . . . . . 0.963 ' HB3' HG13 ' A' ' 23' ' ' ILE . 1.5 mmpt? -93.99 133.66 37.2 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.05 -179.982 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -77.31 117.56 18.93 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.382 179.574 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 35' ' ' CYS . . . . . 0.563 ' SG ' ' HB ' ' A' ' 23' ' ' ILE . 20.1 m -118.35 146.13 44.61 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.026 -179.579 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 36' ' ' LYS . . . . . 0.491 ' HZ2' ' HB2' ' A' ' 24' ' ' GLN . 5.2 mtmm . . . . . 0 C--O 1.249 1.037 0 CA-C-O 118.29 -0.862 . . . . 0.0 110.851 179.624 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.486 1.368 0 CA-C-O 120.827 0.346 . . . . 0.0 111.154 . . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 8.7 t-80 -60.71 100.82 0.12 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.028 -0.533 . . . . 0.0 111.037 -179.921 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 10.8 t80 -67.2 174.64 3.07 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.717 179.669 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 4' ' ' ASN . . . . . 0.519 ' O ' ' ND2' ' A' ' 4' ' ' ASN . 0.8 OUTLIER -77.1 89.14 3.6 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 121.635 0.731 . . . . 0.0 110.117 179.508 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -118.06 -78.54 0.58 Allowed 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.313 -0.858 . . . . 0.0 109.345 179.954 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 6' ' ' VAL . . . . . 0.793 ' HA ' ' H ' ' A' ' 10' ' ' GLY . 10.4 p -54.47 -20.27 4.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 115.672 -0.695 . . . . 0.0 110.112 178.248 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 10.4 t -44.86 -43.19 8.59 Favored 'General case' 0 C--O 1.232 0.171 0 CA-C-N 115.29 -0.868 . . . . 0.0 111.406 179.989 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 23.0 p -97.53 -36.37 10.33 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.076 -179.793 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 153.85 50.29 0.01 OUTLIER Glycine 0 N--CA 1.453 -0.218 0 C-N-CA 120.686 -0.768 . . . . 0.0 112.531 -179.937 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 10' ' ' GLY . . . . . 0.793 ' H ' ' HA ' ' A' ' 6' ' ' VAL . . . -120.9 -177.14 15.63 Favored Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.768 -0.73 . . . . 0.0 112.578 -179.973 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 32.9 mt-30 -147.1 150.83 35.78 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 120.851 0.358 . . . . 0.0 111.138 -179.946 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 3.2 m -96.79 122.67 40.01 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.389 179.483 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 3.3 mt -132.75 159.01 40.94 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.377 -0.374 . . . . 0.0 111.07 -179.681 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 28.2 m-85 -88.34 -9.93 51.12 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.924 -179.923 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 1.6 m -113.56 167.12 10.86 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.134 -179.862 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -52.98 147.3 9.5 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.04 -0.527 . . . . 0.0 111.318 -179.942 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -45.6 120.7 5.07 Favored Pre-proline 0 C--N 1.328 -0.351 0 CA-C-N 115.666 -0.697 . . . . 0.0 111.469 -179.89 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 58.9 Cg_endo -84.01 -75.42 0.0 OUTLIER 'Trans proline' 0 N--CA 1.458 -0.579 0 C-N-CA 122.599 2.2 . . . . 0.0 112.455 179.876 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 19' ' ' ILE . . . . . 0.476 HG22 ' OG1' ' A' ' 21' ' ' THR . 0.3 OUTLIER -56.36 -172.48 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.534 0.34 0 CA-C-N 116.493 -0.322 . . . . 0.0 111.478 179.956 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 20' ' ' PHE . . . . . 0.426 ' N ' HG23 ' A' ' 19' ' ' ILE . 3.0 p90 -75.34 33.5 0.11 Allowed 'General case' 0 CA--C 1.531 0.227 0 N-CA-C 112.113 0.412 . . . . 0.0 112.113 -179.398 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 21' ' ' THR . . . . . 0.476 ' OG1' HG22 ' A' ' 19' ' ' ILE . 0.6 OUTLIER -90.52 -168.95 2.24 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.761 0.315 . . . . 0.0 110.64 179.306 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 11.6 ptpt -151.95 129.86 11.73 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.264 -0.426 . . . . 0.0 110.819 179.649 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 23' ' ' ILE . . . . . 0.699 ' HB ' ' HE3' ' A' ' 33' ' ' LYS . 0.2 OUTLIER -80.76 127.45 39.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.846 -179.811 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 24' ' ' GLN . . . . . 0.536 ' HB2' ' HE2' ' A' ' 36' ' ' LYS . 0.8 OUTLIER -105.68 -35.89 7.25 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.813 -0.63 . . . . 0.0 110.894 -179.734 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -161.21 -128.05 0.92 Allowed Glycine 0 N--CA 1.451 -0.362 0 C-N-CA 120.788 -0.72 . . . . 0.0 112.503 179.974 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 26' ' ' THR . . . . . 0.472 ' HA ' ' HA ' ' A' ' 33' ' ' LYS . 40.9 p -127.72 150.37 49.81 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.992 0.425 . . . . 0.0 111.145 -179.947 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 15.0 t -93.75 -83.59 0.32 Allowed 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.776 -0.647 . . . . 0.0 111.186 -179.671 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 43.2 m-85 -60.85 -169.45 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.59 -179.658 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 12.9 mtp180 -45.92 -44.03 14.34 Favored 'General case' 0 N--CA 1.462 0.135 0 CA-C-N 115.876 -0.602 . . . . 0.0 111.377 -179.866 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 163.1 48.37 0.02 OUTLIER Glycine 0 N--CA 1.452 -0.285 0 C-N-CA 120.635 -0.793 . . . . 0.0 112.649 179.983 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 30.5 mttt -128.97 -18.62 3.73 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.844 0.354 . . . . 0.0 111.009 179.976 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -136.0 147.58 48.04 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.056 179.917 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 33' ' ' LYS . . . . . 0.699 ' HE3' ' HB ' ' A' ' 23' ' ' ILE . 0.0 OUTLIER -91.58 148.09 22.53 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.815 -179.979 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -94.45 126.27 39.62 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.905 -0.589 . . . . 0.0 111.272 -179.798 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 35' ' ' CYS . . . . . 0.53 ' SG ' ' HE3' ' A' ' 33' ' ' LYS . 0.8 OUTLIER -122.51 143.63 49.59 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.411 179.506 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 36' ' ' LYS . . . . . 0.536 ' HE2' ' HB2' ' A' ' 24' ' ' GLN . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.058 0 CA-C-O 118.236 -0.888 . . . . 0.0 111.087 -179.894 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.486 1.372 0 CA-C-O 120.802 0.334 . . . . 0.0 111.198 . . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 8.6 t-80 -60.47 101.09 0.12 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.889 179.88 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 3' ' ' TYR . . . . . 0.418 ' HB3' ' SG ' ' A' ' 5' ' ' CYS . 2.2 t80 -62.16 163.56 7.99 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.275 179.703 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 19.2 t-20 -79.21 74.36 5.78 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 121.491 0.662 . . . . 0.0 110.525 179.807 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 5' ' ' CYS . . . . . 0.78 ' HA ' ' HG2' ' A' ' 36' ' ' LYS . 0.0 OUTLIER -104.49 -55.83 2.29 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 114.984 -1.007 . . . . 0.0 109.934 179.696 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 6' ' ' VAL . . . . . 0.53 ' HA ' ' N ' ' A' ' 10' ' ' GLY . 1.6 p -55.68 -8.08 0.39 Allowed 'Isoleucine or valine' 0 CA--C 1.53 0.182 0 CA-C-N 115.713 -0.676 . . . . 0.0 111.404 179.048 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 7' ' ' SER . . . . . 0.422 ' H ' ' C ' ' A' ' 5' ' ' CYS . 4.2 t -35.58 -52.95 0.68 Allowed 'General case' 0 N--CA 1.464 0.24 0 CA-C-N 115.877 -0.602 . . . . 0.0 111.72 -179.472 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 8.6 p -115.04 -10.98 12.17 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.861 -179.942 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 145.16 31.44 0.08 OUTLIER Glycine 0 N--CA 1.45 -0.39 0 C-N-CA 120.854 -0.688 . . . . 0.0 112.304 -179.84 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 10' ' ' GLY . . . . . 0.53 ' N ' ' HA ' ' A' ' 6' ' ' VAL . . . -62.27 175.38 7.0 Favored Glycine 0 N--CA 1.45 -0.429 0 C-N-CA 120.905 -0.664 . . . . 0.0 112.527 -179.974 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 3.2 pt20 -150.26 156.82 42.28 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.895 0.378 . . . . 0.0 111.175 -179.831 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 3.3 m -128.17 111.61 13.63 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.79 179.864 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 1.1 pt? -140.14 148.51 41.75 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.97 179.949 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 27.2 m-85 -63.31 -33.01 74.58 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.03 -0.532 . . . . 0.0 111.462 -179.58 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -79.7 148.96 31.35 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.39 -0.368 . . . . 0.0 111.316 -179.682 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 16' ' ' ALA . . . . . 0.452 ' HA ' ' HD3' ' A' ' 33' ' ' LYS . . . -55.16 154.79 5.34 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.118 179.698 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -41.4 122.9 2.2 Favored Pre-proline 0 C--N 1.327 -0.377 0 CA-C-N 115.397 -0.819 . . . . 0.0 111.786 -179.635 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 59.3 Cg_endo -86.98 -77.14 0.0 OUTLIER 'Trans proline' 0 N--CA 1.456 -0.694 0 C-N-CA 122.771 2.314 . . . . 0.0 112.314 179.609 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 19' ' ' ILE . . . . . 0.483 HG22 ' OG1' ' A' ' 21' ' ' THR . 0.3 OUTLIER -56.54 -171.74 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.535 0.367 0 CA-C-N 116.452 -0.34 . . . . 0.0 111.387 179.727 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 20' ' ' PHE . . . . . 0.448 ' N ' HG23 ' A' ' 19' ' ' ILE . 0.7 OUTLIER -71.25 19.38 0.06 Allowed 'General case' 0 CA--C 1.531 0.238 0 N-CA-C 112.414 0.524 . . . . 0.0 112.414 -179.426 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 21' ' ' THR . . . . . 0.483 ' OG1' HG22 ' A' ' 19' ' ' ILE . 0.3 OUTLIER -73.99 -170.57 0.94 Allowed 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.761 0.315 . . . . 0.0 110.625 179.388 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 22' ' ' LYS . . . . . 0.476 ' HG2' ' OXT' ' A' ' 36' ' ' LYS . 0.7 OUTLIER -150.76 122.73 8.18 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.79 179.822 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 23' ' ' ILE . . . . . 0.883 ' HB ' ' HE3' ' A' ' 33' ' ' LYS . 0.2 OUTLIER -71.61 130.18 35.2 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-O 120.975 0.416 . . . . 0.0 110.402 179.913 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 24' ' ' GLN . . . . . 0.421 HE22 ' CB ' ' A' ' 34' ' ' CYS . 1.0 OUTLIER -111.95 -4.56 14.5 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.856 -0.611 . . . . 0.0 111.13 -179.298 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 163.82 -135.4 3.77 Favored Glycine 0 N--CA 1.45 -0.412 0 C-N-CA 120.879 -0.677 . . . . 0.0 112.229 -179.993 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 26' ' ' THR . . . . . 0.671 ' HA ' ' HA ' ' A' ' 33' ' ' LYS . 1.2 p -127.3 149.71 49.91 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 121.029 0.442 . . . . 0.0 111.286 179.883 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 27' ' ' CYS . . . . . 0.417 ' HB3' ' H ' ' A' ' 28' ' ' TYR . 4.2 t -88.08 -82.47 0.23 Allowed 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.607 -0.724 . . . . 0.0 111.014 -179.691 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 28' ' ' TYR . . . . . 0.417 ' H ' ' HB3' ' A' ' 27' ' ' CYS . 60.8 m-85 -61.13 -165.95 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.682 -179.841 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -49.22 -42.43 40.39 Favored 'General case' 0 C--N 1.333 -0.139 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.337 -179.813 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 163.94 50.21 0.02 OUTLIER Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.724 -0.75 . . . . 0.0 112.557 179.896 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -124.78 -37.96 2.42 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.78 0.324 . . . . 0.0 110.835 179.948 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -121.54 145.92 47.47 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.887 179.921 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 33' ' ' LYS . . . . . 0.883 ' HE3' ' HB ' ' A' ' 23' ' ' ILE . 0.0 OUTLIER -94.98 145.56 24.85 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.835 -179.941 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 34' ' ' CYS . . . . . 0.425 ' O ' ' HA ' ' A' ' 23' ' ' ILE . 0.0 OUTLIER -90.66 142.96 27.21 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.208 -179.969 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 35' ' ' CYS . . . . . 0.577 ' SG ' ' HE3' ' A' ' 33' ' ' LYS . 1.2 m -138.68 142.07 39.0 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.973 179.933 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 36' ' ' LYS . . . . . 0.78 ' HG2' ' HA ' ' A' ' 5' ' ' CYS . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.066 0 CA-C-O 118.217 -0.897 . . . . 0.0 110.987 179.803 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 17.9 m-20 . . . . . 0 N--CA 1.486 1.368 0 CA-C-O 120.857 0.36 . . . . 0.0 111.271 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 15.2 t-80 -59.89 104.35 0.29 Allowed 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.936 179.991 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 6.0 t80 -61.15 174.58 0.65 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.958 -0.564 . . . . 0.0 110.693 179.731 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -79.55 79.37 6.03 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 121.264 0.554 . . . . 0.0 110.274 179.569 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -109.21 -65.01 1.18 Allowed 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.3 -0.864 . . . . 0.0 110.691 -179.748 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 6' ' ' VAL . . . . . 0.52 ' HA ' ' H ' ' A' ' 10' ' ' GLY . 0.3 OUTLIER -53.93 -17.83 1.93 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 115.672 -0.694 . . . . 0.0 111.143 179.923 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -45.46 -35.99 4.14 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-N 115.916 -0.584 . . . . 0.0 111.183 179.899 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -114.89 -13.7 11.95 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.801 179.845 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 123.81 41.58 0.41 Allowed Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.85 -0.691 . . . . 0.0 112.496 -179.973 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 10' ' ' GLY . . . . . 0.52 ' H ' ' HA ' ' A' ' 6' ' ' VAL . . . -92.23 174.89 37.4 Favored Glycine 0 N--CA 1.452 -0.284 0 C-N-CA 120.785 -0.721 . . . . 0.0 112.417 179.978 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 1.2 tt0 -147.45 150.87 35.44 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.764 0.316 . . . . 0.0 110.874 179.919 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 12' ' ' CYS . . . . . 0.436 ' C ' HD22 ' A' ' 13' ' ' LEU . 1.7 m -93.49 139.37 30.8 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.132 -0.485 . . . . 0.0 111.264 -179.71 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 13' ' ' LEU . . . . . 0.436 HD22 ' C ' ' A' ' 12' ' ' CYS . 3.2 mm? -126.35 142.41 51.54 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.459 179.657 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 2.0 m-85 -74.67 -1.91 23.9 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.396 -0.366 . . . . 0.0 111.209 -179.761 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 15' ' ' SER . . . . . 0.505 ' O ' ' HD2' ' A' ' 33' ' ' LYS . 0.4 OUTLIER -149.91 -179.05 6.83 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.813 179.852 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -44.97 137.18 4.28 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.213 179.984 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 17' ' ' CYS . . . . . 0.452 ' SG ' ' HD2' ' A' ' 18' ' ' PRO . 0.5 OUTLIER -45.49 141.77 3.61 Favored Pre-proline 0 C--N 1.33 -0.268 0 CA-C-N 115.919 -0.582 . . . . 0.0 111.691 -179.568 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 18' ' ' PRO . . . . . 0.452 ' HD2' ' SG ' ' A' ' 17' ' ' CYS . 68.3 Cg_endo -79.3 -83.92 0.0 OUTLIER 'Trans proline' 0 C--N 1.348 0.545 0 C-N-CA 122.618 2.212 . . . . 0.0 112.641 -179.982 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 19' ' ' ILE . . . . . 0.475 HG12 ' H ' ' A' ' 20' ' ' PHE . 3.6 tt -56.17 -176.07 0.02 OUTLIER 'Isoleucine or valine' 0 CA--C 1.533 0.308 0 CA-C-O 120.784 0.326 . . . . 0.0 111.593 -179.768 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 20' ' ' PHE . . . . . 0.475 ' H ' HG12 ' A' ' 19' ' ' ILE . 0.4 OUTLIER -76.3 35.19 0.14 Allowed 'General case' 0 C--N 1.331 -0.205 0 N-CA-C 111.996 0.369 . . . . 0.0 111.996 -179.368 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 21' ' ' THR . . . . . 0.467 ' HB ' ' H ' ' A' ' 22' ' ' LYS . 0.0 OUTLIER -75.9 -152.46 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.792 -0.185 . . . . 0.0 110.507 179.441 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 22' ' ' LYS . . . . . 0.467 ' H ' ' HB ' ' A' ' 21' ' ' THR . 8.0 ttmm -160.45 108.59 1.63 Allowed 'General case' 0 C--O 1.231 0.122 0 CA-C-O 120.859 0.361 . . . . 0.0 111.838 -179.744 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 23' ' ' ILE . . . . . 0.911 HD13 ' HB2' ' A' ' 33' ' ' LYS . 0.1 OUTLIER -66.12 133.21 31.29 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.197 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.852 179.344 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 24' ' ' GLN . . . . . 0.676 ' HB2' ' NZ ' ' A' ' 36' ' ' LYS . 0.0 OUTLIER -114.54 -68.53 0.92 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.614 179.537 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -121.98 164.19 15.16 Favored Glycine 0 N--CA 1.452 -0.295 0 C-N-CA 121.032 -0.604 . . . . 0.0 111.931 179.632 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 26' ' ' THR . . . . . 0.591 ' HA ' ' HA ' ' A' ' 33' ' ' LYS . 1.0 OUTLIER -75.5 153.02 37.76 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.07 0.462 . . . . 0.0 111.622 -179.802 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 18.4 t -100.67 -78.74 0.51 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.655 -0.702 . . . . 0.0 110.911 -179.903 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 3.4 m-85 -60.3 -174.69 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.989 179.931 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 20.0 ttm-85 -50.6 -25.86 4.67 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.873 179.783 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 156.26 9.59 0.06 OUTLIER Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.971 -0.633 . . . . 0.0 112.162 179.851 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -98.64 -14.01 20.06 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.685 0.279 . . . . 0.0 111.11 -179.858 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -138.51 141.95 39.35 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.411 -0.359 . . . . 0.0 110.555 179.896 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 33' ' ' LYS . . . . . 0.911 ' HB2' HD13 ' A' ' 23' ' ' ILE . 0.0 OUTLIER -107.53 141.71 38.55 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.95 0.405 . . . . 0.0 110.776 -179.889 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -84.11 131.27 34.8 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.025 -0.534 . . . . 0.0 111.668 -179.466 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -115.9 156.33 26.36 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 115.774 -0.648 . . . . 0.0 111.089 179.907 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 36' ' ' LYS . . . . . 0.676 ' NZ ' ' HB2' ' A' ' 24' ' ' GLN . 0.1 OUTLIER . . . . . 0 C--O 1.249 1.051 0 CA-C-O 118.412 -0.804 . . . . 0.0 111.005 -179.792 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.487 1.381 0 CA-C-O 120.78 0.324 . . . . 0.0 111.213 . . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 6.3 t-80 -60.28 108.3 0.78 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.853 179.999 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 6.1 t80 -62.51 169.73 2.83 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.986 179.847 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 1.1 m-80 -76.01 86.46 2.92 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.083 0.468 . . . . 0.0 110.764 179.89 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -114.93 -74.58 0.61 Allowed 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.652 -0.704 . . . . 0.0 110.441 179.862 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 6' ' ' VAL . . . . . 0.43 ' HA ' ' H ' ' A' ' 10' ' ' GLY . 7.3 p -54.23 -15.34 1.08 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 115.67 -0.695 . . . . 0.0 111.05 179.467 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -44.18 -57.12 3.61 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-N 115.901 -0.59 . . . . 0.0 111.386 -179.932 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 1.2 m -99.81 -27.81 13.44 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.872 179.986 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 147.23 53.09 0.02 OUTLIER Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.78 -0.724 . . . . 0.0 112.432 -179.926 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 10' ' ' GLY . . . . . 0.43 ' H ' ' HA ' ' A' ' 6' ' ' VAL . . . -121.53 166.86 14.32 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.849 -0.691 . . . . 0.0 112.386 -179.973 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 1.9 tp60 -147.96 151.63 36.14 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.742 0.306 . . . . 0.0 110.398 179.86 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 12' ' ' CYS . . . . . 0.423 ' HB3' ' HB3' ' A' ' 27' ' ' CYS . 1.6 m -65.58 120.91 13.77 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.865 0.364 . . . . 0.0 111.093 -179.742 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 13' ' ' LEU . . . . . 0.522 ' HB3' ' O ' ' A' ' 15' ' ' SER . 0.4 OUTLIER -99.74 109.85 22.27 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.934 -0.576 . . . . 0.0 110.478 179.752 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 14' ' ' TYR . . . . . 0.42 ' HA ' ' HB2' ' A' ' 32' ' ' ALA . 5.2 m-85 -52.89 -19.96 2.96 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.015 -0.539 . . . . 0.0 111.096 -179.893 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 15' ' ' SER . . . . . 0.522 ' O ' ' HB3' ' A' ' 13' ' ' LEU . 0.7 OUTLIER -133.19 169.94 16.15 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.16 179.368 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -50.75 142.67 10.94 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.568 -0.287 . . . . 0.0 110.743 179.852 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -44.97 126.35 5.33 Favored Pre-proline 0 C--N 1.331 -0.203 0 CA-C-N 116.132 -0.485 . . . . 0.0 111.237 -179.571 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 59.1 Cg_endo -90.05 -72.67 0.0 OUTLIER 'Trans proline' 0 N--CA 1.456 -0.724 0 C-N-CA 122.978 2.452 . . . . 0.0 112.74 -179.554 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 19' ' ' ILE . . . . . 0.765 HG13 ' H ' ' A' ' 20' ' ' PHE . 5.2 tp -56.02 -172.92 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.533 0.292 0 CA-C-N 116.344 -0.389 . . . . 0.0 111.501 -179.86 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 20' ' ' PHE . . . . . 0.765 ' H ' HG13 ' A' ' 19' ' ' ILE . 8.1 p90 -74.47 33.13 0.09 Allowed 'General case' 0 C--N 1.331 -0.205 0 N-CA-C 111.693 0.257 . . . . 0.0 111.693 -179.765 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 21' ' ' THR . . . . . 0.47 ' HB ' ' H ' ' A' ' 22' ' ' LYS . 0.6 OUTLIER -81.17 -150.78 0.08 Allowed 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.582 -0.281 . . . . 0.0 110.617 179.447 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 22' ' ' LYS . . . . . 0.47 ' H ' ' HB ' ' A' ' 21' ' ' THR . 2.6 tptp -167.11 108.71 0.65 Allowed 'General case' 0 C--N 1.332 -0.158 0 CA-C-O 120.798 0.333 . . . . 0.0 110.954 179.991 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 23' ' ' ILE . . . . . 0.68 HG13 ' HE2' ' A' ' 33' ' ' LYS . 0.0 OUTLIER -68.27 138.65 22.11 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.614 179.665 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -108.94 -69.93 0.83 Allowed 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.842 -179.984 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -131.51 -146.74 5.84 Favored Glycine 0 N--CA 1.451 -0.34 0 CA-C-N 115.689 -0.687 . . . . 0.0 112.159 179.995 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 26' ' ' THR . . . . . 0.62 ' HA ' ' HA ' ' A' ' 33' ' ' LYS . 9.6 p -113.96 147.93 37.75 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 121.012 0.434 . . . . 0.0 111.338 -179.942 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 27' ' ' CYS . . . . . 0.423 ' HB3' ' HB3' ' A' ' 12' ' ' CYS . 51.7 t -94.15 -92.8 0.18 Allowed 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.705 -0.68 . . . . 0.0 111.016 -179.779 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 16.7 m-85 -61.4 -156.29 0.01 OUTLIER 'General case' 0 CA--C 1.53 0.193 0 CA-C-N 115.978 -0.555 . . . . 0.0 111.604 -179.858 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 3.4 mmm-85 -50.59 -43.94 56.71 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 115.978 -0.556 . . . . 0.0 111.364 -179.896 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 161.31 26.68 0.02 OUTLIER Glycine 0 N--CA 1.453 -0.217 0 C-N-CA 120.691 -0.766 . . . . 0.0 112.679 179.992 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -105.26 -15.16 15.13 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.887 0.375 . . . . 0.0 110.694 179.911 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 32' ' ' ALA . . . . . 0.42 ' HB2' ' HA ' ' A' ' 14' ' ' TYR . . . -140.84 126.69 19.26 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.737 -179.993 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 33' ' ' LYS . . . . . 0.68 ' HE2' HG13 ' A' ' 23' ' ' ILE . 0.0 OUTLIER -93.03 132.04 37.49 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.779 0.324 . . . . 0.0 110.778 179.877 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -55.72 120.16 6.87 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.715 179.82 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 35' ' ' CYS . . . . . 0.512 ' SG ' ' HB ' ' A' ' 23' ' ' ILE . 0.9 OUTLIER -122.2 141.74 51.15 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.017 -179.672 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.028 0 CA-C-O 118.223 -0.894 . . . . 0.0 110.901 179.844 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 19.4 m-20 . . . . . 0 N--CA 1.486 1.357 0 CA-C-O 120.821 0.343 . . . . 0.0 111.027 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 13.9 t-80 -60.91 94.91 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.09 179.841 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 21.0 t80 -65.01 161.53 18.53 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.655 179.572 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -60.75 100.02 0.1 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.347 0.594 . . . . 0.0 110.153 179.509 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 5' ' ' CYS . . . . . 0.743 ' HA ' ' HG2' ' A' ' 36' ' ' LYS . 0.1 OUTLIER -130.34 -82.42 0.54 Allowed 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.545 -0.752 . . . . 0.0 109.918 -179.712 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 6' ' ' VAL . . . . . 0.428 ' HA ' ' H ' ' A' ' 10' ' ' GLY . 7.1 p -54.49 -15.26 1.13 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.183 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.702 178.872 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -44.75 -47.09 10.77 Favored 'General case' 0 C--N 1.333 -0.14 0 CA-C-N 115.669 -0.696 . . . . 0.0 111.519 -179.91 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 3.3 p -114.12 -3.11 13.29 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.288 -0.415 . . . . 0.0 111.11 -179.847 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 124.38 38.23 0.53 Allowed Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 120.678 -0.772 . . . . 0.0 112.617 179.947 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 10' ' ' GLY . . . . . 0.428 ' H ' ' HA ' ' A' ' 6' ' ' VAL . . . -102.54 169.99 19.88 Favored Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.802 -0.714 . . . . 0.0 112.333 179.925 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -150.34 144.84 25.76 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.866 0.365 . . . . 0.0 110.928 179.9 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 12' ' ' CYS . . . . . 0.465 ' HB3' ' HB2' ' A' ' 27' ' ' CYS . 0.0 OUTLIER -92.47 136.05 33.54 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.006 179.866 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 1.9 mp -131.51 162.67 29.72 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.847 -179.885 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 59.3 m-85 -79.73 -45.19 19.35 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.944 -179.993 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -89.21 171.67 9.63 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.13 -179.861 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -55.21 152.53 8.01 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.079 -0.509 . . . . 0.0 111.459 179.994 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 17' ' ' CYS . . . . . 0.43 ' HA ' ' HD3' ' A' ' 18' ' ' PRO . 0.1 OUTLIER -45.36 127.05 6.02 Favored Pre-proline 0 C--N 1.329 -0.289 0 CA-C-N 115.603 -0.726 . . . . 0.0 111.373 -179.988 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 18' ' ' PRO . . . . . 0.43 ' HD3' ' HA ' ' A' ' 17' ' ' CYS . 57.1 Cg_endo -89.18 -78.62 0.0 OUTLIER 'Trans proline' 0 N--CA 1.456 -0.721 0 C-N-CA 122.758 2.305 . . . . 0.0 112.589 -179.953 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 19' ' ' ILE . . . . . 0.776 HG13 ' H ' ' A' ' 20' ' ' PHE . 5.4 tp -56.45 -171.93 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.535 0.371 0 CA-C-N 116.496 -0.32 . . . . 0.0 111.732 -179.793 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 20' ' ' PHE . . . . . 0.776 ' H ' HG13 ' A' ' 19' ' ' ILE . 2.1 p90 -69.77 19.8 0.04 OUTLIER 'General case' 0 N--CA 1.463 0.222 0 N-CA-C 112.314 0.487 . . . . 0.0 112.314 -179.315 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 21' ' ' THR . . . . . 0.452 ' H ' ' C ' ' A' ' 19' ' ' ILE . 0.6 OUTLIER -73.25 -159.63 0.07 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.567 0.222 . . . . 0.0 110.651 179.473 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 22' ' ' LYS . . . . . 0.405 ' H ' ' HB ' ' A' ' 21' ' ' THR . 8.8 tptp -160.63 117.82 2.42 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.931 0.396 . . . . 0.0 111.421 -179.948 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 23' ' ' ILE . . . . . 0.58 HD12 ' HE3' ' A' ' 33' ' ' LYS . 0.6 OUTLIER -73.04 131.0 35.51 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.606 179.31 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 24' ' ' GLN . . . . . 0.885 ' HB2' ' HE2' ' A' ' 36' ' ' LYS . 5.0 tp60 -113.31 -68.63 0.91 Allowed 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.618 179.915 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -126.54 -138.46 4.82 Favored Glycine 0 N--CA 1.45 -0.428 0 C-N-CA 120.847 -0.692 . . . . 0.0 112.074 179.697 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 26' ' ' THR . . . . . 0.662 ' HA ' ' HA ' ' A' ' 33' ' ' LYS . 3.1 p -125.3 146.61 49.48 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 120.932 0.396 . . . . 0.0 111.17 179.93 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 27' ' ' CYS . . . . . 0.465 ' HB2' ' HB3' ' A' ' 12' ' ' CYS . 0.0 OUTLIER -86.44 -81.88 0.21 Allowed 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.808 -0.633 . . . . 0.0 111.169 -179.717 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 24.0 m-85 -61.02 -165.27 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.905 -0.589 . . . . 0.0 111.887 -179.598 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -50.52 -34.48 25.44 Favored 'General case' 0 C--N 1.333 -0.152 0 CA-C-N 115.87 -0.605 . . . . 0.0 111.419 -179.929 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 153.91 41.37 0.02 OUTLIER Glycine 0 N--CA 1.452 -0.235 0 C-N-CA 120.726 -0.75 . . . . 0.0 112.491 -179.915 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 15.2 mttm -116.76 -23.53 8.09 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.841 0.353 . . . . 0.0 110.88 179.923 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -136.33 145.67 45.72 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.911 179.952 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 33' ' ' LYS . . . . . 0.662 ' HA ' ' HA ' ' A' ' 26' ' ' THR . 0.0 OUTLIER -98.26 138.95 34.78 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.918 -179.875 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -78.07 138.29 38.69 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.753 179.958 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 35' ' ' CYS . . . . . 0.414 ' SG ' ' NZ ' ' A' ' 33' ' ' LYS . 1.2 m -125.88 131.5 52.35 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.965 -179.839 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 36' ' ' LYS . . . . . 0.885 ' HE2' ' HB2' ' A' ' 24' ' ' GLN . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.054 0 CA-C-O 118.247 -0.882 . . . . 0.0 110.919 179.908 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 6.7 t-80 . . . . . 0 CA--C 1.528 0.11 0 CA-C-O 120.807 0.337 . . . . 0.0 111.089 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 5.2 t80 -63.48 158.66 20.33 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.501 179.573 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -66.57 86.08 0.11 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.079 0.466 . . . . 0.0 110.547 179.813 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -106.86 -74.32 0.66 Allowed 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.616 -0.72 . . . . 0.0 110.867 -179.709 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 6' ' ' VAL . . . . . 0.532 ' HA ' ' H ' ' A' ' 10' ' ' GLY . 12.7 p -53.64 -25.22 11.03 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.228 0 CA-C-N 115.987 -0.551 . . . . 0.0 111.157 179.914 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -45.37 -53.37 8.69 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.835 -0.62 . . . . 0.0 111.34 179.992 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 58.6 m -95.68 -31.24 13.34 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.984 -179.925 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 147.26 54.63 0.02 OUTLIER Glycine 0 N--CA 1.452 -0.276 0 C-N-CA 120.865 -0.683 . . . . 0.0 112.404 179.989 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . 0.532 ' H ' ' HA ' ' A' ' 6' ' ' VAL . . . -123.89 174.32 16.77 Favored Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.714 -0.755 . . . . 0.0 112.632 -179.919 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 7.3 tt0 -150.02 156.39 41.6 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.87 0.367 . . . . 0.0 110.918 -179.946 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -98.02 131.06 44.77 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.041 -0.527 . . . . 0.0 111.031 -179.937 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -134.85 134.75 41.09 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.871 179.982 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 40.3 m-85 -59.15 -28.66 66.79 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.119 -179.973 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 47.1 m -107.25 169.45 8.56 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.152 -179.804 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . 0.431 ' HA ' ' HD3' ' A' ' 33' ' ' LYS . . . -52.64 154.28 2.74 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 115.984 -0.553 . . . . 0.0 111.464 -179.986 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . 0.636 ' SG ' ' HE3' ' A' ' 33' ' ' LYS . 85.3 m -45.33 134.04 5.73 Favored Pre-proline 0 C--N 1.328 -0.347 0 CA-C-N 115.437 -0.802 . . . . 0.0 111.633 -179.748 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . 0.503 ' HG2' ' H ' ' A' ' 19' ' ' ILE . 69.7 Cg_endo -77.06 -78.94 0.01 OUTLIER 'Trans proline' 0 C--N 1.347 0.464 0 C-N-CA 122.501 2.134 . . . . 0.0 111.81 179.444 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' ILE . . . . . 0.503 ' H ' ' HG2' ' A' ' 18' ' ' PRO . 2.0 tt -56.63 -172.1 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.534 0.334 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.126 179.351 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' PHE . . . . . 0.406 ' N ' HG23 ' A' ' 19' ' ' ILE . 0.3 OUTLIER -77.94 41.41 0.35 Allowed 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.728 0.299 . . . . 0.0 111.471 -179.926 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' THR . . . . . 0.617 ' HB ' ' SG ' ' A' ' 35' ' ' CYS . 0.4 OUTLIER -89.97 -165.81 1.44 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.471 -0.331 . . . . 0.0 110.905 179.799 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . 0.518 ' O ' ' HG2' ' A' ' 22' ' ' LYS . 0.0 OUTLIER -150.13 128.54 12.17 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-O 120.985 0.421 . . . . 0.0 110.719 179.504 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' ILE . . . . . 0.553 HG13 ' HB2' ' A' ' 33' ' ' LYS . 0.1 OUTLIER -78.06 124.45 36.46 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.908 -179.447 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' GLN . . . . . 0.584 ' HB2' ' HE2' ' A' ' 36' ' ' LYS . 3.1 mt-30 -93.8 -57.68 2.48 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.91 179.989 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -136.1 -148.62 5.59 Favored Glycine 0 N--CA 1.452 -0.287 0 C-N-CA 120.919 -0.658 . . . . 0.0 112.486 -179.984 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . 0.407 ' HA ' ' HA ' ' A' ' 33' ' ' LYS . 0.7 OUTLIER -118.96 147.25 44.26 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.962 0.41 . . . . 0.0 111.241 -179.997 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 9.5 t -83.87 -95.39 0.06 Allowed 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.746 -0.661 . . . . 0.0 110.953 -179.768 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 14.9 m-85 -61.51 -156.61 0.01 OUTLIER 'General case' 0 CA--C 1.53 0.176 0 CA-C-O 120.985 0.422 . . . . 0.0 111.474 179.984 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 1.9 mtp180 -50.06 -35.36 24.84 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-N 116.053 -0.521 . . . . 0.0 111.109 179.983 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 155.64 17.39 0.04 OUTLIER Glycine 0 N--CA 1.452 -0.289 0 C-N-CA 120.727 -0.749 . . . . 0.0 112.5 179.925 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 18.6 tttt -89.67 -24.21 21.66 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.91 0.386 . . . . 0.0 110.531 179.83 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -130.27 144.92 51.66 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.96 -0.564 . . . . 0.0 111.009 179.897 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . 0.636 ' HE3' ' SG ' ' A' ' 17' ' ' CYS . 0.0 OUTLIER -102.24 139.66 37.55 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.787 -179.992 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -81.72 125.51 30.7 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.657 179.861 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 35' ' ' CYS . . . . . 0.617 ' SG ' ' HB ' ' A' ' 21' ' ' THR . 4.6 t -127.49 151.53 48.74 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.355 -179.684 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . 0.584 ' HE2' ' HB2' ' A' ' 24' ' ' GLN . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.071 0 CA-C-O 118.253 -0.879 . . . . 0.0 110.799 179.953 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 6.5 t-80 . . . . . 0 C--O 1.231 0.128 0 CA-C-O 120.802 0.334 . . . . 0.0 110.853 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 9.0 t80 -54.96 162.14 1.39 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.731 179.732 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 1.2 m120 -72.42 80.49 1.04 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.206 0.527 . . . . 0.0 110.543 179.836 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 3.0 m -98.3 -70.0 0.74 Allowed 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.398 -0.819 . . . . 0.0 110.525 -179.916 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 2.0 p -54.85 -13.52 0.83 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-N 116.081 -0.509 . . . . 0.0 111.153 179.176 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 1.2 t -41.88 -51.7 4.24 Favored 'General case' 0 N--CA 1.462 0.153 0 CA-C-N 115.865 -0.607 . . . . 0.0 111.488 -179.717 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 1.3 m -105.79 -10.0 16.94 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.782 179.951 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 125.53 39.03 0.45 Allowed Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.874 -0.679 . . . . 0.0 112.399 -179.964 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -82.68 170.31 49.96 Favored Glycine 0 N--CA 1.452 -0.294 0 C-N-CA 120.806 -0.711 . . . . 0.0 112.466 -179.998 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -143.5 153.93 43.12 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.817 0.342 . . . . 0.0 110.959 179.968 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 1.9 m -110.13 137.08 48.37 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.947 -179.991 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -136.96 152.13 49.81 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.88 179.996 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 62.9 m-85 -75.6 -14.32 60.37 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.226 -179.797 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 1.9 p -120.61 169.94 9.89 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.977 -179.893 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -51.63 145.55 8.97 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.105 179.948 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER -45.49 142.04 3.49 Favored Pre-proline 0 C--N 1.329 -0.305 0 CA-C-N 115.752 -0.658 . . . . 0.0 111.674 -179.621 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 55.4 Cg_endo -91.01 -75.39 0.0 OUTLIER 'Trans proline' 0 N--CA 1.456 -0.734 0 C-N-CA 123.115 2.543 . . . . 0.0 113.023 -179.686 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' ILE . . . . . 0.457 HG22 ' OG1' ' A' ' 21' ' ' THR . 2.4 tt -56.02 -176.47 0.02 OUTLIER 'Isoleucine or valine' 0 CA--C 1.535 0.382 0 CA-C-O 120.848 0.356 . . . . 0.0 111.903 -179.496 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 4.0 p90 -74.88 32.15 0.09 Allowed 'General case' 0 CA--C 1.532 0.259 0 N-CA-C 112.616 0.599 . . . . 0.0 112.616 -178.85 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' THR . . . . . 0.457 ' OG1' HG22 ' A' ' 19' ' ' ILE . 0.0 OUTLIER -78.86 -152.82 0.06 Allowed 'General case' 0 C--N 1.331 -0.227 0 C-N-CA 121.136 -0.226 . . . . 0.0 110.46 179.273 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . 0.444 ' H ' ' HB ' ' A' ' 21' ' ' THR . 17.0 tttp -165.17 94.07 0.63 Allowed 'General case' 0 C--N 1.333 -0.126 0 C-N-CA 120.711 -0.395 . . . . 0.0 111.661 -179.919 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' ILE . . . . . 0.531 ' HB ' ' CE ' ' A' ' 33' ' ' LYS . 0.2 OUTLIER -49.14 131.83 7.1 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.576 179.252 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' GLN . . . . . 0.445 ' NE2' ' NZ ' ' A' ' 36' ' ' LYS . 0.0 OUTLIER -120.54 0.77 10.55 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.467 -0.333 . . . . 0.0 111.715 -179.426 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 176.44 -145.67 7.59 Favored Glycine 0 N--CA 1.451 -0.343 0 C-N-CA 120.428 -0.891 . . . . 0.0 112.889 180.0 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . 0.517 ' HA ' ' HA ' ' A' ' 33' ' ' LYS . 1.2 p -127.01 149.45 49.89 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.06 0.457 . . . . 0.0 111.303 -179.749 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 8.5 t -89.64 -85.48 0.21 Allowed 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.672 -0.694 . . . . 0.0 111.146 -179.737 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 8.5 m-85 -61.37 -158.23 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.564 -179.641 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 81.8 mtt180 -48.56 -38.39 20.41 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-N 116.018 -0.537 . . . . 0.0 111.349 -179.73 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 157.54 17.5 0.04 OUTLIER Glycine 0 N--CA 1.452 -0.283 0 C-N-CA 120.725 -0.75 . . . . 0.0 112.674 179.919 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 3.0 mttt -95.62 -28.2 14.95 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.872 0.368 . . . . 0.0 110.814 179.874 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -118.13 149.66 40.67 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.121 -0.49 . . . . 0.0 111.044 -179.979 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . 0.531 ' CE ' ' HB ' ' A' ' 23' ' ' ILE . 0.0 OUTLIER -97.44 145.52 26.11 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.892 -0.594 . . . . 0.0 110.883 -179.992 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -97.65 119.88 37.02 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.944 179.9 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 35' ' ' CYS . . . . . 0.53 ' SG ' ' HE3' ' A' ' 33' ' ' LYS . 0.0 OUTLIER -114.55 160.94 18.69 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.728 -0.669 . . . . 0.0 111.261 -179.615 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . 0.464 ' NZ ' ' HA ' ' A' ' 35' ' ' CYS . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.051 0 CA-C-O 118.271 -0.871 . . . . 0.0 111.001 -179.996 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.231 0.114 0 CA-C-O 120.886 0.374 . . . . 0.0 110.568 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 3' ' ' TYR . . . . . 0.435 ' HB3' ' SG ' ' A' ' 34' ' ' CYS . 1.4 t80 -56.52 145.44 28.01 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.882 -179.794 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 4.1 m120 -66.11 84.36 0.09 Allowed 'General case' 0 N--CA 1.45 -0.457 0 CA-C-O 121.135 0.493 . . . . 0.0 110.905 -179.995 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -102.26 -69.21 0.79 Allowed 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.579 -0.737 . . . . 0.0 110.776 -179.838 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 10.3 p -53.73 -21.27 4.68 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 115.777 -0.647 . . . . 0.0 111.282 179.893 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 22.5 p -45.32 -37.58 4.97 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-N 115.928 -0.578 . . . . 0.0 111.255 -179.939 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 2.8 m -112.03 -20.55 11.92 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.9 -179.949 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 118.01 49.15 0.38 Allowed Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.838 -0.696 . . . . 0.0 112.512 179.998 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -101.99 -173.24 27.71 Favored Glycine 0 N--CA 1.451 -0.301 0 C-N-CA 120.679 -0.772 . . . . 0.0 112.497 -179.999 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -149.46 137.52 20.52 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.694 0.283 . . . . 0.0 110.567 179.885 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' CYS . . . . . 0.553 ' HA ' ' O ' ' A' ' 33' ' ' LYS . 0.0 OUTLIER -89.58 110.68 21.52 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.001 0.429 . . . . 0.0 111.533 -179.63 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 1.6 mp -105.11 122.12 45.22 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.789 -0.641 . . . . 0.0 110.1 179.249 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' TYR . . . . . 0.796 ' HA ' ' HA ' ' A' ' 32' ' ' ALA . 31.9 m-85 -49.68 -33.32 15.4 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.07 -179.443 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 34.2 t -99.01 166.91 11.05 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.387 179.338 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -52.94 141.06 22.99 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.449 -0.341 . . . . 0.0 110.718 179.851 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . 0.513 ' SG ' ' HB ' ' A' ' 23' ' ' ILE . 39.5 m -45.5 132.01 6.22 Favored Pre-proline 0 C--N 1.33 -0.26 0 CA-C-N 116.063 -0.517 . . . . 0.0 111.914 -179.416 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . 0.427 ' HG2' ' H ' ' A' ' 19' ' ' ILE . 68.6 Cg_endo -81.49 -70.04 0.01 OUTLIER 'Trans proline' 0 N--CA 1.459 -0.503 0 C-N-CA 122.691 2.261 . . . . 0.0 112.261 179.624 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' ILE . . . . . 0.457 HG13 ' H ' ' A' ' 20' ' ' PHE . 0.3 OUTLIER -56.59 -173.24 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.534 0.334 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.639 179.759 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' PHE . . . . . 0.457 ' H ' HG13 ' A' ' 19' ' ' ILE . 27.9 p90 -74.51 25.91 0.08 Allowed 'General case' 0 C--N 1.331 -0.213 0 N-CA-C 112.073 0.397 . . . . 0.0 112.073 -179.626 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' THR . . . . . 0.563 ' HB ' ' SG ' ' A' ' 35' ' ' CYS . 0.9 OUTLIER -76.74 -163.04 0.3 Allowed 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 120.518 0.199 . . . . 0.0 110.763 179.711 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . 0.432 ' H ' ' HB ' ' A' ' 21' ' ' THR . 8.9 tttt -163.6 108.23 1.04 Allowed 'General case' 0 C--O 1.231 0.132 0 CA-C-O 120.843 0.354 . . . . 0.0 110.844 -179.97 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' ILE . . . . . 0.889 HG13 ' HB3' ' A' ' 33' ' ' LYS . 0.0 OUTLIER -68.93 139.57 20.29 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 CA-C-O 121.076 0.465 . . . . 0.0 110.755 179.891 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' GLN . . . . . 0.867 ' HB2' ' HE3' ' A' ' 36' ' ' LYS . 0.4 OUTLIER -105.19 -44.95 4.63 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.727 -0.67 . . . . 0.0 110.568 179.23 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -151.88 -149.48 5.1 Favored Glycine 0 N--CA 1.452 -0.292 0 C-N-CA 120.989 -0.624 . . . . 0.0 112.251 179.917 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -110.54 148.34 32.33 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.053 0.454 . . . . 0.0 111.277 -179.931 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' CYS . . . . . 0.442 ' HB2' ' HB3' ' A' ' 12' ' ' CYS . 0.0 OUTLIER -83.44 -91.3 0.08 Allowed 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.741 -0.663 . . . . 0.0 111.133 -179.694 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' TYR . . . . . 0.432 ' H ' ' HB3' ' A' ' 27' ' ' CYS . 29.4 m-85 -61.49 -156.18 0.01 OUTLIER 'General case' 0 CA--C 1.531 0.229 0 CA-C-N 116.066 -0.516 . . . . 0.0 111.764 -179.701 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -49.17 -39.55 29.69 Favored 'General case' 0 C--O 1.232 0.139 0 CA-C-N 115.917 -0.583 . . . . 0.0 111.314 -179.83 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 155.65 48.15 0.01 OUTLIER Glycine 0 N--CA 1.452 -0.257 0 C-N-CA 120.744 -0.741 . . . . 0.0 112.549 -179.975 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 5.9 mptt -120.04 -44.21 2.51 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.86 0.362 . . . . 0.0 110.881 179.999 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . 0.796 ' HA ' ' HA ' ' A' ' 14' ' ' TYR . . . -105.98 146.66 29.76 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.987 179.977 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . 0.889 ' HB3' HG13 ' A' ' 23' ' ' ILE . 2.7 mtpp -95.77 120.66 36.42 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.079 -179.932 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 34' ' ' CYS . . . . . 0.604 ' SG ' ' HE2' ' A' ' 36' ' ' LYS . 0.1 OUTLIER -69.74 111.7 5.69 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.213 179.287 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 35' ' ' CYS . . . . . 0.563 ' SG ' ' HB ' ' A' ' 21' ' ' THR . 3.3 t -116.16 146.93 41.89 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.233 -179.427 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . 0.867 ' HE3' ' HB2' ' A' ' 24' ' ' GLN . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.043 0 CA-C-O 118.23 -0.89 . . . . 0.0 110.887 179.827 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.232 0.16 0 CA-C-O 120.894 0.378 . . . . 0.0 110.902 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 5.2 t80 -65.55 160.17 22.98 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.594 179.852 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -68.91 85.63 0.33 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.1 0.476 . . . . 0.0 110.822 179.883 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 5' ' ' CYS . . . . . 0.672 ' HA ' ' HG2' ' A' ' 36' ' ' LYS . 0.0 OUTLIER -109.53 -79.05 0.58 Allowed 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.641 -0.709 . . . . 0.0 110.556 179.941 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 11.9 p -54.26 -16.82 1.56 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.188 0 CA-C-N 115.959 -0.564 . . . . 0.0 111.15 179.62 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -45.08 -53.63 7.7 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.925 -0.58 . . . . 0.0 111.342 -179.859 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 5.5 p -106.32 -5.06 19.36 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.982 179.995 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 118.37 51.14 0.32 Allowed Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.786 -0.721 . . . . 0.0 112.501 -179.964 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -96.88 -178.26 34.91 Favored Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.735 -0.745 . . . . 0.0 112.476 -179.973 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 6.1 tt0 -146.51 131.75 18.45 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.815 0.341 . . . . 0.0 110.826 179.948 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' CYS . . . . . 0.476 ' HB3' ' HB2' ' A' ' 27' ' ' CYS . 0.0 OUTLIER -102.62 131.02 49.67 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.951 -179.893 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 3.0 mt -133.03 158.15 43.46 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.006 -179.949 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' TYR . . . . . 0.453 ' CD1' ' HB2' ' A' ' 32' ' ' ALA . 29.2 m-85 -82.41 -8.47 59.62 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.212 -179.848 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 98.7 p -117.65 169.08 9.86 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.386 -0.37 . . . . 0.0 111.085 -179.833 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -54.94 147.68 14.94 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.07 -0.513 . . . . 0.0 111.115 179.947 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . 0.452 ' HA ' ' HD3' ' A' ' 18' ' ' PRO . 0.1 OUTLIER -45.26 131.26 5.85 Favored Pre-proline 0 C--N 1.33 -0.265 0 CA-C-N 115.856 -0.611 . . . . 0.0 111.306 -179.855 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . 0.452 ' HD3' ' HA ' ' A' ' 17' ' ' CYS . 40.9 Cg_endo -90.8 -79.98 0.0 OUTLIER 'Trans proline' 0 N--CA 1.455 -0.767 0 C-N-CA 122.995 2.463 . . . . 0.0 112.64 -179.782 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' ILE . . . . . 0.567 HG12 ' H ' ' A' ' 20' ' ' PHE . 3.7 tt -56.6 -168.3 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.536 0.432 0 CA-C-N 116.376 -0.375 . . . . 0.0 111.758 -179.873 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' PHE . . . . . 0.567 ' H ' HG12 ' A' ' 19' ' ' ILE . 0.8 OUTLIER -75.69 33.97 0.12 Allowed 'General case' 0 CA--C 1.531 0.223 0 N-CA-C 112.083 0.401 . . . . 0.0 112.083 -179.492 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' THR . . . . . 0.448 HG22 ' OXT' ' A' ' 36' ' ' LYS . 0.1 OUTLIER -90.25 180.0 5.77 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.74 0.305 . . . . 0.0 110.695 179.263 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . 0.472 ' HE2' HE22 ' A' ' 24' ' ' GLN . 1.6 ptmm? -135.68 136.39 40.86 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.332 -0.394 . . . . 0.0 110.408 179.554 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' ILE . . . . . 0.968 HD13 ' HB2' ' A' ' 33' ' ' LYS . 0.1 OUTLIER -89.9 126.35 42.78 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.836 -179.715 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' GLN . . . . . 0.694 ' HB2' ' HE2' ' A' ' 36' ' ' LYS . 0.0 OUTLIER -104.08 -59.81 1.67 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.607 -0.724 . . . . 0.0 111.157 -179.703 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -141.45 -132.98 2.84 Favored Glycine 0 C--N 1.332 0.329 0 C-N-CA 120.673 -0.775 . . . . 0.0 112.904 -179.702 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 15.9 p -126.04 149.76 48.63 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.05 0.452 . . . . 0.0 111.234 -179.786 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' CYS . . . . . 0.476 ' HB2' ' HB3' ' A' ' 12' ' ' CYS . 0.7 OUTLIER -95.27 -78.06 0.46 Allowed 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.678 -0.692 . . . . 0.0 111.158 -179.738 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 17.6 m-85 -60.94 -164.65 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.504 -179.658 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 4.3 mtm180 -50.1 -36.97 31.76 Favored 'General case' 0 C--N 1.333 -0.143 0 CA-C-N 115.964 -0.562 . . . . 0.0 111.279 -179.936 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 153.74 43.61 0.02 OUTLIER Glycine 0 N--CA 1.452 -0.294 0 C-N-CA 120.751 -0.738 . . . . 0.0 112.556 179.949 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -122.54 -21.22 5.78 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.841 0.353 . . . . 0.0 110.947 179.967 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . 0.453 ' HB2' ' CD1' ' A' ' 14' ' ' TYR . . . -127.63 143.94 51.12 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.123 -0.49 . . . . 0.0 111.036 179.992 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . 0.968 ' HB2' HD13 ' A' ' 23' ' ' ILE . 0.0 OUTLIER -96.1 134.66 38.89 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.877 179.998 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 34' ' ' CYS . . . . . 0.455 ' HB2' ' SG ' ' A' ' 27' ' ' CYS . 0.0 OUTLIER -79.16 141.49 37.18 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.139 -179.739 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 35' ' ' CYS . . . . . 0.434 ' SG ' ' HE3' ' A' ' 33' ' ' LYS . 0.8 OUTLIER -134.79 129.95 35.37 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.905 179.946 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . 0.694 ' HE2' ' HB2' ' A' ' 24' ' ' GLN . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.079 0 CA-C-O 118.256 -0.878 . . . . 0.0 110.874 179.942 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 1.9 t-80 . . . . . 0 C--O 1.232 0.142 0 CA-C-O 120.845 0.355 . . . . 0.0 110.602 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 4.4 t80 -62.75 166.72 5.19 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.744 179.995 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 4' ' ' ASN . . . . . 0.431 ' ND2' ' HB2' ' A' ' 7' ' ' SER . 26.0 t-20 -81.89 78.49 8.6 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 121.409 0.623 . . . . 0.0 110.765 179.862 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 0.3 OUTLIER -106.23 -56.51 2.18 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.168 -0.924 . . . . 0.0 110.241 179.897 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 60.9 t -54.99 -12.89 0.74 Allowed 'Isoleucine or valine' 0 CA--C 1.53 0.208 0 CA-C-N 115.754 -0.657 . . . . 0.0 111.105 179.168 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . 0.431 ' HB2' ' ND2' ' A' ' 4' ' ' ASN . 6.2 t -34.38 -50.22 0.41 Allowed 'General case' 0 N--CA 1.464 0.266 0 CA-C-N 115.821 -0.627 . . . . 0.0 111.833 -179.831 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 28.2 t -107.75 -19.74 13.44 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.863 -179.96 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 136.39 34.85 0.22 Allowed Glycine 0 N--CA 1.45 -0.37 0 C-N-CA 120.828 -0.701 . . . . 0.0 112.321 -179.93 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -65.89 176.75 15.67 Favored Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.796 -0.716 . . . . 0.0 112.477 -179.995 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -144.84 142.51 29.99 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.84 0.352 . . . . 0.0 110.965 -179.967 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 3.2 m -106.18 125.24 50.76 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.079 -0.509 . . . . 0.0 110.704 179.876 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . 0.499 ' O ' ' HG3' ' A' ' 33' ' ' LYS . 3.6 mp -135.14 151.84 51.06 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.275 -0.421 . . . . 0.0 111.046 -179.842 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' TYR . . . . . 0.428 ' CD1' ' HB2' ' A' ' 32' ' ' ALA . 11.8 m-85 -77.74 -3.96 43.89 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.881 179.942 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 15.7 t -122.3 173.85 7.36 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.007 -179.997 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -54.78 144.18 23.18 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.279 -179.987 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . 0.509 ' SG ' ' HE3' ' A' ' 33' ' ' LYS . 71.7 m -45.78 139.45 5.07 Favored Pre-proline 0 C--N 1.331 -0.228 0 CA-C-N 115.824 -0.626 . . . . 0.0 111.551 -179.792 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . 0.45 ' HG2' ' H ' ' A' ' 19' ' ' ILE . 68.1 Cg_endo -76.43 -83.3 0.0 OUTLIER 'Trans proline' 0 C--N 1.347 0.452 0 C-N-CA 122.498 2.132 . . . . 0.0 112.289 179.853 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' ILE . . . . . 0.604 HG13 ' H ' ' A' ' 20' ' ' PHE . 0.8 OUTLIER -56.53 -171.18 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.535 0.391 0 CA-C-O 120.859 0.362 . . . . 0.0 111.619 179.884 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' PHE . . . . . 0.604 ' H ' HG13 ' A' ' 19' ' ' ILE . 3.8 p90 -69.96 15.48 0.08 Allowed 'General case' 0 CA--C 1.533 0.291 0 N-CA-C 111.982 0.364 . . . . 0.0 111.982 -179.664 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' THR . . . . . 0.632 ' HB ' ' SG ' ' A' ' 35' ' ' CYS . 0.6 OUTLIER -63.15 -172.71 0.05 OUTLIER 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 120.851 0.358 . . . . 0.0 111.268 179.809 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -151.54 118.07 5.7 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.066 179.945 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' ILE . . . . . 0.586 HD12 ' HD2' ' A' ' 33' ' ' LYS . 0.2 OUTLIER -64.76 120.67 12.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.735 179.99 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' GLN . . . . . 0.583 ' HB2' ' HZ2' ' A' ' 36' ' ' LYS . 0.0 OUTLIER -88.39 -28.84 20.69 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.552 179.922 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -177.47 -130.28 1.36 Allowed Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 121.026 -0.607 . . . . 0.0 112.219 179.998 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . 0.63 ' HA ' ' HA ' ' A' ' 33' ' ' LYS . 0.6 OUTLIER -116.79 145.74 43.32 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.9 0.381 . . . . 0.0 111.037 179.831 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 25.5 t -94.37 -78.47 0.44 Allowed 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.839 -179.87 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' TYR . . . . . 0.509 ' HB3' ' NZ ' ' A' ' 31' ' ' LYS . 22.7 m-85 -60.12 -176.92 0.05 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.842 -0.617 . . . . 0.0 111.039 -179.979 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . 0.416 HH11 ' HD3' ' A' ' 29' ' ' ARG . 7.0 mmt-85 -50.31 -24.41 2.93 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.218 -179.988 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 153.65 32.75 0.03 OUTLIER Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.885 -0.674 . . . . 0.0 112.342 179.873 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . 0.509 ' NZ ' ' HB3' ' A' ' 28' ' ' TYR . 2.0 mttp -111.17 -35.76 5.8 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.759 0.314 . . . . 0.0 110.927 -179.968 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . 0.428 ' HB2' ' CD1' ' A' ' 14' ' ' TYR . . . -128.86 153.79 47.11 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.299 -0.41 . . . . 0.0 110.995 -179.983 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . 0.63 ' HA ' ' HA ' ' A' ' 26' ' ' THR . 0.0 OUTLIER -92.81 144.94 24.79 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.938 -179.869 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -88.36 128.18 35.5 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.456 179.86 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 35' ' ' CYS . . . . . 0.632 ' SG ' ' HB ' ' A' ' 21' ' ' THR . 2.5 t -130.06 150.17 51.45 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.195 -179.54 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . 0.583 ' HZ2' ' HB2' ' A' ' 24' ' ' GLN . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.044 0 CA-C-O 118.284 -0.865 . . . . 0.0 110.959 179.999 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 6.8 t-80 . . . . . 0 C--O 1.232 0.146 0 CA-C-O 120.874 0.369 . . . . 0.0 110.71 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 7.8 t80 -60.57 164.48 4.5 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.714 179.78 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 1.1 t30 -71.18 85.32 0.75 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.075 0.464 . . . . 0.0 110.51 179.683 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 5' ' ' CYS . . . . . 0.586 ' HA ' ' HG2' ' A' ' 36' ' ' LYS . 0.1 OUTLIER -102.54 -72.43 0.69 Allowed 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.686 -0.688 . . . . 0.0 110.668 -179.865 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 13.9 p -53.9 -19.74 3.32 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-N 115.973 -0.558 . . . . 0.0 111.132 179.723 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 3.3 p -45.13 -44.28 10.48 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 115.938 -0.574 . . . . 0.0 111.402 -179.972 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 3.1 p -113.89 1.06 14.63 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.974 -179.948 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 103.94 44.6 1.61 Allowed Glycine 0 N--CA 1.451 -0.334 0 C-N-CA 120.736 -0.745 . . . . 0.0 112.181 -179.846 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -85.99 -176.18 49.99 Favored Glycine 0 N--CA 1.45 -0.394 0 C-N-CA 120.795 -0.717 . . . . 0.0 112.499 -179.881 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 5.0 mp0 -147.91 150.13 33.51 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.753 0.311 . . . . 0.0 110.797 179.985 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' CYS . . . . . 0.415 ' C ' HD22 ' A' ' 13' ' ' LEU . 0.1 OUTLIER -108.18 129.56 55.18 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.911 179.969 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . 0.57 ' HB2' ' NZ ' ' A' ' 33' ' ' LYS . 3.9 mm? -121.15 157.26 30.56 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.959 -179.847 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 60.0 m-85 -82.9 -18.91 38.51 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.78 179.852 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -126.88 -175.58 3.46 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.864 -179.946 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -51.06 140.16 16.4 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.064 -0.516 . . . . 0.0 111.14 179.915 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . 0.617 ' SG ' ' HE3' ' A' ' 33' ' ' LYS . 82.9 m -45.52 137.89 5.25 Favored Pre-proline 0 C--N 1.331 -0.21 0 CA-C-N 116.081 -0.509 . . . . 0.0 111.555 -179.782 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . 0.456 ' HD3' ' HA ' ' A' ' 17' ' ' CYS . 50.7 Cg_endo -89.75 -73.34 0.0 OUTLIER 'Trans proline' 0 N--CA 1.454 -0.796 0 C-N-CA 122.957 2.438 . . . . 0.0 112.231 179.802 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' ILE . . . . . 0.612 HG13 ' H ' ' A' ' 20' ' ' PHE . 0.7 OUTLIER -56.47 -173.45 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.534 0.338 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.456 179.738 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' PHE . . . . . 0.612 ' H ' HG13 ' A' ' 19' ' ' ILE . 2.1 p90 -78.1 40.03 0.32 Allowed 'General case' 0 C--N 1.332 -0.196 0 CA-C-N 116.563 -0.29 . . . . 0.0 111.594 -179.753 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' THR . . . . . 0.58 ' HB ' ' SG ' ' A' ' 35' ' ' CYS . 0.7 OUTLIER -89.48 -161.01 0.73 Allowed 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.567 -0.288 . . . . 0.0 110.631 179.448 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . 0.409 ' H ' ' HB ' ' A' ' 21' ' ' THR . 15.8 tttt -159.07 108.91 1.95 Allowed 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 120.721 0.296 . . . . 0.0 111.399 -179.953 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' ILE . . . . . 0.933 HD13 ' HB2' ' A' ' 33' ' ' LYS . 0.2 OUTLIER -60.39 126.61 18.51 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.226 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.735 179.592 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' GLN . . . . . 0.533 ' HB2' ' HE2' ' A' ' 36' ' ' LYS . 0.1 OUTLIER -111.66 -56.49 2.38 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.042 -0.527 . . . . 0.0 110.882 179.894 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -140.75 -160.96 8.5 Favored Glycine 0 N--CA 1.452 -0.29 0 C-N-CA 120.814 -0.708 . . . . 0.0 112.337 179.857 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -92.65 147.9 22.5 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.985 0.421 . . . . 0.0 111.231 179.917 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' CYS . . . . . 0.423 ' HB3' ' H ' ' A' ' 28' ' ' TYR . 0.1 OUTLIER -93.18 -92.71 0.16 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.951 -0.568 . . . . 0.0 111.002 -179.898 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' TYR . . . . . 0.423 ' H ' ' HB3' ' A' ' 27' ' ' CYS . 15.4 m-85 -61.24 -160.49 0.01 OUTLIER 'General case' 0 CA--C 1.53 0.209 0 CA-C-O 120.985 0.422 . . . . 0.0 111.46 -179.878 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 14.6 ttm-85 -50.08 -36.4 29.24 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 116.012 -0.54 . . . . 0.0 111.298 -179.905 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 154.44 34.08 0.03 OUTLIER Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.634 -0.793 . . . . 0.0 112.592 -179.974 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 31.8 mmtt -110.82 -20.58 12.42 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.924 0.392 . . . . 0.0 110.822 179.944 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -136.55 145.18 44.73 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.862 179.975 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . 0.933 ' HB2' HD13 ' A' ' 23' ' ' ILE . 0.1 OUTLIER -93.29 130.25 39.09 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.284 -0.416 . . . . 0.0 111.006 -179.799 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -69.27 127.67 33.89 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.547 179.679 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 35' ' ' CYS . . . . . 0.58 ' SG ' ' HB ' ' A' ' 21' ' ' THR . 6.8 t -131.44 132.78 44.58 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.169 -179.649 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . 0.586 ' HG2' ' HA ' ' A' ' 5' ' ' CYS . 0.0 OUTLIER . . . . . 0 C--O 1.25 1.083 0 CA-C-O 118.23 -0.891 . . . . 0.0 110.94 179.951 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 9.7 t-80 . . . . . 0 C--O 1.232 0.159 0 CA-C-O 120.873 0.368 . . . . 0.0 111.104 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 5.6 t80 -65.09 169.47 5.41 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.824 179.76 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 1.1 m120 -74.88 81.33 2.14 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 121.181 0.515 . . . . 0.0 110.532 179.71 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 1.2 m -111.64 -64.14 1.33 Allowed 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.482 -0.781 . . . . 0.0 111.086 -179.527 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 9.4 p -54.25 -15.0 0.98 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.215 0 CA-C-N 115.942 -0.572 . . . . 0.0 111.324 179.833 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -44.96 -53.31 7.81 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.914 -0.585 . . . . 0.0 111.592 -179.785 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -96.5 -22.26 17.21 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.395 -0.366 . . . . 0.0 111.072 -179.791 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 133.77 45.6 0.11 Allowed Glycine 0 N--CA 1.452 -0.275 0 C-N-CA 120.887 -0.673 . . . . 0.0 112.257 -179.957 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -99.71 174.27 26.66 Favored Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.784 -0.722 . . . . 0.0 112.731 -179.738 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 3.0 tp60 -149.29 154.43 39.01 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.778 0.323 . . . . 0.0 110.702 179.922 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' CYS . . . . . 0.453 ' HB3' ' HB2' ' A' ' 27' ' ' CYS . 0.0 OUTLIER -105.12 133.7 49.46 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.853 179.968 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . 0.496 HD13 ' HD3' ' A' ' 18' ' ' PRO . 3.4 mp -135.5 157.35 47.11 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.198 -0.456 . . . . 0.0 111.155 -179.672 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' TYR . . . . . 0.454 ' CD1' ' HB2' ' A' ' 32' ' ' ALA . 22.9 m-85 -74.6 -10.9 59.99 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.882 179.874 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -124.7 -179.7 4.62 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.687 179.992 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -54.75 144.36 22.52 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.165 179.88 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 8.1 m -45.63 142.99 3.21 Favored Pre-proline 0 C--N 1.331 -0.202 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.34 -179.876 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . 0.496 ' HD3' HD13 ' A' ' 13' ' ' LEU . 74.4 Cg_endo -79.05 -80.7 0.0 OUTLIER 'Trans proline' 0 C--N 1.345 0.386 0 C-N-CA 122.541 2.161 . . . . 0.0 112.384 179.997 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' ILE . . . . . 0.463 ' H ' ' HG2' ' A' ' 18' ' ' PRO . 0.9 OUTLIER -56.56 -170.34 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.535 0.402 0 CA-C-N 116.493 -0.321 . . . . 0.0 111.576 179.779 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' PHE . . . . . 0.454 ' N ' HG23 ' A' ' 19' ' ' ILE . 1.3 p90 -76.0 35.56 0.13 Allowed 'General case' 0 N--CA 1.463 0.183 0 CA-C-O 120.711 0.291 . . . . 0.0 111.417 179.987 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' THR . . . . . 0.407 ' H ' ' C ' ' A' ' 19' ' ' ILE . 0.7 OUTLIER -82.09 -165.96 1.13 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.512 -0.313 . . . . 0.0 110.87 179.77 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . 0.807 ' HG3' HE22 ' A' ' 24' ' ' GLN . 0.0 OUTLIER -151.23 130.33 12.65 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.895 0.379 . . . . 0.0 110.479 179.636 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' ILE . . . . . 0.701 HG13 ' HB2' ' A' ' 33' ' ' LYS . 0.0 OUTLIER -81.27 133.12 29.97 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-N 116.158 -0.474 . . . . 0.0 111.206 -179.514 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' GLN . . . . . 0.807 HE22 ' HG3' ' A' ' 22' ' ' LYS . 0.0 OUTLIER -107.75 -66.98 0.99 Allowed 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.581 -0.736 . . . . 0.0 111.088 -179.84 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -132.04 -130.04 3.09 Favored Glycine 0 N--CA 1.452 -0.289 0 C-N-CA 120.769 -0.729 . . . . 0.0 112.56 -179.927 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . 0.591 ' HA ' ' HA ' ' A' ' 33' ' ' LYS . 44.4 p -125.11 153.67 42.61 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.054 0.455 . . . . 0.0 111.502 -179.807 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' CYS . . . . . 0.453 ' HB2' ' HB3' ' A' ' 12' ' ' CYS . 0.1 OUTLIER -100.56 -84.52 0.43 Allowed 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.558 -0.747 . . . . 0.0 111.299 -179.684 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 22.6 m-85 -61.12 -160.52 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.726 -0.67 . . . . 0.0 111.861 -179.447 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 10.7 ttt85 -49.72 -34.55 19.17 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 115.786 -0.643 . . . . 0.0 111.096 -179.918 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 149.6 22.07 0.07 OUTLIER Glycine 0 N--CA 1.451 -0.357 0 C-N-CA 120.646 -0.787 . . . . 0.0 112.738 179.81 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -98.93 -10.89 22.18 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.755 0.312 . . . . 0.0 110.968 179.881 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . 0.454 ' HB2' ' CD1' ' A' ' 14' ' ' TYR . . . -144.51 146.83 32.61 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.288 -0.415 . . . . 0.0 111.156 179.987 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . 0.701 ' HB2' HG13 ' A' ' 23' ' ' ILE . 0.0 OUTLIER -99.86 141.52 32.57 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.789 179.914 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -74.72 144.04 43.87 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.028 -0.533 . . . . 0.0 111.718 -179.404 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 35' ' ' CYS . . . . . 0.493 ' SG ' ' HE2' ' A' ' 33' ' ' LYS . 84.7 m -134.98 143.89 47.09 Favored 'General case' 0 C--N 1.332 -0.154 0 CA-C-N 115.806 -0.634 . . . . 0.0 110.55 179.59 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . 0.69 ' HE2' HE21 ' A' ' 24' ' ' GLN . 0.0 OUTLIER . . . . . 0 C--O 1.248 1.017 0 CA-C-O 118.252 -0.88 . . . . 0.0 111.081 179.962 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 11.5 t-160 . . . . . 0 C--O 1.232 0.162 0 CA-C-O 120.772 0.32 . . . . 0.0 110.943 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 9.7 t80 -57.51 172.66 0.33 Allowed 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.047 179.946 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 5.1 m120 -77.3 76.91 3.84 Favored 'General case' 0 N--CA 1.448 -0.541 0 CA-C-O 121.248 0.547 . . . . 0.0 110.577 179.778 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -110.08 -64.69 1.23 Allowed 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.384 -0.825 . . . . 0.0 110.392 179.788 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -54.59 -16.84 1.73 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.177 0 CA-C-N 115.915 -0.584 . . . . 0.0 111.1 179.47 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 40.0 t -45.5 -40.46 8.5 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 115.846 -0.615 . . . . 0.0 111.212 -179.984 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -115.16 -0.77 13.17 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.777 179.957 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 113.07 34.7 1.77 Allowed Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 120.798 -0.715 . . . . 0.0 112.551 179.877 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -86.22 170.85 43.51 Favored Glycine 0 N--CA 1.451 -0.359 0 C-N-CA 120.809 -0.71 . . . . 0.0 112.559 -179.946 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -150.12 156.48 41.72 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.823 0.344 . . . . 0.0 110.854 179.977 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 0.2 OUTLIER -75.77 117.02 17.08 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.232 -179.88 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . 0.566 ' HG ' ' HD3' ' A' ' 18' ' ' PRO . 1.5 mm? -102.92 105.9 16.35 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.231 179.238 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 7.3 m-85 -50.82 -20.56 1.33 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.361 -179.714 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -125.55 176.11 7.08 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.805 179.827 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -52.52 146.29 10.13 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.108 -0.496 . . . . 0.0 111.047 179.912 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . 0.416 ' HA ' ' HD3' ' A' ' 18' ' ' PRO . 0.0 OUTLIER -45.2 122.07 5.02 Favored Pre-proline 0 C--N 1.33 -0.239 0 CA-C-N 115.939 -0.573 . . . . 0.0 111.255 -179.765 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . 0.566 ' HD3' ' HG ' ' A' ' 13' ' ' LEU . 58.2 Cg_endo -88.43 -72.5 0.0 OUTLIER 'Trans proline' 0 N--CA 1.456 -0.732 0 C-N-CA 122.788 2.326 . . . . 0.0 112.524 -179.829 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' ILE . . . . . 0.701 HG12 ' H ' ' A' ' 20' ' ' PHE . 9.0 tt -55.92 -176.01 0.02 OUTLIER 'Isoleucine or valine' 0 CA--C 1.533 0.306 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.457 179.967 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' PHE . . . . . 0.701 ' H ' HG12 ' A' ' 19' ' ' ILE . 0.6 OUTLIER -76.62 32.17 0.13 Allowed 'General case' 0 C--N 1.33 -0.249 0 N-CA-C 112.032 0.382 . . . . 0.0 112.032 -179.391 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' THR . . . . . 0.44 ' HB ' ' H ' ' A' ' 22' ' ' LYS . 0.9 OUTLIER -83.37 -154.3 0.15 Allowed 'General case' 0 C--N 1.332 -0.161 0 CA-C-O 120.575 0.226 . . . . 0.0 110.693 179.322 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . 0.44 ' H ' ' HB ' ' A' ' 21' ' ' THR . 0.1 OUTLIER -158.01 105.58 1.96 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.546 -0.297 . . . . 0.0 110.675 179.694 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' ILE . . . . . 0.564 ' HB ' ' SG ' ' A' ' 35' ' ' CYS . 0.0 OUTLIER -64.75 137.78 24.33 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.238 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.737 -179.999 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -112.77 -69.84 0.84 Allowed 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.72 179.822 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -127.68 -143.58 5.74 Favored Glycine 0 N--CA 1.45 -0.426 0 C-N-CA 120.92 -0.657 . . . . 0.0 112.487 179.986 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -115.77 143.65 45.09 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.042 0.449 . . . . 0.0 111.429 -179.845 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' CYS . . . . . 0.435 ' HB3' ' H ' ' A' ' 28' ' ' TYR . 2.1 t -81.89 -88.39 0.08 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.805 -0.634 . . . . 0.0 110.629 179.835 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' TYR . . . . . 0.435 ' H ' ' HB3' ' A' ' 27' ' ' CYS . 15.7 m-85 -62.12 -153.41 0.01 OUTLIER 'General case' 0 CA--C 1.532 0.262 0 CA-C-N 116.076 -0.511 . . . . 0.0 111.459 179.824 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -50.17 -35.86 27.95 Favored 'General case' 0 C--N 1.333 -0.119 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.577 -179.766 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 149.5 28.27 0.06 OUTLIER Glycine 0 N--CA 1.452 -0.295 0 C-N-CA 120.585 -0.817 . . . . 0.0 112.699 -179.943 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 1.6 mttp -102.12 -26.31 13.41 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.928 0.394 . . . . 0.0 110.607 179.871 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -122.75 139.74 53.65 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.922 179.943 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . 0.476 ' HE2' HG13 ' A' ' 23' ' ' ILE . 14.5 mtpt -92.59 120.86 33.44 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.363 -0.38 . . . . 0.0 110.743 179.918 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -64.13 111.71 2.68 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.01 -0.541 . . . . 0.0 111.033 -179.822 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 35' ' ' CYS . . . . . 0.564 ' SG ' ' HB ' ' A' ' 23' ' ' ILE . 1.8 m -106.69 138.44 42.86 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.821 -179.896 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.048 0 CA-C-O 118.213 -0.899 . . . . 0.0 111.055 179.72 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 C--O 1.232 0.158 0 CA-C-O 120.881 0.372 . . . . 0.0 110.794 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 2.4 t80 -64.93 156.44 31.11 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.591 179.894 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 6.4 p-10 -72.15 83.94 1.01 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 121.309 0.576 . . . . 0.0 111.324 -179.618 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 5' ' ' CYS . . . . . 0.416 ' HA ' ' HG2' ' A' ' 36' ' ' LYS . 0.0 OUTLIER -97.76 -65.21 0.98 Allowed 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.475 -0.784 . . . . 0.0 110.009 179.38 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 14.6 p -53.9 -18.4 2.23 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 115.141 -0.936 . . . . 0.0 111.389 179.676 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 6.8 t -42.19 -48.73 4.89 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 115.975 -0.557 . . . . 0.0 111.532 -179.632 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -111.84 -22.23 11.22 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.375 -0.375 . . . . 0.0 110.794 179.868 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 133.17 53.25 0.08 OUTLIER Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.934 -0.65 . . . . 0.0 112.258 -179.962 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -89.98 -178.54 44.7 Favored Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.823 -0.703 . . . . 0.0 112.69 -179.762 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -149.32 141.19 23.7 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.748 0.309 . . . . 0.0 110.649 -179.962 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -93.2 125.79 37.97 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.912 -179.936 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -123.51 155.18 38.04 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.771 179.867 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 85.8 m-85 -82.47 -31.38 29.41 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.978 -179.808 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -104.1 171.98 7.05 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.793 179.926 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -54.9 149.55 11.38 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.064 -0.517 . . . . 0.0 111.242 -179.931 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . 0.425 ' HA ' ' HD3' ' A' ' 18' ' ' PRO . 0.1 OUTLIER -45.43 123.53 5.68 Favored Pre-proline 0 C--N 1.33 -0.278 0 CA-C-N 115.692 -0.686 . . . . 0.0 111.051 179.932 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . 0.425 ' HD3' ' HA ' ' A' ' 17' ' ' CYS . 42.2 Cg_endo -90.63 -72.96 0.0 OUTLIER 'Trans proline' 0 N--CA 1.456 -0.723 0 C-N-CA 122.876 2.384 . . . . 0.0 112.864 -179.51 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' ILE . . . . . 0.659 HG13 ' H ' ' A' ' 20' ' ' PHE . 1.6 tp -56.13 -170.97 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.536 0.407 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.617 -179.728 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' PHE . . . . . 0.659 ' H ' HG13 ' A' ' 19' ' ' ILE . 4.5 p90 -71.03 23.12 0.04 OUTLIER 'General case' 0 CA--C 1.531 0.236 0 N-CA-C 112.227 0.455 . . . . 0.0 112.227 -179.347 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' THR . . . . . 0.451 ' H ' ' C ' ' A' ' 19' ' ' ILE . 0.8 OUTLIER -81.91 -165.73 1.06 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.537 0.208 . . . . 0.0 110.642 179.406 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . 0.405 ' H ' ' HB ' ' A' ' 21' ' ' THR . 40.0 tttp -161.97 117.31 1.97 Allowed 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 120.876 0.369 . . . . 0.0 111.13 179.928 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' ILE . . . . . 0.431 ' HB ' ' NZ ' ' A' ' 33' ' ' LYS . 0.8 OUTLIER -67.45 135.74 27.94 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.853 179.745 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' GLN . . . . . 0.58 ' HB2' ' NZ ' ' A' ' 36' ' ' LYS . 1.7 mp0 -114.7 -42.43 3.26 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.895 -0.593 . . . . 0.0 110.826 -179.924 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -154.54 -131.32 1.49 Allowed Glycine 0 N--CA 1.451 -0.363 0 C-N-CA 120.899 -0.667 . . . . 0.0 112.371 179.922 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . 0.601 ' HA ' ' HA ' ' A' ' 33' ' ' LYS . 15.6 p -122.49 141.15 51.95 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.841 0.353 . . . . 0.0 111.177 179.886 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' CYS . . . . . 0.466 ' HB3' ' H ' ' A' ' 28' ' ' TYR . 0.2 OUTLIER -82.99 -91.29 0.08 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.013 -0.54 . . . . 0.0 111.056 -179.842 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' TYR . . . . . 0.466 ' H ' ' HB3' ' A' ' 27' ' ' CYS . 23.7 m-85 -60.94 -168.02 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.166 0 CA-C-O 120.962 0.411 . . . . 0.0 111.206 -179.985 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 5.4 ttt-85 -50.39 -35.86 30.17 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 115.985 -0.552 . . . . 0.0 111.301 -179.938 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 159.66 44.39 0.02 OUTLIER Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.676 -0.773 . . . . 0.0 112.593 179.962 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 9.8 mtpt -119.73 -14.16 9.05 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.896 0.379 . . . . 0.0 110.651 179.798 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -154.35 147.27 24.48 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.668 179.858 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . 0.601 ' HA ' ' HA ' ' A' ' 26' ' ' THR . 0.0 OUTLIER -92.08 146.03 24.05 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.977 0.418 . . . . 0.0 110.937 -179.843 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 0.2 OUTLIER -77.63 135.2 38.09 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.895 -0.593 . . . . 0.0 111.091 -179.74 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 0.9 OUTLIER -136.57 128.97 30.16 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.972 179.88 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . 0.58 ' NZ ' ' HB2' ' A' ' 24' ' ' GLN . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.054 0 CA-C-O 118.245 -0.883 . . . . 0.0 110.748 179.802 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 7.2 t-80 . . . . . 0 C--O 1.231 0.117 0 CA-C-O 120.855 0.36 . . . . 0.0 110.709 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 2.4 t80 -63.81 167.29 6.18 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.619 179.834 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 1.4 t-20 -80.47 76.91 7.29 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.344 0.592 . . . . 0.0 110.265 179.567 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 5' ' ' CYS . . . . . 0.645 ' HA ' ' HD2' ' A' ' 36' ' ' LYS . 0.0 OUTLIER -101.3 -63.54 1.13 Allowed 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.085 -0.961 . . . . 0.0 110.643 -179.722 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 10.8 p -54.29 -16.91 1.6 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-N 115.827 -0.624 . . . . 0.0 111.134 179.586 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -38.03 -48.61 1.22 Allowed 'General case' 0 N--CA 1.462 0.174 0 CA-C-N 115.788 -0.642 . . . . 0.0 111.89 -179.725 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -109.28 -29.05 8.66 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.433 -0.349 . . . . 0.0 111.095 -179.916 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 142.69 45.52 0.05 OUTLIER Glycine 0 N--CA 1.452 -0.249 0 C-N-CA 120.804 -0.713 . . . . 0.0 112.428 -179.924 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -97.91 169.21 24.08 Favored Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.732 -0.747 . . . . 0.0 112.567 -179.882 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 12.7 mt-30 -143.11 148.86 37.3 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.75 0.31 . . . . 0.0 110.63 179.978 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' CYS . . . . . 0.494 ' HA ' ' O ' ' A' ' 33' ' ' LYS . 0.0 OUTLIER -103.0 125.11 49.62 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.297 -0.411 . . . . 0.0 111.222 -179.903 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -122.62 143.56 49.68 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.41 179.623 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 26.8 m-85 -60.31 -10.58 4.87 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.351 -0.386 . . . . 0.0 111.261 -179.755 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -114.07 155.69 25.5 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.788 179.613 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -54.95 157.82 3.06 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.284 179.823 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . 0.434 ' HB2' HG22 ' A' ' 23' ' ' ILE . 0.1 OUTLIER -44.91 112.08 1.42 Allowed Pre-proline 0 C--N 1.327 -0.39 0 CA-C-N 115.452 -0.794 . . . . 0.0 111.2 179.926 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 60.9 Cg_endo -87.78 -72.46 0.0 OUTLIER 'Trans proline' 0 N--CA 1.457 -0.619 0 C-N-CA 122.724 2.282 . . . . 0.0 112.664 -179.839 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' ILE . . . . . 0.587 HG12 ' H ' ' A' ' 20' ' ' PHE . 4.6 tt -56.37 -169.85 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.534 0.34 0 CA-C-N 116.321 -0.4 . . . . 0.0 111.588 -179.979 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' PHE . . . . . 0.587 ' H ' HG12 ' A' ' 19' ' ' ILE . 5.8 p90 -76.64 36.01 0.16 Allowed 'General case' 0 CA--C 1.53 0.179 0 N-CA-C 111.859 0.318 . . . . 0.0 111.859 -179.616 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' THR . . . . . 0.436 ' HB ' ' HB3' ' A' ' 35' ' ' CYS . 0.3 OUTLIER -88.08 -161.21 0.7 Allowed 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.662 0.268 . . . . 0.0 110.758 179.39 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . 0.422 ' H ' ' HB ' ' A' ' 21' ' ' THR . 1.4 tttm -157.58 103.1 1.91 Allowed 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.86 0.362 . . . . 0.0 111.028 -179.931 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' ILE . . . . . 0.524 HD13 ' HB3' ' A' ' 33' ' ' LYS . 1.4 tp -69.67 131.91 33.63 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.224 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.994 179.745 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' GLN . . . . . 0.502 ' HB2' ' HE3' ' A' ' 36' ' ' LYS . 18.6 mt-30 -114.29 -66.5 1.08 Allowed 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.125 179.346 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -125.52 167.07 17.99 Favored Glycine 0 N--CA 1.449 -0.478 0 CA-C-N 115.511 -0.768 . . . . 0.0 111.401 179.175 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 1.7 p -75.77 154.62 36.19 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 121.261 0.553 . . . . 0.0 111.16 -179.955 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' CYS . . . . . 0.493 ' HB3' ' H ' ' A' ' 28' ' ' TYR . 5.4 t -84.35 -96.15 0.06 Allowed 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.317 -0.856 . . . . 0.0 111.252 -179.55 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' TYR . . . . . 0.493 ' H ' ' HB3' ' A' ' 27' ' ' CYS . 61.7 m-85 -61.65 -144.06 0.0 OUTLIER 'General case' 0 CA--C 1.534 0.349 0 CA-C-N 115.982 -0.554 . . . . 0.0 111.628 -179.796 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . 0.403 ' HD2' HH11 ' A' ' 29' ' ' ARG . 7.6 mtt180 -48.16 -42.82 30.63 Favored 'General case' 0 C--O 1.232 0.133 0 CA-C-O 120.801 0.334 . . . . 0.0 111.402 -179.625 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 153.39 24.62 0.04 OUTLIER Glycine 0 N--CA 1.451 -0.363 0 C-N-CA 120.767 -0.73 . . . . 0.0 112.566 -179.94 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -99.86 -40.85 7.49 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.75 0.309 . . . . 0.0 110.932 179.953 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -97.76 139.26 33.89 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.887 179.937 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . 0.524 ' HB3' HD13 ' A' ' 23' ' ' ILE . 0.8 OUTLIER -91.63 126.53 36.74 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.914 0.388 . . . . 0.0 110.881 -179.937 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -83.08 104.39 13.24 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.911 -0.586 . . . . 0.0 111.045 179.869 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 35' ' ' CYS . . . . . 0.519 ' SG ' ' HB ' ' A' ' 23' ' ' ILE . 30.4 m -98.24 144.13 28.0 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.742 179.947 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . 0.645 ' HD2' ' HA ' ' A' ' 5' ' ' CYS . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.073 0 CA-C-O 118.198 -0.906 . . . . 0.0 110.872 179.753 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 6.0 t-80 . . . . . 0 C--O 1.231 0.121 0 CA-C-O 120.857 0.361 . . . . 0.0 110.673 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 5.7 t80 -57.5 158.8 5.47 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.744 179.962 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -70.24 82.41 0.53 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.215 0.531 . . . . 0.0 110.819 -179.916 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 5' ' ' CYS . . . . . 0.794 ' HA ' ' HG2' ' A' ' 36' ' ' LYS . 0.1 OUTLIER -100.8 -72.96 0.66 Allowed 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.475 -0.784 . . . . 0.0 110.29 179.596 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 6' ' ' VAL . . . . . 0.525 ' HA ' ' H ' ' A' ' 10' ' ' GLY . 9.9 p -54.0 -17.58 1.83 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 115.621 -0.718 . . . . 0.0 111.247 179.452 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -45.03 -48.65 11.67 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-N 115.834 -0.621 . . . . 0.0 111.443 -179.895 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 55.2 p -115.18 -4.35 12.46 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.94 179.991 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 123.46 53.43 0.2 Allowed Glycine 0 N--CA 1.452 -0.284 0 C-N-CA 120.725 -0.75 . . . . 0.0 112.494 179.886 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . 0.525 ' H ' ' HA ' ' A' ' 6' ' ' VAL . . . -97.09 171.16 26.75 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.804 -0.712 . . . . 0.0 112.467 -179.972 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 6.1 tp-100 -148.6 145.93 28.02 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.806 0.336 . . . . 0.0 110.911 -179.999 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 12' ' ' CYS . . . . . 0.458 ' HB3' ' HB2' ' A' ' 27' ' ' CYS . 0.1 OUTLIER -100.6 110.71 22.87 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.04 -179.893 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . 0.46 ' O ' ' HG3' ' A' ' 33' ' ' LYS . 11.0 mt -119.67 147.64 44.31 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.918 179.891 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 1.4 m-85 -88.86 16.29 7.12 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.957 179.934 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . 0.452 ' O ' ' HD3' ' A' ' 33' ' ' LYS . 8.5 p -139.79 158.4 44.15 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.89 179.908 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -48.79 140.66 8.3 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.381 -179.879 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . 0.43 ' HA ' ' HD3' ' A' ' 18' ' ' PRO . 0.2 OUTLIER -45.96 123.88 6.53 Favored Pre-proline 0 C--N 1.332 -0.176 0 CA-C-N 115.888 -0.596 . . . . 0.0 111.379 -179.875 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . 0.43 ' HD3' ' HA ' ' A' ' 17' ' ' CYS . 56.8 Cg_endo -89.38 -73.65 0.0 OUTLIER 'Trans proline' 0 N--CA 1.455 -0.747 0 C-N-CA 122.895 2.396 . . . . 0.0 112.69 -179.812 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 19' ' ' ILE . . . . . 0.667 HG12 ' H ' ' A' ' 20' ' ' PHE . 6.6 tt -56.47 -174.21 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.535 0.375 0 CA-C-N 116.492 -0.322 . . . . 0.0 111.567 -179.894 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 20' ' ' PHE . . . . . 0.667 ' H ' HG12 ' A' ' 19' ' ' ILE . 50.8 p90 -70.1 17.63 0.06 Allowed 'General case' 0 CA--C 1.531 0.224 0 N-CA-C 112.472 0.545 . . . . 0.0 112.472 -179.285 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 21' ' ' THR . . . . . 0.513 ' OG1' HG22 ' A' ' 19' ' ' ILE . 0.7 OUTLIER -74.91 -174.24 2.15 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.744 0.307 . . . . 0.0 110.683 179.417 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . 0.484 ' HG3' ' HZ1' ' A' ' 36' ' ' LYS . 10.0 ptmt -147.31 127.65 13.95 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.999 179.807 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 23' ' ' ILE . . . . . 0.707 ' HB ' ' HE3' ' A' ' 33' ' ' LYS . 0.2 OUTLIER -81.26 119.78 31.56 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.645 179.802 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 24' ' ' GLN . . . . . 0.704 ' HB2' ' HE2' ' A' ' 36' ' ' LYS . 0.9 OUTLIER -95.75 -46.72 6.47 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.763 -179.892 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -152.06 -127.13 1.28 Allowed Glycine 0 N--CA 1.45 -0.391 0 C-N-CA 120.9 -0.667 . . . . 0.0 112.226 179.838 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . 0.576 ' HA ' ' HA ' ' A' ' 33' ' ' LYS . 17.0 p -131.96 138.76 48.44 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.864 0.364 . . . . 0.0 111.16 179.844 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 27' ' ' CYS . . . . . 0.458 ' HB2' ' HB3' ' A' ' 12' ' ' CYS . 0.1 OUTLIER -71.85 -85.09 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.903 179.995 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 28' ' ' TYR . . . . . 0.414 ' H ' ' HB3' ' A' ' 27' ' ' CYS . 8.5 m-85 -60.84 -168.46 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.193 179.916 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 10.7 tpt180 -50.22 -31.9 15.14 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.049 -0.523 . . . . 0.0 111.148 179.934 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 157.38 36.9 0.02 OUTLIER Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 120.795 -0.717 . . . . 0.0 112.58 179.98 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 1.7 mtpp -113.2 -8.63 13.53 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.804 0.335 . . . . 0.0 110.776 179.886 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -150.86 151.39 32.16 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.288 179.989 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . 0.707 ' HE3' ' HB ' ' A' ' 23' ' ' ILE . 0.0 OUTLIER -97.97 139.59 33.58 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.753 -0.658 . . . . 0.0 110.739 179.827 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 34' ' ' CYS . . . . . 0.47 ' O ' ' HA ' ' A' ' 23' ' ' ILE . 0.0 OUTLIER -87.76 134.26 33.71 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.913 179.981 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 35' ' ' CYS . . . . . 0.581 ' SG ' ' HE3' ' A' ' 33' ' ' LYS . 1.0 OUTLIER -130.94 125.73 34.22 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.169 -179.971 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . 0.794 ' HG2' ' HA ' ' A' ' 5' ' ' CYS . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.047 0 CA-C-O 118.199 -0.905 . . . . 0.0 110.75 179.661 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 2' ' ' HIS . . . . . 0.504 ' HE1' HG12 ' A' ' 6' ' ' VAL . 11.7 t-80 . . . . . 0 C--O 1.232 0.143 0 CA-C-O 120.801 0.334 . . . . 0.0 111.109 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 10.4 t80 -62.87 160.89 13.74 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.742 179.642 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 6.7 t-20 -64.09 91.58 0.07 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.222 0.534 . . . . 0.0 110.213 179.623 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -119.51 -75.87 0.58 Allowed 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.485 -0.78 . . . . 0.0 109.71 179.928 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 6' ' ' VAL . . . . . 0.504 HG12 ' HE1' ' A' ' 2' ' ' HIS . 8.1 p -54.68 -13.72 0.84 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.191 0 CA-C-N 115.76 -0.655 . . . . 0.0 110.688 178.794 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 41.3 t -38.58 -50.89 1.62 Allowed 'General case' 0 N--CA 1.462 0.146 0 CA-C-N 115.76 -0.654 . . . . 0.0 111.288 179.926 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -110.75 -22.95 11.32 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.903 -0.589 . . . . 0.0 110.75 179.957 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 147.88 41.23 0.04 OUTLIER Glycine 0 N--CA 1.452 -0.273 0 C-N-CA 120.736 -0.745 . . . . 0.0 112.536 179.937 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . 0.483 ' H ' ' HA ' ' A' ' 6' ' ' VAL . . . -88.53 170.54 38.78 Favored Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.821 -0.704 . . . . 0.0 112.55 179.993 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -143.74 145.76 32.65 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.787 0.327 . . . . 0.0 110.887 -179.937 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 12' ' ' CYS . . . . . 0.445 ' C ' HD22 ' A' ' 13' ' ' LEU . 1.9 m -95.88 134.68 38.58 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.861 179.934 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . 0.445 HD22 ' C ' ' A' ' 12' ' ' CYS . 3.8 mm? -122.75 152.22 40.82 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.849 -179.874 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 90.5 m-85 -88.39 4.54 45.92 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.696 179.833 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . 0.468 ' O ' ' HD2' ' A' ' 33' ' ' LYS . 5.6 t -153.99 -176.22 5.75 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.858 179.954 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -49.8 137.49 16.24 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.048 -0.524 . . . . 0.0 111.38 -179.945 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . 0.406 ' HA ' ' HD3' ' A' ' 18' ' ' PRO . 0.1 OUTLIER -45.86 146.05 2.13 Favored Pre-proline 0 C--N 1.332 -0.183 0 CA-C-N 115.952 -0.567 . . . . 0.0 111.316 179.982 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . 0.406 ' HD3' ' HA ' ' A' ' 17' ' ' CYS . 53.0 Cg_endo -90.94 -80.37 0.0 OUTLIER 'Trans proline' 0 N--CA 1.454 -0.795 0 C-N-CA 122.969 2.446 . . . . 0.0 112.656 -179.754 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 19' ' ' ILE . . . . . 0.643 HG12 ' H ' ' A' ' 20' ' ' PHE . 6.1 tt -56.17 -172.38 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.534 0.346 0 CA-C-N 116.375 -0.375 . . . . 0.0 111.664 -179.866 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 20' ' ' PHE . . . . . 0.643 ' H ' HG12 ' A' ' 19' ' ' ILE . 0.2 OUTLIER -75.84 36.6 0.14 Allowed 'General case' 0 CA--C 1.531 0.236 0 N-CA-C 111.947 0.351 . . . . 0.0 111.947 -179.533 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 21' ' ' THR . . . . . 0.432 ' OG1' HG22 ' A' ' 19' ' ' ILE . 0.0 OUTLIER -85.81 -162.95 0.79 Allowed 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 120.526 0.203 . . . . 0.0 110.657 179.354 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . 0.588 ' HG3' HE22 ' A' ' 24' ' ' GLN . 2.1 pttt -155.66 122.22 5.25 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.937 0.399 . . . . 0.0 111.527 -179.907 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 23' ' ' ILE . . . . . 0.463 ' HB ' ' HE3' ' A' ' 33' ' ' LYS . 0.3 OUTLIER -75.66 125.72 35.6 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.47 179.434 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 24' ' ' GLN . . . . . 0.588 HE22 ' HG3' ' A' ' 22' ' ' LYS . 1.6 mp0 -103.48 -44.07 5.23 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.174 -0.467 . . . . 0.0 111.104 -179.739 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -146.89 -143.69 3.91 Favored Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.739 -0.743 . . . . 0.0 112.627 -179.92 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . 0.786 ' HA ' ' HA ' ' A' ' 33' ' ' LYS . 0.0 OUTLIER -120.14 140.41 51.13 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.851 0.357 . . . . 0.0 111.217 -179.908 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 41.6 t -85.97 -80.5 0.23 Allowed 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.89 179.913 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 2.9 m-85 -60.27 -173.72 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.813 -0.63 . . . . 0.0 110.943 179.932 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -50.57 -28.13 8.06 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.934 179.772 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 161.76 10.42 0.04 OUTLIER Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.886 -0.673 . . . . 0.0 112.536 179.954 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -96.74 -16.01 21.09 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.754 0.312 . . . . 0.0 111.161 -179.886 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . 0.405 ' O ' HG22 ' A' ' 26' ' ' THR . . . -134.93 150.45 50.4 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.828 179.912 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . 0.786 ' HA ' ' HA ' ' A' ' 26' ' ' THR . 0.0 OUTLIER -108.57 143.1 38.05 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.832 179.9 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -79.09 125.4 29.36 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.637 179.97 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -126.15 140.12 52.82 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.818 -179.896 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . 0.435 ' HE3' ' HB2' ' A' ' 24' ' ' GLN . 0.0 OUTLIER . . . . . 0 C--O 1.248 1.021 0 CA-C-O 118.22 -0.895 . . . . 0.0 110.895 179.798 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 2.0 t-80 . . . . . 0 C--O 1.232 0.149 0 CA-C-O 120.991 0.424 . . . . 0.0 110.844 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 9.1 t80 -61.38 167.5 3.24 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.688 179.737 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -77.65 77.27 4.17 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.235 0.541 . . . . 0.0 110.684 179.813 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 0.4 OUTLIER -103.89 -76.29 0.6 Allowed 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.298 -0.865 . . . . 0.0 110.494 179.943 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 6' ' ' VAL . . . . . 0.64 ' HA ' ' H ' ' A' ' 10' ' ' GLY . 7.5 p -54.13 -17.76 2.04 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.153 0 CA-C-N 116.019 -0.537 . . . . 0.0 111.126 179.579 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -45.34 -59.04 2.89 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 115.834 -0.621 . . . . 0.0 111.552 -179.912 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 52.4 p -98.81 -20.11 17.05 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.367 -0.379 . . . . 0.0 111.245 -179.643 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 144.49 53.81 0.03 OUTLIER Glycine 0 N--CA 1.452 -0.267 0 C-N-CA 120.688 -0.768 . . . . 0.0 112.605 -179.963 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . 0.64 ' H ' ' HA ' ' A' ' 6' ' ' VAL . . . -105.02 159.79 15.53 Favored Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.78 -0.724 . . . . 0.0 112.465 179.924 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 1.2 mt-30 -125.25 153.21 43.54 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.761 0.315 . . . . 0.0 110.909 -179.926 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 12' ' ' CYS . . . . . 0.449 ' C ' HD22 ' A' ' 13' ' ' LEU . 3.1 m -118.59 119.7 35.28 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.086 -179.773 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . 0.449 HD22 ' C ' ' A' ' 12' ' ' CYS . 3.2 mm? -124.82 159.1 31.81 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.722 179.928 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 34.2 m-85 -88.56 -5.52 58.14 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.341 -0.39 . . . . 0.0 111.165 -179.921 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . 0.441 ' O ' ' HD3' ' A' ' 33' ' ' LYS . 2.4 t -128.4 -179.3 4.95 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.372 -0.377 . . . . 0.0 110.917 -179.877 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -48.84 141.64 7.25 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.087 179.966 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . 0.419 ' HA ' ' HD3' ' A' ' 18' ' ' PRO . 0.9 OUTLIER -45.63 141.63 3.85 Favored Pre-proline 0 C--N 1.329 -0.318 0 CA-C-N 115.907 -0.588 . . . . 0.0 111.455 -179.756 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . 0.419 ' HD3' ' HA ' ' A' ' 17' ' ' CYS . 38.9 Cg_endo -89.84 -81.59 0.0 OUTLIER 'Trans proline' 0 N--CA 1.453 -0.885 0 C-N-CA 122.91 2.407 . . . . 0.0 112.357 179.94 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 19' ' ' ILE . . . . . 0.71 HG13 ' H ' ' A' ' 20' ' ' PHE . 4.3 tp -56.57 -173.95 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.535 0.393 0 CA-C-N 116.406 -0.361 . . . . 0.0 111.638 179.976 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 20' ' ' PHE . . . . . 0.71 ' H ' HG13 ' A' ' 19' ' ' ILE . 7.5 p90 -71.62 21.36 0.05 Allowed 'General case' 0 CA--C 1.535 0.371 0 N-CA-C 112.939 0.718 . . . . 0.0 112.939 -178.876 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 21' ' ' THR . . . . . 0.492 ' OG1' HG22 ' A' ' 19' ' ' ILE . 0.2 OUTLIER -75.71 -172.21 1.81 Allowed 'General case' 0 N--CA 1.463 0.187 0 C-N-CA 121.051 -0.259 . . . . 0.0 110.86 179.288 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 6.4 tttp -145.94 111.59 5.53 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 120.789 0.328 . . . . 0.0 111.093 -179.749 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 23' ' ' ILE . . . . . 0.487 ' HB ' ' HE3' ' A' ' 33' ' ' LYS . 0.2 OUTLIER -58.72 123.97 11.91 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.189 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.009 -179.96 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -99.36 -25.6 14.42 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.84 179.923 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -178.74 -116.87 0.52 Allowed Glycine 0 N--CA 1.451 -0.358 0 C-N-CA 120.828 -0.701 . . . . 0.0 112.391 179.957 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . 0.707 ' HA ' ' HA ' ' A' ' 33' ' ' LYS . 1.0 OUTLIER -133.78 143.57 48.49 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.983 0.42 . . . . 0.0 111.352 -179.961 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 10.4 t -81.9 -79.3 0.18 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.903 -0.59 . . . . 0.0 110.968 179.973 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 11.3 m-85 -61.28 -160.5 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.002 -0.545 . . . . 0.0 111.427 -179.928 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 12.0 mtm180 -50.13 -39.2 42.37 Favored 'General case' 0 C--N 1.332 -0.156 0 CA-C-N 115.997 -0.547 . . . . 0.0 111.18 -179.944 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 159.26 33.16 0.02 OUTLIER Glycine 0 N--CA 1.451 -0.328 0 C-N-CA 120.811 -0.709 . . . . 0.0 112.486 179.937 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 2.0 mmpt? -107.77 -32.08 7.78 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.894 0.378 . . . . 0.0 110.788 -179.971 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -121.3 150.67 41.07 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.013 -0.54 . . . . 0.0 110.875 179.932 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . 0.707 ' HA ' ' HA ' ' A' ' 26' ' ' THR . 0.0 OUTLIER -90.32 145.39 25.01 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.985 -179.872 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 34' ' ' CYS . . . . . 0.416 ' O ' ' HA ' ' A' ' 23' ' ' ILE . 0.0 OUTLIER -95.03 135.7 36.24 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.976 179.948 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 35' ' ' CYS . . . . . 0.579 ' SG ' ' HE3' ' A' ' 33' ' ' LYS . 1.1 m -129.26 140.27 51.51 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.046 -0.525 . . . . 0.0 110.57 179.93 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . 0.607 ' HE3' ' H ' ' A' ' 36' ' ' LYS . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.07 0 CA-C-O 118.179 -0.915 . . . . 0.0 111.063 179.844 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 2.0 t-80 . . . . . 0 C--O 1.231 0.125 0 CA-C-O 120.872 0.368 . . . . 0.0 110.674 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 6.5 t80 -63.89 160.51 17.44 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.752 179.897 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -71.83 82.77 0.9 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.184 0.516 . . . . 0.0 110.546 179.727 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -99.66 -67.43 0.85 Allowed 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.469 -0.787 . . . . 0.0 110.498 179.948 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 4.2 p -54.78 -15.5 1.31 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.516 179.645 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -42.63 -52.98 4.65 Favored 'General case' 0 N--CA 1.464 0.252 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.518 -179.646 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 10.7 p -101.73 -1.21 33.0 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.903 -179.904 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 112.89 30.36 2.8 Favored Glycine 0 N--CA 1.451 -0.328 0 C-N-CA 120.7 -0.762 . . . . 0.0 112.168 -179.868 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -84.49 165.01 40.31 Favored Glycine 0 N--CA 1.45 -0.388 0 C-N-CA 120.849 -0.691 . . . . 0.0 112.711 -179.869 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -146.38 142.6 28.37 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.643 0.259 . . . . 0.0 110.674 179.94 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 12' ' ' CYS . . . . . 0.459 ' HA ' ' O ' ' A' ' 33' ' ' LYS . 0.0 OUTLIER -97.1 122.54 40.21 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.887 0.375 . . . . 0.0 111.173 -179.868 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -117.02 147.36 42.4 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.729 179.785 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -51.0 -33.96 27.17 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.059 -0.519 . . . . 0.0 111.4 -179.609 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -108.65 163.26 13.41 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.793 179.957 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -52.86 155.2 2.46 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.543 179.473 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . 0.518 ' SG ' ' HB ' ' A' ' 23' ' ' ILE . 3.1 m -44.93 138.66 4.11 Favored Pre-proline 0 C--N 1.327 -0.41 0 CA-C-N 115.901 -0.591 . . . . 0.0 111.342 -179.573 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . 0.433 ' HD3' ' HA ' ' A' ' 17' ' ' CYS . 50.2 Cg_endo -88.28 -71.87 0.01 OUTLIER 'Trans proline' 0 N--CA 1.454 -0.837 0 C-N-CA 122.996 2.464 . . . . 0.0 111.801 179.62 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 19' ' ' ILE . . . . . 0.458 ' C ' ' H ' ' A' ' 21' ' ' THR . 1.5 tt -56.97 -168.76 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.535 0.396 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.036 179.177 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 20' ' ' PHE . . . . . 0.45 ' N ' HG23 ' A' ' 19' ' ' ILE . 2.1 p90 -73.43 23.43 0.07 Allowed 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.583 0.23 . . . . 0.0 111.538 179.917 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 21' ' ' THR . . . . . 0.458 ' H ' ' C ' ' A' ' 19' ' ' ILE . 0.2 OUTLIER -65.23 -169.45 0.05 OUTLIER 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 120.766 0.317 . . . . 0.0 111.116 179.844 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -156.15 111.0 2.88 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.701 179.996 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 23' ' ' ILE . . . . . 0.769 HG13 ' HB3' ' A' ' 33' ' ' LYS . 0.0 OUTLIER -75.9 132.66 32.73 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-O 121.044 0.45 . . . . 0.0 111.202 -179.779 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 24' ' ' GLN . . . . . 0.464 ' NE2' ' HE2' ' A' ' 36' ' ' LYS . 0.3 OUTLIER -92.98 -43.57 8.86 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.719 -0.673 . . . . 0.0 110.37 179.42 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -159.47 -138.76 2.53 Favored Glycine 0 N--CA 1.45 -0.399 0 CA-C-N 115.613 -0.721 . . . . 0.0 112.05 179.942 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . 0.411 HG22 ' HE3' ' A' ' 33' ' ' LYS . 4.1 p -120.71 145.34 47.58 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 120.89 0.376 . . . . 0.0 111.028 179.775 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -80.89 -88.4 0.08 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.971 -179.929 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 8.0 m-85 -61.23 -161.69 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.231 179.908 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -50.29 -34.38 23.24 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.972 179.956 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 151.93 48.6 0.02 OUTLIER Glycine 0 N--CA 1.452 -0.27 0 C-N-CA 120.801 -0.714 . . . . 0.0 112.466 179.878 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -116.43 -35.05 4.39 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.769 0.318 . . . . 0.0 110.917 179.968 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -123.79 140.59 52.83 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.221 -179.973 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . 0.769 ' HB3' HG13 ' A' ' 23' ' ' ILE . 1.0 OUTLIER -85.74 130.68 34.5 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.879 -179.953 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -80.82 112.23 18.01 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.534 179.703 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 35' ' ' CYS . . . . . 0.527 ' SG ' ' HB ' ' A' ' 23' ' ' ILE . 68.8 m -113.46 151.37 31.52 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.949 -0.568 . . . . 0.0 110.522 179.982 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . 0.464 ' HE2' ' NE2' ' A' ' 24' ' ' GLN . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.027 0 CA-C-O 118.232 -0.89 . . . . 0.0 110.93 179.704 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 2' ' ' HIS . . . . . 0.444 ' CE1' HG12 ' A' ' 6' ' ' VAL . 4.1 t-80 . . . . . 0 C--O 1.232 0.152 0 CA-C-O 120.841 0.353 . . . . 0.0 110.841 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 3.4 t80 -58.93 150.77 23.45 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.402 179.623 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 4' ' ' ASN . . . . . 0.507 ' OD1' ' HB2' ' A' ' 7' ' ' SER . 4.4 t30 -64.5 86.41 0.05 OUTLIER 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.274 0.559 . . . . 0.0 110.562 179.947 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 5' ' ' CYS . . . . . 0.436 ' HA ' ' HG2' ' A' ' 36' ' ' LYS . 0.1 OUTLIER -116.82 -74.54 0.6 Allowed 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.449 -0.796 . . . . 0.0 110.103 -179.991 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 6' ' ' VAL . . . . . 0.449 ' HA ' ' H ' ' A' ' 10' ' ' GLY . 5.5 p -55.65 -8.17 0.4 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.192 0 CA-C-N 115.946 -0.57 . . . . 0.0 111.21 178.95 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . 0.507 ' HB2' ' OD1' ' A' ' 4' ' ' ASN . 2.3 t -31.61 -54.02 0.26 Allowed 'General case' 0 N--CA 1.464 0.227 0 CA-C-N 115.755 -0.657 . . . . 0.0 111.553 -179.702 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -115.34 -40.19 3.47 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.695 -0.684 . . . . 0.0 110.754 179.826 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 178.38 41.48 0.07 OUTLIER Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 120.965 -0.636 . . . . 0.0 112.236 -179.975 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . 0.449 ' H ' ' HA ' ' A' ' 6' ' ' VAL . . . -94.3 162.77 24.9 Favored Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 120.818 -0.706 . . . . 0.0 112.682 -179.798 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 2.1 pt20 -150.25 150.61 31.77 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.736 0.303 . . . . 0.0 110.675 179.988 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 12' ' ' CYS . . . . . 0.51 ' HB3' ' HB2' ' A' ' 27' ' ' CYS . 0.0 OUTLIER -98.45 114.69 27.15 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.948 0.404 . . . . 0.0 111.384 -179.893 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . 0.422 HD22 ' HG3' ' A' ' 18' ' ' PRO . 0.2 OUTLIER -99.69 133.99 43.23 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.211 179.429 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER -53.27 -21.92 6.18 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.398 -0.365 . . . . 0.0 111.184 -179.792 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -114.32 159.24 20.44 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.585 179.618 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -53.22 155.87 2.51 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.332 -0.395 . . . . 0.0 111.131 179.891 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -39.6 112.52 0.78 Allowed Pre-proline 0 C--N 1.328 -0.331 0 CA-C-N 115.427 -0.806 . . . . 0.0 111.749 -179.563 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . 0.422 ' HG3' HD22 ' A' ' 13' ' ' LEU . 60.5 Cg_endo -83.56 -72.6 0.01 OUTLIER 'Trans proline' 0 N--CA 1.459 -0.519 0 C-N-CA 122.689 2.26 . . . . 0.0 112.281 179.784 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 19' ' ' ILE . . . . . 0.439 ' C ' ' H ' ' A' ' 21' ' ' THR . 1.2 tt -56.46 -172.8 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.534 0.334 0 CA-C-N 116.408 -0.36 . . . . 0.0 111.375 179.741 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 20' ' ' PHE . . . . . 0.431 ' N ' HG23 ' A' ' 19' ' ' ILE . 38.0 p90 -72.92 24.56 0.06 Allowed 'General case' 0 CA--C 1.53 0.205 0 N-CA-C 111.983 0.364 . . . . 0.0 111.983 -179.66 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 21' ' ' THR . . . . . 0.439 ' H ' ' C ' ' A' ' 19' ' ' ILE . 0.8 OUTLIER -76.88 -162.99 0.31 Allowed 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.626 0.25 . . . . 0.0 110.669 179.527 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . 0.402 ' H ' ' HB ' ' A' ' 21' ' ' THR . 8.1 pttp -155.14 111.82 3.24 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.92 0.391 . . . . 0.0 111.0 179.813 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 23' ' ' ILE . . . . . 0.963 HG13 ' HB3' ' A' ' 33' ' ' LYS . 0.0 OUTLIER -74.53 131.41 35.02 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.869 -179.979 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 24' ' ' GLN . . . . . 0.491 ' HB2' ' HZ2' ' A' ' 36' ' ' LYS . 2.2 mp0 -100.56 -39.38 7.94 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.053 -0.522 . . . . 0.0 110.72 179.68 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -157.15 -151.17 5.92 Favored Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.823 -0.703 . . . . 0.0 112.381 -179.986 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . 0.871 HG23 ' HE3' ' A' ' 33' ' ' LYS . 0.0 OUTLIER -115.24 149.48 37.68 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.012 0.434 . . . . 0.0 111.208 -179.931 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 27' ' ' CYS . . . . . 0.51 ' HB2' ' HB3' ' A' ' 12' ' ' CYS . 0.0 OUTLIER -91.4 -87.59 0.2 Allowed 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.764 -0.653 . . . . 0.0 111.199 -179.891 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 28' ' ' TYR . . . . . 0.41 ' H ' ' HB3' ' A' ' 27' ' ' CYS . 5.0 m-85 -61.08 -164.01 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.496 -179.743 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -50.24 -33.03 18.22 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.952 -0.567 . . . . 0.0 111.199 -179.907 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 151.35 41.12 0.03 OUTLIER Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 120.673 -0.775 . . . . 0.0 112.742 179.851 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 23.5 mtpt -115.57 -24.39 8.33 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.748 0.309 . . . . 0.0 110.975 179.882 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -129.96 141.82 50.72 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.13 179.97 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . 0.963 ' HB3' HG13 ' A' ' 23' ' ' ILE . 1.5 mmpt? -93.99 133.66 37.2 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.05 -179.982 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -77.31 117.56 18.93 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.382 179.574 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 35' ' ' CYS . . . . . 0.563 ' SG ' ' HB ' ' A' ' 23' ' ' ILE . 20.1 m -118.35 146.13 44.61 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.026 -179.579 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . 0.491 ' HZ2' ' HB2' ' A' ' 24' ' ' GLN . 5.2 mtmm . . . . . 0 C--O 1.249 1.037 0 CA-C-O 118.29 -0.862 . . . . 0.0 110.851 179.624 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 8.7 t-80 . . . . . 0 C--O 1.232 0.166 0 CA-C-O 121.009 0.433 . . . . 0.0 111.037 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 10.8 t80 -67.2 174.64 3.07 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.717 179.669 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 4' ' ' ASN . . . . . 0.519 ' O ' ' ND2' ' A' ' 4' ' ' ASN . 0.8 OUTLIER -77.1 89.14 3.6 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 121.635 0.731 . . . . 0.0 110.117 179.508 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -118.06 -78.54 0.58 Allowed 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.313 -0.858 . . . . 0.0 109.345 179.954 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 6' ' ' VAL . . . . . 0.793 ' HA ' ' H ' ' A' ' 10' ' ' GLY . 10.4 p -54.47 -20.27 4.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 115.672 -0.695 . . . . 0.0 110.112 178.248 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 10.4 t -44.86 -43.19 8.59 Favored 'General case' 0 C--O 1.232 0.171 0 CA-C-N 115.29 -0.868 . . . . 0.0 111.406 179.989 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 23.0 p -97.53 -36.37 10.33 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.076 -179.793 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 153.85 50.29 0.01 OUTLIER Glycine 0 N--CA 1.453 -0.218 0 C-N-CA 120.686 -0.768 . . . . 0.0 112.531 -179.937 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . 0.793 ' H ' ' HA ' ' A' ' 6' ' ' VAL . . . -120.9 -177.14 15.63 Favored Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.768 -0.73 . . . . 0.0 112.578 -179.973 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 32.9 mt-30 -147.1 150.83 35.78 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 120.851 0.358 . . . . 0.0 111.138 -179.946 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 3.2 m -96.79 122.67 40.01 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.389 179.483 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 3.3 mt -132.75 159.01 40.94 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.377 -0.374 . . . . 0.0 111.07 -179.681 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 28.2 m-85 -88.34 -9.93 51.12 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.924 -179.923 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 1.6 m -113.56 167.12 10.86 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.134 -179.862 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -52.98 147.3 9.5 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.04 -0.527 . . . . 0.0 111.318 -179.942 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -45.6 120.7 5.07 Favored Pre-proline 0 C--N 1.328 -0.351 0 CA-C-N 115.666 -0.697 . . . . 0.0 111.469 -179.89 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 58.9 Cg_endo -84.01 -75.42 0.0 OUTLIER 'Trans proline' 0 N--CA 1.458 -0.579 0 C-N-CA 122.599 2.2 . . . . 0.0 112.455 179.876 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 19' ' ' ILE . . . . . 0.476 HG22 ' OG1' ' A' ' 21' ' ' THR . 0.3 OUTLIER -56.36 -172.48 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.534 0.34 0 CA-C-N 116.493 -0.322 . . . . 0.0 111.478 179.956 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 20' ' ' PHE . . . . . 0.426 ' N ' HG23 ' A' ' 19' ' ' ILE . 3.0 p90 -75.34 33.5 0.11 Allowed 'General case' 0 CA--C 1.531 0.227 0 N-CA-C 112.113 0.412 . . . . 0.0 112.113 -179.398 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 21' ' ' THR . . . . . 0.476 ' OG1' HG22 ' A' ' 19' ' ' ILE . 0.6 OUTLIER -90.52 -168.95 2.24 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.761 0.315 . . . . 0.0 110.64 179.306 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . 0.539 ' HG3' HE22 ' A' ' 24' ' ' GLN . 11.6 ptpt -151.95 129.86 11.73 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.264 -0.426 . . . . 0.0 110.819 179.649 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 23' ' ' ILE . . . . . 0.699 ' HB ' ' HE3' ' A' ' 33' ' ' LYS . 0.2 OUTLIER -80.76 127.45 39.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.846 -179.811 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 24' ' ' GLN . . . . . 0.539 HE22 ' HG3' ' A' ' 22' ' ' LYS . 0.0 OUTLIER -105.68 -35.89 7.25 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.813 -0.63 . . . . 0.0 110.894 -179.734 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -161.21 -128.05 0.92 Allowed Glycine 0 N--CA 1.451 -0.362 0 C-N-CA 120.788 -0.72 . . . . 0.0 112.503 179.974 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . 0.472 ' HA ' ' HA ' ' A' ' 33' ' ' LYS . 40.9 p -127.72 150.37 49.81 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.992 0.425 . . . . 0.0 111.145 -179.947 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 15.0 t -93.75 -83.59 0.32 Allowed 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.776 -0.647 . . . . 0.0 111.186 -179.671 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 43.2 m-85 -60.85 -169.45 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.59 -179.658 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 12.9 mtp180 -45.92 -44.03 14.34 Favored 'General case' 0 N--CA 1.462 0.135 0 CA-C-N 115.876 -0.602 . . . . 0.0 111.377 -179.866 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 163.1 48.37 0.02 OUTLIER Glycine 0 N--CA 1.452 -0.285 0 C-N-CA 120.635 -0.793 . . . . 0.0 112.649 179.983 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 30.5 mttt -128.97 -18.62 3.73 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.844 0.354 . . . . 0.0 111.009 179.976 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -136.0 147.58 48.04 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.056 179.917 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . 0.699 ' HE3' ' HB ' ' A' ' 23' ' ' ILE . 0.0 OUTLIER -91.58 148.09 22.53 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.815 -179.979 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -94.45 126.27 39.62 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.905 -0.589 . . . . 0.0 111.272 -179.798 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 35' ' ' CYS . . . . . 0.53 ' SG ' ' HE3' ' A' ' 33' ' ' LYS . 0.8 OUTLIER -122.51 143.63 49.59 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.411 179.506 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . 0.536 ' HE2' ' HB2' ' A' ' 24' ' ' GLN . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.058 0 CA-C-O 118.236 -0.888 . . . . 0.0 111.087 -179.894 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 8.6 t-80 . . . . . 0 C--O 1.231 0.095 0 CA-C-O 120.845 0.355 . . . . 0.0 110.889 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 3' ' ' TYR . . . . . 0.418 ' HB3' ' SG ' ' A' ' 5' ' ' CYS . 2.2 t80 -62.16 163.56 7.99 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.275 179.703 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 19.2 t-20 -79.21 74.36 5.78 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 121.491 0.662 . . . . 0.0 110.525 179.807 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 5' ' ' CYS . . . . . 0.78 ' HA ' ' HG2' ' A' ' 36' ' ' LYS . 0.0 OUTLIER -104.49 -55.83 2.29 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 114.984 -1.007 . . . . 0.0 109.934 179.696 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 6' ' ' VAL . . . . . 0.53 ' HA ' ' N ' ' A' ' 10' ' ' GLY . 1.6 p -55.68 -8.08 0.39 Allowed 'Isoleucine or valine' 0 CA--C 1.53 0.182 0 CA-C-N 115.713 -0.676 . . . . 0.0 111.404 179.048 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . 0.422 ' H ' ' C ' ' A' ' 5' ' ' CYS . 4.2 t -35.58 -52.95 0.68 Allowed 'General case' 0 N--CA 1.464 0.24 0 CA-C-N 115.877 -0.602 . . . . 0.0 111.72 -179.472 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 8.6 p -115.04 -10.98 12.17 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.861 -179.942 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 145.16 31.44 0.08 OUTLIER Glycine 0 N--CA 1.45 -0.39 0 C-N-CA 120.854 -0.688 . . . . 0.0 112.304 -179.84 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . 0.53 ' N ' ' HA ' ' A' ' 6' ' ' VAL . . . -62.27 175.38 7.0 Favored Glycine 0 N--CA 1.45 -0.429 0 C-N-CA 120.905 -0.664 . . . . 0.0 112.527 -179.974 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 3.2 pt20 -150.26 156.82 42.28 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.895 0.378 . . . . 0.0 111.175 -179.831 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 3.3 m -128.17 111.61 13.63 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.79 179.864 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 1.1 pt? -140.14 148.51 41.75 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.97 179.949 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 27.2 m-85 -63.31 -33.01 74.58 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.03 -0.532 . . . . 0.0 111.462 -179.58 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -79.7 148.96 31.35 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.39 -0.368 . . . . 0.0 111.316 -179.682 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . 0.452 ' HA ' ' HD3' ' A' ' 33' ' ' LYS . . . -55.16 154.79 5.34 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.118 179.698 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -41.4 122.9 2.2 Favored Pre-proline 0 C--N 1.327 -0.377 0 CA-C-N 115.397 -0.819 . . . . 0.0 111.786 -179.635 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 59.3 Cg_endo -86.98 -77.14 0.0 OUTLIER 'Trans proline' 0 N--CA 1.456 -0.694 0 C-N-CA 122.771 2.314 . . . . 0.0 112.314 179.609 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 19' ' ' ILE . . . . . 0.483 HG22 ' OG1' ' A' ' 21' ' ' THR . 0.3 OUTLIER -56.54 -171.74 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.535 0.367 0 CA-C-N 116.452 -0.34 . . . . 0.0 111.387 179.727 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 20' ' ' PHE . . . . . 0.448 ' N ' HG23 ' A' ' 19' ' ' ILE . 0.7 OUTLIER -71.25 19.38 0.06 Allowed 'General case' 0 CA--C 1.531 0.238 0 N-CA-C 112.414 0.524 . . . . 0.0 112.414 -179.426 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 21' ' ' THR . . . . . 0.483 ' OG1' HG22 ' A' ' 19' ' ' ILE . 0.3 OUTLIER -73.99 -170.57 0.94 Allowed 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.761 0.315 . . . . 0.0 110.625 179.388 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . 0.476 ' HG2' ' OXT' ' A' ' 36' ' ' LYS . 0.7 OUTLIER -150.76 122.73 8.18 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.79 179.822 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 23' ' ' ILE . . . . . 0.883 ' HB ' ' HE3' ' A' ' 33' ' ' LYS . 0.2 OUTLIER -71.61 130.18 35.2 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-O 120.975 0.416 . . . . 0.0 110.402 179.913 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 24' ' ' GLN . . . . . 0.691 HE21 ' HE2' ' A' ' 36' ' ' LYS . 0.0 OUTLIER -111.95 -4.56 14.5 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.856 -0.611 . . . . 0.0 111.13 -179.298 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 163.82 -135.4 3.77 Favored Glycine 0 N--CA 1.45 -0.412 0 C-N-CA 120.879 -0.677 . . . . 0.0 112.229 -179.993 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . 0.671 ' HA ' ' HA ' ' A' ' 33' ' ' LYS . 1.2 p -127.3 149.71 49.91 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 121.029 0.442 . . . . 0.0 111.286 179.883 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 27' ' ' CYS . . . . . 0.417 ' HB3' ' H ' ' A' ' 28' ' ' TYR . 4.2 t -88.08 -82.47 0.23 Allowed 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.607 -0.724 . . . . 0.0 111.014 -179.691 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 28' ' ' TYR . . . . . 0.417 ' H ' ' HB3' ' A' ' 27' ' ' CYS . 60.8 m-85 -61.13 -165.95 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.682 -179.841 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -49.22 -42.43 40.39 Favored 'General case' 0 C--N 1.333 -0.139 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.337 -179.813 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 163.94 50.21 0.02 OUTLIER Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.724 -0.75 . . . . 0.0 112.557 179.896 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -124.78 -37.96 2.42 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.78 0.324 . . . . 0.0 110.835 179.948 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -121.54 145.92 47.47 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.887 179.921 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . 0.883 ' HE3' ' HB ' ' A' ' 23' ' ' ILE . 0.0 OUTLIER -94.98 145.56 24.85 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.835 -179.941 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 34' ' ' CYS . . . . . 0.674 ' HB3' HE22 ' A' ' 24' ' ' GLN . 0.0 OUTLIER -90.66 142.96 27.21 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.208 -179.969 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 35' ' ' CYS . . . . . 0.577 ' SG ' ' HE3' ' A' ' 33' ' ' LYS . 1.2 m -138.68 142.07 39.0 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.973 179.933 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . 0.78 ' HG2' ' HA ' ' A' ' 5' ' ' CYS . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.066 0 CA-C-O 118.217 -0.897 . . . . 0.0 110.987 179.803 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 15.2 t-80 . . . . . 0 C--O 1.231 0.122 0 CA-C-O 120.921 0.391 . . . . 0.0 110.936 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 6.0 t80 -61.15 174.58 0.65 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.958 -0.564 . . . . 0.0 110.693 179.731 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -79.55 79.37 6.03 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 121.264 0.554 . . . . 0.0 110.274 179.569 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -109.21 -65.01 1.18 Allowed 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.3 -0.864 . . . . 0.0 110.691 -179.748 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 6' ' ' VAL . . . . . 0.52 ' HA ' ' H ' ' A' ' 10' ' ' GLY . 0.3 OUTLIER -53.93 -17.83 1.93 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 115.672 -0.694 . . . . 0.0 111.143 179.923 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -45.46 -35.99 4.14 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-N 115.916 -0.584 . . . . 0.0 111.183 179.899 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -114.89 -13.7 11.95 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.801 179.845 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 123.81 41.58 0.41 Allowed Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.85 -0.691 . . . . 0.0 112.496 -179.973 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . 0.52 ' H ' ' HA ' ' A' ' 6' ' ' VAL . . . -92.23 174.89 37.4 Favored Glycine 0 N--CA 1.452 -0.284 0 C-N-CA 120.785 -0.721 . . . . 0.0 112.417 179.978 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 1.2 tt0 -147.45 150.87 35.44 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.764 0.316 . . . . 0.0 110.874 179.919 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 12' ' ' CYS . . . . . 0.436 ' C ' HD22 ' A' ' 13' ' ' LEU . 1.7 m -93.49 139.37 30.8 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.132 -0.485 . . . . 0.0 111.264 -179.71 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . 0.436 HD22 ' C ' ' A' ' 12' ' ' CYS . 3.2 mm? -126.35 142.41 51.54 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.459 179.657 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 2.0 m-85 -74.67 -1.91 23.9 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.396 -0.366 . . . . 0.0 111.209 -179.761 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . 0.505 ' O ' ' HD2' ' A' ' 33' ' ' LYS . 0.4 OUTLIER -149.91 -179.05 6.83 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.813 179.852 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -44.97 137.18 4.28 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.213 179.984 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . 0.452 ' SG ' ' HD2' ' A' ' 18' ' ' PRO . 0.5 OUTLIER -45.49 141.77 3.61 Favored Pre-proline 0 C--N 1.33 -0.268 0 CA-C-N 115.919 -0.582 . . . . 0.0 111.691 -179.568 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . 0.452 ' HD2' ' SG ' ' A' ' 17' ' ' CYS . 68.3 Cg_endo -79.3 -83.92 0.0 OUTLIER 'Trans proline' 0 C--N 1.348 0.545 0 C-N-CA 122.618 2.212 . . . . 0.0 112.641 -179.982 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 19' ' ' ILE . . . . . 0.475 HG12 ' H ' ' A' ' 20' ' ' PHE . 3.6 tt -56.17 -176.07 0.02 OUTLIER 'Isoleucine or valine' 0 CA--C 1.533 0.308 0 CA-C-O 120.784 0.326 . . . . 0.0 111.593 -179.768 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 20' ' ' PHE . . . . . 0.475 ' H ' HG12 ' A' ' 19' ' ' ILE . 0.4 OUTLIER -76.3 35.19 0.14 Allowed 'General case' 0 C--N 1.331 -0.205 0 N-CA-C 111.996 0.369 . . . . 0.0 111.996 -179.368 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 21' ' ' THR . . . . . 0.467 ' HB ' ' H ' ' A' ' 22' ' ' LYS . 0.0 OUTLIER -75.9 -152.46 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.792 -0.185 . . . . 0.0 110.507 179.441 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . 0.467 ' H ' ' HB ' ' A' ' 21' ' ' THR . 8.0 ttmm -160.45 108.59 1.63 Allowed 'General case' 0 C--O 1.231 0.122 0 CA-C-O 120.859 0.361 . . . . 0.0 111.838 -179.744 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 23' ' ' ILE . . . . . 0.911 HD13 ' HB2' ' A' ' 33' ' ' LYS . 0.1 OUTLIER -66.12 133.21 31.29 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.197 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.852 179.344 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 24' ' ' GLN . . . . . 0.676 ' HB2' ' NZ ' ' A' ' 36' ' ' LYS . 0.0 OUTLIER -114.54 -68.53 0.92 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.614 179.537 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -121.98 164.19 15.16 Favored Glycine 0 N--CA 1.452 -0.295 0 C-N-CA 121.032 -0.604 . . . . 0.0 111.931 179.632 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . 0.591 ' HA ' ' HA ' ' A' ' 33' ' ' LYS . 1.0 OUTLIER -75.5 153.02 37.76 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.07 0.462 . . . . 0.0 111.622 -179.802 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 18.4 t -100.67 -78.74 0.51 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.655 -0.702 . . . . 0.0 110.911 -179.903 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 3.4 m-85 -60.3 -174.69 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.989 179.931 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 20.0 ttm-85 -50.6 -25.86 4.67 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.873 179.783 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 156.26 9.59 0.06 OUTLIER Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.971 -0.633 . . . . 0.0 112.162 179.851 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -98.64 -14.01 20.06 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.685 0.279 . . . . 0.0 111.11 -179.858 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -138.51 141.95 39.35 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.411 -0.359 . . . . 0.0 110.555 179.896 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . 0.911 ' HB2' HD13 ' A' ' 23' ' ' ILE . 0.0 OUTLIER -107.53 141.71 38.55 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.95 0.405 . . . . 0.0 110.776 -179.889 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -84.11 131.27 34.8 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.025 -0.534 . . . . 0.0 111.668 -179.466 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -115.9 156.33 26.36 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 115.774 -0.648 . . . . 0.0 111.089 179.907 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . 0.676 ' NZ ' ' HB2' ' A' ' 24' ' ' GLN . 0.1 OUTLIER . . . . . 0 C--O 1.249 1.051 0 CA-C-O 118.412 -0.804 . . . . 0.0 111.005 -179.792 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 6.3 t-80 . . . . . 0 C--O 1.232 0.151 0 CA-C-O 120.846 0.355 . . . . 0.0 110.853 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 6.1 t80 -62.51 169.73 2.83 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.986 179.847 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 1.7 m120 -76.01 86.46 2.92 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.083 0.468 . . . . 0.0 110.764 179.89 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -114.93 -74.58 0.61 Allowed 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.652 -0.704 . . . . 0.0 110.441 179.862 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 6' ' ' VAL . . . . . 0.43 ' HA ' ' H ' ' A' ' 10' ' ' GLY . 7.3 p -54.23 -15.34 1.08 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 115.67 -0.695 . . . . 0.0 111.05 179.467 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -44.18 -57.12 3.61 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-N 115.901 -0.59 . . . . 0.0 111.386 -179.932 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 1.2 m -99.81 -27.81 13.44 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.872 179.986 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 147.23 53.09 0.02 OUTLIER Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.78 -0.724 . . . . 0.0 112.432 -179.926 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . 0.43 ' H ' ' HA ' ' A' ' 6' ' ' VAL . . . -121.53 166.86 14.32 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.849 -0.691 . . . . 0.0 112.386 -179.973 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 1.9 tp60 -147.96 151.63 36.14 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.742 0.306 . . . . 0.0 110.398 179.86 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 12' ' ' CYS . . . . . 0.423 ' HB3' ' HB3' ' A' ' 27' ' ' CYS . 1.6 m -65.58 120.91 13.77 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.865 0.364 . . . . 0.0 111.093 -179.742 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . 0.522 ' HB3' ' O ' ' A' ' 15' ' ' SER . 0.4 OUTLIER -99.74 109.85 22.27 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.934 -0.576 . . . . 0.0 110.478 179.752 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 14' ' ' TYR . . . . . 0.42 ' HA ' ' HB2' ' A' ' 32' ' ' ALA . 5.2 m-85 -52.89 -19.96 2.96 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.015 -0.539 . . . . 0.0 111.096 -179.893 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . 0.522 ' O ' ' HB3' ' A' ' 13' ' ' LEU . 0.7 OUTLIER -133.19 169.94 16.15 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.16 179.368 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -50.75 142.67 10.94 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.568 -0.287 . . . . 0.0 110.743 179.852 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -44.97 126.35 5.33 Favored Pre-proline 0 C--N 1.331 -0.203 0 CA-C-N 116.132 -0.485 . . . . 0.0 111.237 -179.571 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 59.1 Cg_endo -90.05 -72.67 0.0 OUTLIER 'Trans proline' 0 N--CA 1.456 -0.724 0 C-N-CA 122.978 2.452 . . . . 0.0 112.74 -179.554 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 19' ' ' ILE . . . . . 0.765 HG13 ' H ' ' A' ' 20' ' ' PHE . 5.2 tp -56.02 -172.92 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.533 0.292 0 CA-C-N 116.344 -0.389 . . . . 0.0 111.501 -179.86 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 20' ' ' PHE . . . . . 0.765 ' H ' HG13 ' A' ' 19' ' ' ILE . 8.1 p90 -74.47 33.13 0.09 Allowed 'General case' 0 C--N 1.331 -0.205 0 N-CA-C 111.693 0.257 . . . . 0.0 111.693 -179.765 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 21' ' ' THR . . . . . 0.47 ' HB ' ' H ' ' A' ' 22' ' ' LYS . 0.6 OUTLIER -81.17 -150.78 0.08 Allowed 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.582 -0.281 . . . . 0.0 110.617 179.447 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . 0.776 ' HG3' HE22 ' A' ' 24' ' ' GLN . 2.6 tptp -167.11 108.71 0.65 Allowed 'General case' 0 C--N 1.332 -0.158 0 CA-C-O 120.798 0.333 . . . . 0.0 110.954 179.991 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 23' ' ' ILE . . . . . 0.68 HG13 ' HE2' ' A' ' 33' ' ' LYS . 0.0 OUTLIER -68.27 138.65 22.11 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.614 179.665 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 24' ' ' GLN . . . . . 0.776 HE22 ' HG3' ' A' ' 22' ' ' LYS . 0.0 OUTLIER -108.94 -69.93 0.83 Allowed 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.842 -179.984 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -131.51 -146.74 5.84 Favored Glycine 0 N--CA 1.451 -0.34 0 CA-C-N 115.689 -0.687 . . . . 0.0 112.159 179.995 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . 0.62 ' HA ' ' HA ' ' A' ' 33' ' ' LYS . 9.6 p -113.96 147.93 37.75 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 121.012 0.434 . . . . 0.0 111.338 -179.942 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 27' ' ' CYS . . . . . 0.423 ' HB3' ' HB3' ' A' ' 12' ' ' CYS . 51.7 t -94.15 -92.8 0.18 Allowed 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.705 -0.68 . . . . 0.0 111.016 -179.779 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 16.7 m-85 -61.4 -156.29 0.01 OUTLIER 'General case' 0 CA--C 1.53 0.193 0 CA-C-N 115.978 -0.555 . . . . 0.0 111.604 -179.858 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 3.4 mmm-85 -50.59 -43.94 56.71 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 115.978 -0.556 . . . . 0.0 111.364 -179.896 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 161.31 26.68 0.02 OUTLIER Glycine 0 N--CA 1.453 -0.217 0 C-N-CA 120.691 -0.766 . . . . 0.0 112.679 179.992 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -105.26 -15.16 15.13 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.887 0.375 . . . . 0.0 110.694 179.911 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . 0.42 ' HB2' ' HA ' ' A' ' 14' ' ' TYR . . . -140.84 126.69 19.26 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.737 -179.993 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . 0.68 ' HE2' HG13 ' A' ' 23' ' ' ILE . 0.0 OUTLIER -93.03 132.04 37.49 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.779 0.324 . . . . 0.0 110.778 179.877 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -55.72 120.16 6.87 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.715 179.82 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 35' ' ' CYS . . . . . 0.512 ' SG ' ' HB ' ' A' ' 23' ' ' ILE . 0.9 OUTLIER -122.2 141.74 51.15 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.017 -179.672 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.028 0 CA-C-O 118.223 -0.894 . . . . 0.0 110.901 179.844 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 13.9 t-80 . . . . . 0 C--O 1.232 0.144 0 CA-C-O 120.824 0.345 . . . . 0.0 111.09 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 21.0 t80 -65.01 161.53 18.53 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.655 179.572 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -60.75 100.02 0.1 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.347 0.594 . . . . 0.0 110.153 179.509 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 5' ' ' CYS . . . . . 0.743 ' HA ' ' HG2' ' A' ' 36' ' ' LYS . 0.1 OUTLIER -130.34 -82.42 0.54 Allowed 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.545 -0.752 . . . . 0.0 109.918 -179.712 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 6' ' ' VAL . . . . . 0.428 ' HA ' ' H ' ' A' ' 10' ' ' GLY . 7.1 p -54.49 -15.26 1.13 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.183 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.702 178.872 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -44.75 -47.09 10.77 Favored 'General case' 0 C--N 1.333 -0.14 0 CA-C-N 115.669 -0.696 . . . . 0.0 111.519 -179.91 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 3.3 p -114.12 -3.11 13.29 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.288 -0.415 . . . . 0.0 111.11 -179.847 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 124.38 38.23 0.53 Allowed Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 120.678 -0.772 . . . . 0.0 112.617 179.947 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . 0.428 ' H ' ' HA ' ' A' ' 6' ' ' VAL . . . -102.54 169.99 19.88 Favored Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.802 -0.714 . . . . 0.0 112.333 179.925 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -150.34 144.84 25.76 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.866 0.365 . . . . 0.0 110.928 179.9 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 12' ' ' CYS . . . . . 0.465 ' HB3' ' HB2' ' A' ' 27' ' ' CYS . 0.0 OUTLIER -92.47 136.05 33.54 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.006 179.866 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 1.9 mp -131.51 162.67 29.72 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.847 -179.885 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 59.3 m-85 -79.73 -45.19 19.35 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.944 -179.993 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -89.21 171.67 9.63 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.13 -179.861 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -55.21 152.53 8.01 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.079 -0.509 . . . . 0.0 111.459 179.994 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . 0.43 ' HA ' ' HD3' ' A' ' 18' ' ' PRO . 0.1 OUTLIER -45.36 127.05 6.02 Favored Pre-proline 0 C--N 1.329 -0.289 0 CA-C-N 115.603 -0.726 . . . . 0.0 111.373 -179.988 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . 0.43 ' HD3' ' HA ' ' A' ' 17' ' ' CYS . 57.1 Cg_endo -89.18 -78.62 0.0 OUTLIER 'Trans proline' 0 N--CA 1.456 -0.721 0 C-N-CA 122.758 2.305 . . . . 0.0 112.589 -179.953 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 19' ' ' ILE . . . . . 0.776 HG13 ' H ' ' A' ' 20' ' ' PHE . 5.4 tp -56.45 -171.93 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.535 0.371 0 CA-C-N 116.496 -0.32 . . . . 0.0 111.732 -179.793 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 20' ' ' PHE . . . . . 0.776 ' H ' HG13 ' A' ' 19' ' ' ILE . 2.1 p90 -69.77 19.8 0.04 OUTLIER 'General case' 0 N--CA 1.463 0.222 0 N-CA-C 112.314 0.487 . . . . 0.0 112.314 -179.315 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 21' ' ' THR . . . . . 0.452 ' H ' ' C ' ' A' ' 19' ' ' ILE . 0.6 OUTLIER -73.25 -159.63 0.07 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.567 0.222 . . . . 0.0 110.651 179.473 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . 0.405 ' H ' ' HB ' ' A' ' 21' ' ' THR . 8.8 tptp -160.63 117.82 2.42 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.931 0.396 . . . . 0.0 111.421 -179.948 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 23' ' ' ILE . . . . . 0.58 HD12 ' HE3' ' A' ' 33' ' ' LYS . 0.6 OUTLIER -73.04 131.0 35.51 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.606 179.31 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 24' ' ' GLN . . . . . 0.885 ' HB2' ' HE2' ' A' ' 36' ' ' LYS . 1.7 tp-100 -113.31 -68.63 0.91 Allowed 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.618 179.915 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -126.54 -138.46 4.82 Favored Glycine 0 N--CA 1.45 -0.428 0 C-N-CA 120.847 -0.692 . . . . 0.0 112.074 179.697 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . 0.662 ' HA ' ' HA ' ' A' ' 33' ' ' LYS . 3.1 p -125.3 146.61 49.48 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 120.932 0.396 . . . . 0.0 111.17 179.93 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 27' ' ' CYS . . . . . 0.465 ' HB2' ' HB3' ' A' ' 12' ' ' CYS . 0.0 OUTLIER -86.44 -81.88 0.21 Allowed 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.808 -0.633 . . . . 0.0 111.169 -179.717 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 24.0 m-85 -61.02 -165.27 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.905 -0.589 . . . . 0.0 111.887 -179.598 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -50.52 -34.48 25.44 Favored 'General case' 0 C--N 1.333 -0.152 0 CA-C-N 115.87 -0.605 . . . . 0.0 111.419 -179.929 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 153.91 41.37 0.02 OUTLIER Glycine 0 N--CA 1.452 -0.235 0 C-N-CA 120.726 -0.75 . . . . 0.0 112.491 -179.915 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 15.2 mttm -116.76 -23.53 8.09 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.841 0.353 . . . . 0.0 110.88 179.923 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -136.33 145.67 45.72 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.911 179.952 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . 0.662 ' HA ' ' HA ' ' A' ' 26' ' ' THR . 0.0 OUTLIER -98.26 138.95 34.78 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.918 -179.875 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -78.07 138.29 38.69 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.753 179.958 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 35' ' ' CYS . . . . . 0.414 ' SG ' ' NZ ' ' A' ' 33' ' ' LYS . 1.2 m -125.88 131.5 52.35 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.965 -179.839 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . 0.885 ' HE2' ' HB2' ' A' ' 24' ' ' GLN . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.054 0 CA-C-O 118.247 -0.882 . . . . 0.0 110.919 179.908 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 5.1 m-20 . . . . . 0 N--CA 1.487 1.385 0 CA-C-O 120.864 0.364 . . . . 0.0 111.246 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 6.7 t-80 -60.06 108.05 0.72 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.997 -0.547 . . . . 0.0 111.089 -179.879 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 5.2 t80 -63.48 158.66 20.33 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.501 179.573 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -66.57 86.08 0.11 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.079 0.466 . . . . 0.0 110.547 179.813 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -106.86 -74.32 0.66 Allowed 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.616 -0.72 . . . . 0.0 110.867 -179.709 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . 0.532 ' HA ' ' H ' ' A' ' 10' ' ' GLY . 12.7 p -53.64 -25.22 11.03 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.228 0 CA-C-N 115.987 -0.551 . . . . 0.0 111.157 179.914 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -45.37 -53.37 8.69 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.835 -0.62 . . . . 0.0 111.34 179.992 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 58.6 m -95.68 -31.24 13.34 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.984 -179.925 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 147.26 54.63 0.02 OUTLIER Glycine 0 N--CA 1.452 -0.276 0 C-N-CA 120.865 -0.683 . . . . 0.0 112.404 179.989 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . 0.532 ' H ' ' HA ' ' A' ' 6' ' ' VAL . . . -123.89 174.32 16.77 Favored Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.714 -0.755 . . . . 0.0 112.632 -179.919 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 7.3 tt0 -150.02 156.39 41.6 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.87 0.367 . . . . 0.0 110.918 -179.946 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -98.02 131.06 44.77 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.041 -0.527 . . . . 0.0 111.031 -179.937 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -134.85 134.75 41.09 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.871 179.982 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 40.3 m-85 -59.15 -28.66 66.79 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.119 -179.973 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 47.1 m -107.25 169.45 8.56 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.152 -179.804 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . 0.431 ' HA ' ' HD3' ' A' ' 33' ' ' LYS . . . -52.64 154.28 2.74 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 115.984 -0.553 . . . . 0.0 111.464 -179.986 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . 0.636 ' SG ' ' HE3' ' A' ' 33' ' ' LYS . 85.3 m -45.33 134.04 5.73 Favored Pre-proline 0 C--N 1.328 -0.347 0 CA-C-N 115.437 -0.802 . . . . 0.0 111.633 -179.748 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . 0.503 ' HG2' ' H ' ' A' ' 19' ' ' ILE . 69.7 Cg_endo -77.06 -78.94 0.01 OUTLIER 'Trans proline' 0 C--N 1.347 0.464 0 C-N-CA 122.501 2.134 . . . . 0.0 111.81 179.444 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' ILE . . . . . 0.503 ' H ' ' HG2' ' A' ' 18' ' ' PRO . 2.0 tt -56.63 -172.1 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.534 0.334 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.126 179.351 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' PHE . . . . . 0.406 ' N ' HG23 ' A' ' 19' ' ' ILE . 0.3 OUTLIER -77.94 41.41 0.35 Allowed 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.728 0.299 . . . . 0.0 111.471 -179.926 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . 0.617 ' HB ' ' SG ' ' A' ' 35' ' ' CYS . 0.4 OUTLIER -89.97 -165.81 1.44 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.471 -0.331 . . . . 0.0 110.905 179.799 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . 0.518 ' O ' ' HG2' ' A' ' 22' ' ' LYS . 0.0 OUTLIER -150.13 128.54 12.17 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-O 120.985 0.421 . . . . 0.0 110.719 179.504 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' ILE . . . . . 0.553 HG13 ' HB2' ' A' ' 33' ' ' LYS . 0.1 OUTLIER -78.06 124.45 36.46 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.908 -179.447 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' GLN . . . . . 0.584 ' HB2' ' HE2' ' A' ' 36' ' ' LYS . 3.1 mt-30 -93.8 -57.68 2.48 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.91 179.989 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -136.1 -148.62 5.59 Favored Glycine 0 N--CA 1.452 -0.287 0 C-N-CA 120.919 -0.658 . . . . 0.0 112.486 -179.984 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . 0.407 ' HA ' ' HA ' ' A' ' 33' ' ' LYS . 0.7 OUTLIER -118.96 147.25 44.26 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.962 0.41 . . . . 0.0 111.241 -179.997 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 9.5 t -83.87 -95.39 0.06 Allowed 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.746 -0.661 . . . . 0.0 110.953 -179.768 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 14.9 m-85 -61.51 -156.61 0.01 OUTLIER 'General case' 0 CA--C 1.53 0.176 0 CA-C-O 120.985 0.422 . . . . 0.0 111.474 179.984 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 1.9 mtp180 -50.06 -35.36 24.84 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-N 116.053 -0.521 . . . . 0.0 111.109 179.983 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 155.64 17.39 0.04 OUTLIER Glycine 0 N--CA 1.452 -0.289 0 C-N-CA 120.727 -0.749 . . . . 0.0 112.5 179.925 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 18.6 tttt -89.67 -24.21 21.66 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.91 0.386 . . . . 0.0 110.531 179.83 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -130.27 144.92 51.66 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.96 -0.564 . . . . 0.0 111.009 179.897 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . 0.636 ' HE3' ' SG ' ' A' ' 17' ' ' CYS . 0.0 OUTLIER -102.24 139.66 37.55 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.787 -179.992 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -81.72 125.51 30.7 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.657 179.861 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' CYS . . . . . 0.617 ' SG ' ' HB ' ' A' ' 21' ' ' THR . 4.6 t -127.49 151.53 48.74 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.355 -179.684 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . 0.584 ' HE2' ' HB2' ' A' ' 24' ' ' GLN . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.071 0 CA-C-O 118.253 -0.879 . . . . 0.0 110.799 179.953 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 1.7 t70 . . . . . 0 N--CA 1.486 1.345 0 CA-C-O 120.792 0.33 . . . . 0.0 111.08 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 6.5 t-80 -60.13 109.42 0.97 Allowed 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.853 179.971 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 9.0 t80 -54.96 162.14 1.39 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.731 179.732 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 1.2 m120 -72.42 80.49 1.04 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.206 0.527 . . . . 0.0 110.543 179.836 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 3.0 m -98.3 -70.0 0.74 Allowed 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.398 -0.819 . . . . 0.0 110.525 -179.916 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 2.0 p -54.85 -13.52 0.83 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-N 116.081 -0.509 . . . . 0.0 111.153 179.176 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 1.2 t -41.88 -51.7 4.24 Favored 'General case' 0 N--CA 1.462 0.153 0 CA-C-N 115.865 -0.607 . . . . 0.0 111.488 -179.717 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 1.3 m -105.79 -10.0 16.94 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.782 179.951 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 125.53 39.03 0.45 Allowed Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.874 -0.679 . . . . 0.0 112.399 -179.964 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -82.68 170.31 49.96 Favored Glycine 0 N--CA 1.452 -0.294 0 C-N-CA 120.806 -0.711 . . . . 0.0 112.466 -179.998 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -143.5 153.93 43.12 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.817 0.342 . . . . 0.0 110.959 179.968 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 1.9 m -110.13 137.08 48.37 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.947 -179.991 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -136.96 152.13 49.81 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.88 179.996 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 62.9 m-85 -75.6 -14.32 60.37 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.226 -179.797 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 1.9 p -120.61 169.94 9.89 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.977 -179.893 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -51.63 145.55 8.97 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.105 179.948 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER -45.49 142.04 3.49 Favored Pre-proline 0 C--N 1.329 -0.305 0 CA-C-N 115.752 -0.658 . . . . 0.0 111.674 -179.621 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 55.4 Cg_endo -91.01 -75.39 0.0 OUTLIER 'Trans proline' 0 N--CA 1.456 -0.734 0 C-N-CA 123.115 2.543 . . . . 0.0 113.023 -179.686 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' ILE . . . . . 0.457 HG22 ' OG1' ' A' ' 21' ' ' THR . 2.4 tt -56.02 -176.47 0.02 OUTLIER 'Isoleucine or valine' 0 CA--C 1.535 0.382 0 CA-C-O 120.848 0.356 . . . . 0.0 111.903 -179.496 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 4.0 p90 -74.88 32.15 0.09 Allowed 'General case' 0 CA--C 1.532 0.259 0 N-CA-C 112.616 0.599 . . . . 0.0 112.616 -178.85 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . 0.457 ' OG1' HG22 ' A' ' 19' ' ' ILE . 0.0 OUTLIER -78.86 -152.82 0.06 Allowed 'General case' 0 C--N 1.331 -0.227 0 C-N-CA 121.136 -0.226 . . . . 0.0 110.46 179.273 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . 0.444 ' H ' ' HB ' ' A' ' 21' ' ' THR . 17.0 tttp -165.17 94.07 0.63 Allowed 'General case' 0 C--N 1.333 -0.126 0 C-N-CA 120.711 -0.395 . . . . 0.0 111.661 -179.919 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' ILE . . . . . 0.531 ' HB ' ' CE ' ' A' ' 33' ' ' LYS . 0.2 OUTLIER -49.14 131.83 7.1 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.576 179.252 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' GLN . . . . . 0.445 ' NE2' ' NZ ' ' A' ' 36' ' ' LYS . 0.0 OUTLIER -120.54 0.77 10.55 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.467 -0.333 . . . . 0.0 111.715 -179.426 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 176.44 -145.67 7.59 Favored Glycine 0 N--CA 1.451 -0.343 0 C-N-CA 120.428 -0.891 . . . . 0.0 112.889 180.0 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . 0.517 ' HA ' ' HA ' ' A' ' 33' ' ' LYS . 1.2 p -127.01 149.45 49.89 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.06 0.457 . . . . 0.0 111.303 -179.749 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 8.5 t -89.64 -85.48 0.21 Allowed 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.672 -0.694 . . . . 0.0 111.146 -179.737 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 8.5 m-85 -61.37 -158.23 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.564 -179.641 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 81.8 mtt180 -48.56 -38.39 20.41 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-N 116.018 -0.537 . . . . 0.0 111.349 -179.73 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 157.54 17.5 0.04 OUTLIER Glycine 0 N--CA 1.452 -0.283 0 C-N-CA 120.725 -0.75 . . . . 0.0 112.674 179.919 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 3.0 mttt -95.62 -28.2 14.95 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.872 0.368 . . . . 0.0 110.814 179.874 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -118.13 149.66 40.67 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.121 -0.49 . . . . 0.0 111.044 -179.979 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . 0.531 ' CE ' ' HB ' ' A' ' 23' ' ' ILE . 0.0 OUTLIER -97.44 145.52 26.11 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.892 -0.594 . . . . 0.0 110.883 -179.992 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -97.65 119.88 37.02 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.944 179.9 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' CYS . . . . . 0.53 ' SG ' ' HE3' ' A' ' 33' ' ' LYS . 0.0 OUTLIER -114.55 160.94 18.69 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.728 -0.669 . . . . 0.0 111.261 -179.615 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . 0.464 ' NZ ' ' HA ' ' A' ' 35' ' ' CYS . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.051 0 CA-C-O 118.271 -0.871 . . . . 0.0 111.001 -179.996 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 . . . . . 0 N--CA 1.486 1.355 0 CA-C-O 120.799 0.333 . . . . 0.0 111.183 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -60.31 125.5 23.93 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.568 179.9 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' TYR . . . . . 0.435 ' HB3' ' SG ' ' A' ' 34' ' ' CYS . 1.4 t80 -56.52 145.44 28.01 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.882 -179.794 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 4.1 m120 -66.11 84.36 0.09 Allowed 'General case' 0 N--CA 1.45 -0.457 0 CA-C-O 121.135 0.493 . . . . 0.0 110.905 -179.995 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -102.26 -69.21 0.79 Allowed 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.579 -0.737 . . . . 0.0 110.776 -179.838 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 10.3 p -53.73 -21.27 4.68 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 115.777 -0.647 . . . . 0.0 111.282 179.893 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 22.5 p -45.32 -37.58 4.97 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-N 115.928 -0.578 . . . . 0.0 111.255 -179.939 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 2.8 m -112.03 -20.55 11.92 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.9 -179.949 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 118.01 49.15 0.38 Allowed Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.838 -0.696 . . . . 0.0 112.512 179.998 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -101.99 -173.24 27.71 Favored Glycine 0 N--CA 1.451 -0.301 0 C-N-CA 120.679 -0.772 . . . . 0.0 112.497 -179.999 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -149.46 137.52 20.52 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.694 0.283 . . . . 0.0 110.567 179.885 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . 0.553 ' HA ' ' O ' ' A' ' 33' ' ' LYS . 0.0 OUTLIER -89.58 110.68 21.52 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.001 0.429 . . . . 0.0 111.533 -179.63 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 1.6 mp -105.11 122.12 45.22 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.789 -0.641 . . . . 0.0 110.1 179.249 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' TYR . . . . . 0.796 ' HA ' ' HA ' ' A' ' 32' ' ' ALA . 31.9 m-85 -49.68 -33.32 15.4 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.07 -179.443 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 34.2 t -99.01 166.91 11.05 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.387 179.338 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -52.94 141.06 22.99 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.449 -0.341 . . . . 0.0 110.718 179.851 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . 0.513 ' SG ' ' HB ' ' A' ' 23' ' ' ILE . 39.5 m -45.5 132.01 6.22 Favored Pre-proline 0 C--N 1.33 -0.26 0 CA-C-N 116.063 -0.517 . . . . 0.0 111.914 -179.416 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . 0.427 ' HG2' ' H ' ' A' ' 19' ' ' ILE . 68.6 Cg_endo -81.49 -70.04 0.01 OUTLIER 'Trans proline' 0 N--CA 1.459 -0.503 0 C-N-CA 122.691 2.261 . . . . 0.0 112.261 179.624 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' ILE . . . . . 0.457 HG13 ' H ' ' A' ' 20' ' ' PHE . 0.3 OUTLIER -56.59 -173.24 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.534 0.334 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.639 179.759 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' PHE . . . . . 0.457 ' H ' HG13 ' A' ' 19' ' ' ILE . 27.9 p90 -74.51 25.91 0.08 Allowed 'General case' 0 C--N 1.331 -0.213 0 N-CA-C 112.073 0.397 . . . . 0.0 112.073 -179.626 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . 0.563 ' HB ' ' SG ' ' A' ' 35' ' ' CYS . 0.9 OUTLIER -76.74 -163.04 0.3 Allowed 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 120.518 0.199 . . . . 0.0 110.763 179.711 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . 0.432 ' H ' ' HB ' ' A' ' 21' ' ' THR . 8.9 tttt -163.6 108.23 1.04 Allowed 'General case' 0 C--O 1.231 0.132 0 CA-C-O 120.843 0.354 . . . . 0.0 110.844 -179.97 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' ILE . . . . . 0.889 HG13 ' HB3' ' A' ' 33' ' ' LYS . 0.0 OUTLIER -68.93 139.57 20.29 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 CA-C-O 121.076 0.465 . . . . 0.0 110.755 179.891 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' GLN . . . . . 0.867 ' HB2' ' HE3' ' A' ' 36' ' ' LYS . 0.4 OUTLIER -105.19 -44.95 4.63 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.727 -0.67 . . . . 0.0 110.568 179.23 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -151.88 -149.48 5.1 Favored Glycine 0 N--CA 1.452 -0.292 0 C-N-CA 120.989 -0.624 . . . . 0.0 112.251 179.917 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -110.54 148.34 32.33 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.053 0.454 . . . . 0.0 111.277 -179.931 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' CYS . . . . . 0.442 ' HB2' ' HB3' ' A' ' 12' ' ' CYS . 0.0 OUTLIER -83.44 -91.3 0.08 Allowed 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.741 -0.663 . . . . 0.0 111.133 -179.694 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' TYR . . . . . 0.432 ' H ' ' HB3' ' A' ' 27' ' ' CYS . 29.4 m-85 -61.49 -156.18 0.01 OUTLIER 'General case' 0 CA--C 1.531 0.229 0 CA-C-N 116.066 -0.516 . . . . 0.0 111.764 -179.701 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -49.17 -39.55 29.69 Favored 'General case' 0 C--O 1.232 0.139 0 CA-C-N 115.917 -0.583 . . . . 0.0 111.314 -179.83 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 155.65 48.15 0.01 OUTLIER Glycine 0 N--CA 1.452 -0.257 0 C-N-CA 120.744 -0.741 . . . . 0.0 112.549 -179.975 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 5.9 mptt -120.04 -44.21 2.51 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.86 0.362 . . . . 0.0 110.881 179.999 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . 0.796 ' HA ' ' HA ' ' A' ' 14' ' ' TYR . . . -105.98 146.66 29.76 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.987 179.977 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . 0.889 ' HB3' HG13 ' A' ' 23' ' ' ILE . 2.7 mtpp -95.77 120.66 36.42 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.079 -179.932 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' CYS . . . . . 0.604 ' SG ' ' HE2' ' A' ' 36' ' ' LYS . 0.1 OUTLIER -69.74 111.7 5.69 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.213 179.287 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' CYS . . . . . 0.563 ' SG ' ' HB ' ' A' ' 21' ' ' THR . 3.3 t -116.16 146.93 41.89 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.233 -179.427 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . 0.867 ' HE3' ' HB2' ' A' ' 24' ' ' GLN . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.043 0 CA-C-O 118.23 -0.89 . . . . 0.0 110.887 179.827 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.486 1.34 0 CA-C-O 120.834 0.35 . . . . 0.0 111.143 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -60.32 116.46 4.28 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.902 -179.991 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 5.2 t80 -65.55 160.17 22.98 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.594 179.852 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -68.91 85.63 0.33 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.1 0.476 . . . . 0.0 110.822 179.883 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' CYS . . . . . 0.672 ' HA ' ' HG2' ' A' ' 36' ' ' LYS . 0.0 OUTLIER -109.53 -79.05 0.58 Allowed 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.641 -0.709 . . . . 0.0 110.556 179.941 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 11.9 p -54.26 -16.82 1.56 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.188 0 CA-C-N 115.959 -0.564 . . . . 0.0 111.15 179.62 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -45.08 -53.63 7.7 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.925 -0.58 . . . . 0.0 111.342 -179.859 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 5.5 p -106.32 -5.06 19.36 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.982 179.995 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 118.37 51.14 0.32 Allowed Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.786 -0.721 . . . . 0.0 112.501 -179.964 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -96.88 -178.26 34.91 Favored Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.735 -0.745 . . . . 0.0 112.476 -179.973 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 6.1 tt0 -146.51 131.75 18.45 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.815 0.341 . . . . 0.0 110.826 179.948 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . 0.476 ' HB3' ' HB2' ' A' ' 27' ' ' CYS . 0.0 OUTLIER -102.62 131.02 49.67 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.951 -179.893 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 3.0 mt -133.03 158.15 43.46 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.006 -179.949 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' TYR . . . . . 0.453 ' CD1' ' HB2' ' A' ' 32' ' ' ALA . 29.2 m-85 -82.41 -8.47 59.62 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.212 -179.848 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 98.7 p -117.65 169.08 9.86 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.386 -0.37 . . . . 0.0 111.085 -179.833 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -54.94 147.68 14.94 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.07 -0.513 . . . . 0.0 111.115 179.947 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . 0.452 ' HA ' ' HD3' ' A' ' 18' ' ' PRO . 0.1 OUTLIER -45.26 131.26 5.85 Favored Pre-proline 0 C--N 1.33 -0.265 0 CA-C-N 115.856 -0.611 . . . . 0.0 111.306 -179.855 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . 0.452 ' HD3' ' HA ' ' A' ' 17' ' ' CYS . 40.9 Cg_endo -90.8 -79.98 0.0 OUTLIER 'Trans proline' 0 N--CA 1.455 -0.767 0 C-N-CA 122.995 2.463 . . . . 0.0 112.64 -179.782 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' ILE . . . . . 0.567 HG12 ' H ' ' A' ' 20' ' ' PHE . 3.7 tt -56.6 -168.3 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.536 0.432 0 CA-C-N 116.376 -0.375 . . . . 0.0 111.758 -179.873 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' PHE . . . . . 0.567 ' H ' HG12 ' A' ' 19' ' ' ILE . 0.8 OUTLIER -75.69 33.97 0.12 Allowed 'General case' 0 CA--C 1.531 0.223 0 N-CA-C 112.083 0.401 . . . . 0.0 112.083 -179.492 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . 0.448 HG22 ' OXT' ' A' ' 36' ' ' LYS . 0.1 OUTLIER -90.25 180.0 5.77 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.74 0.305 . . . . 0.0 110.695 179.263 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . 0.472 ' HE2' HE22 ' A' ' 24' ' ' GLN . 1.6 ptmm? -135.68 136.39 40.86 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.332 -0.394 . . . . 0.0 110.408 179.554 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' ILE . . . . . 0.968 HD13 ' HB2' ' A' ' 33' ' ' LYS . 0.1 OUTLIER -89.9 126.35 42.78 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.836 -179.715 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' GLN . . . . . 0.694 ' HB2' ' HE2' ' A' ' 36' ' ' LYS . 0.0 OUTLIER -104.08 -59.81 1.67 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.607 -0.724 . . . . 0.0 111.157 -179.703 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -141.45 -132.98 2.84 Favored Glycine 0 C--N 1.332 0.329 0 C-N-CA 120.673 -0.775 . . . . 0.0 112.904 -179.702 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 15.9 p -126.04 149.76 48.63 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.05 0.452 . . . . 0.0 111.234 -179.786 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' CYS . . . . . 0.476 ' HB2' ' HB3' ' A' ' 12' ' ' CYS . 0.7 OUTLIER -95.27 -78.06 0.46 Allowed 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.678 -0.692 . . . . 0.0 111.158 -179.738 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 17.6 m-85 -60.94 -164.65 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.504 -179.658 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 4.3 mtm180 -50.1 -36.97 31.76 Favored 'General case' 0 C--N 1.333 -0.143 0 CA-C-N 115.964 -0.562 . . . . 0.0 111.279 -179.936 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 153.74 43.61 0.02 OUTLIER Glycine 0 N--CA 1.452 -0.294 0 C-N-CA 120.751 -0.738 . . . . 0.0 112.556 179.949 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -122.54 -21.22 5.78 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.841 0.353 . . . . 0.0 110.947 179.967 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . 0.453 ' HB2' ' CD1' ' A' ' 14' ' ' TYR . . . -127.63 143.94 51.12 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.123 -0.49 . . . . 0.0 111.036 179.992 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . 0.968 ' HB2' HD13 ' A' ' 23' ' ' ILE . 0.0 OUTLIER -96.1 134.66 38.89 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.877 179.998 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' CYS . . . . . 0.455 ' HB2' ' SG ' ' A' ' 27' ' ' CYS . 0.0 OUTLIER -79.16 141.49 37.18 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.139 -179.739 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' CYS . . . . . 0.434 ' SG ' ' HE3' ' A' ' 33' ' ' LYS . 0.8 OUTLIER -134.79 129.95 35.37 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.905 179.946 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . 0.694 ' HE2' ' HB2' ' A' ' 24' ' ' GLN . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.079 0 CA-C-O 118.256 -0.878 . . . . 0.0 110.874 179.942 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.486 1.371 0 CA-C-O 120.851 0.357 . . . . 0.0 111.248 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 1.9 t-80 -59.83 113.29 2.2 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.602 179.881 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 4.4 t80 -62.75 166.72 5.19 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.744 179.995 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' ASN . . . . . 0.431 ' ND2' ' HB2' ' A' ' 7' ' ' SER . 26.0 t-20 -81.89 78.49 8.6 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 121.409 0.623 . . . . 0.0 110.765 179.862 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 0.3 OUTLIER -106.23 -56.51 2.18 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.168 -0.924 . . . . 0.0 110.241 179.897 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 60.9 t -54.99 -12.89 0.74 Allowed 'Isoleucine or valine' 0 CA--C 1.53 0.208 0 CA-C-N 115.754 -0.657 . . . . 0.0 111.105 179.168 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . 0.431 ' HB2' ' ND2' ' A' ' 4' ' ' ASN . 6.2 t -34.38 -50.22 0.41 Allowed 'General case' 0 N--CA 1.464 0.266 0 CA-C-N 115.821 -0.627 . . . . 0.0 111.833 -179.831 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 28.2 t -107.75 -19.74 13.44 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.863 -179.96 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 136.39 34.85 0.22 Allowed Glycine 0 N--CA 1.45 -0.37 0 C-N-CA 120.828 -0.701 . . . . 0.0 112.321 -179.93 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -65.89 176.75 15.67 Favored Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.796 -0.716 . . . . 0.0 112.477 -179.995 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -144.84 142.51 29.99 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.84 0.352 . . . . 0.0 110.965 -179.967 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 3.2 m -106.18 125.24 50.76 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.079 -0.509 . . . . 0.0 110.704 179.876 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . 0.499 ' O ' ' HG3' ' A' ' 33' ' ' LYS . 3.6 mp -135.14 151.84 51.06 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.275 -0.421 . . . . 0.0 111.046 -179.842 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' TYR . . . . . 0.428 ' CD1' ' HB2' ' A' ' 32' ' ' ALA . 11.8 m-85 -77.74 -3.96 43.89 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.881 179.942 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 15.7 t -122.3 173.85 7.36 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.007 -179.997 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -54.78 144.18 23.18 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.279 -179.987 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . 0.509 ' SG ' ' HE3' ' A' ' 33' ' ' LYS . 71.7 m -45.78 139.45 5.07 Favored Pre-proline 0 C--N 1.331 -0.228 0 CA-C-N 115.824 -0.626 . . . . 0.0 111.551 -179.792 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . 0.45 ' HG2' ' H ' ' A' ' 19' ' ' ILE . 68.1 Cg_endo -76.43 -83.3 0.0 OUTLIER 'Trans proline' 0 C--N 1.347 0.452 0 C-N-CA 122.498 2.132 . . . . 0.0 112.289 179.853 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' ILE . . . . . 0.604 HG13 ' H ' ' A' ' 20' ' ' PHE . 0.8 OUTLIER -56.53 -171.18 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.535 0.391 0 CA-C-O 120.859 0.362 . . . . 0.0 111.619 179.884 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' PHE . . . . . 0.604 ' H ' HG13 ' A' ' 19' ' ' ILE . 3.8 p90 -69.96 15.48 0.08 Allowed 'General case' 0 CA--C 1.533 0.291 0 N-CA-C 111.982 0.364 . . . . 0.0 111.982 -179.664 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . 0.632 ' HB ' ' SG ' ' A' ' 35' ' ' CYS . 0.6 OUTLIER -63.15 -172.71 0.05 OUTLIER 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 120.851 0.358 . . . . 0.0 111.268 179.809 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -151.54 118.07 5.7 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.066 179.945 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' ILE . . . . . 0.586 HD12 ' HD2' ' A' ' 33' ' ' LYS . 0.2 OUTLIER -64.76 120.67 12.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.735 179.99 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' GLN . . . . . 0.583 ' HB2' ' HZ2' ' A' ' 36' ' ' LYS . 0.0 OUTLIER -88.39 -28.84 20.69 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.552 179.922 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -177.47 -130.28 1.36 Allowed Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 121.026 -0.607 . . . . 0.0 112.219 179.998 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . 0.63 ' HA ' ' HA ' ' A' ' 33' ' ' LYS . 0.6 OUTLIER -116.79 145.74 43.32 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.9 0.381 . . . . 0.0 111.037 179.831 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 25.5 t -94.37 -78.47 0.44 Allowed 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.839 -179.87 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' TYR . . . . . 0.509 ' HB3' ' NZ ' ' A' ' 31' ' ' LYS . 22.7 m-85 -60.12 -176.92 0.05 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.842 -0.617 . . . . 0.0 111.039 -179.979 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . 0.416 HH11 ' HD3' ' A' ' 29' ' ' ARG . 7.0 mmt-85 -50.31 -24.41 2.93 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.218 -179.988 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 153.65 32.75 0.03 OUTLIER Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.885 -0.674 . . . . 0.0 112.342 179.873 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . 0.509 ' NZ ' ' HB3' ' A' ' 28' ' ' TYR . 2.0 mttp -111.17 -35.76 5.8 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.759 0.314 . . . . 0.0 110.927 -179.968 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . 0.428 ' HB2' ' CD1' ' A' ' 14' ' ' TYR . . . -128.86 153.79 47.11 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.299 -0.41 . . . . 0.0 110.995 -179.983 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . 0.63 ' HA ' ' HA ' ' A' ' 26' ' ' THR . 0.0 OUTLIER -92.81 144.94 24.79 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.938 -179.869 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -88.36 128.18 35.5 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.456 179.86 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' CYS . . . . . 0.632 ' SG ' ' HB ' ' A' ' 21' ' ' THR . 2.5 t -130.06 150.17 51.45 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.195 -179.54 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . 0.583 ' HZ2' ' HB2' ' A' ' 24' ' ' GLN . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.044 0 CA-C-O 118.284 -0.865 . . . . 0.0 110.959 179.999 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.487 1.386 0 CA-C-O 120.699 0.285 . . . . 0.0 111.1 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 6.8 t-80 -60.18 105.61 0.43 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.71 179.854 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 7.8 t80 -60.57 164.48 4.5 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.714 179.78 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 1.1 t30 -71.18 85.32 0.75 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.075 0.464 . . . . 0.0 110.51 179.683 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' CYS . . . . . 0.586 ' HA ' ' HG2' ' A' ' 36' ' ' LYS . 0.1 OUTLIER -102.54 -72.43 0.69 Allowed 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.686 -0.688 . . . . 0.0 110.668 -179.865 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 13.9 p -53.9 -19.74 3.32 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-N 115.973 -0.558 . . . . 0.0 111.132 179.723 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 3.3 p -45.13 -44.28 10.48 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 115.938 -0.574 . . . . 0.0 111.402 -179.972 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 3.1 p -113.89 1.06 14.63 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.974 -179.948 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 103.94 44.6 1.61 Allowed Glycine 0 N--CA 1.451 -0.334 0 C-N-CA 120.736 -0.745 . . . . 0.0 112.181 -179.846 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -85.99 -176.18 49.99 Favored Glycine 0 N--CA 1.45 -0.394 0 C-N-CA 120.795 -0.717 . . . . 0.0 112.499 -179.881 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 5.0 mp0 -147.91 150.13 33.51 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.753 0.311 . . . . 0.0 110.797 179.985 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . 0.415 ' C ' HD22 ' A' ' 13' ' ' LEU . 0.1 OUTLIER -108.18 129.56 55.18 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.911 179.969 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . 0.57 ' HB2' ' NZ ' ' A' ' 33' ' ' LYS . 3.9 mm? -121.15 157.26 30.56 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.959 -179.847 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 60.0 m-85 -82.9 -18.91 38.51 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.78 179.852 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -126.88 -175.58 3.46 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.864 -179.946 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -51.06 140.16 16.4 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.064 -0.516 . . . . 0.0 111.14 179.915 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . 0.617 ' SG ' ' HE3' ' A' ' 33' ' ' LYS . 82.9 m -45.52 137.89 5.25 Favored Pre-proline 0 C--N 1.331 -0.21 0 CA-C-N 116.081 -0.509 . . . . 0.0 111.555 -179.782 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . 0.456 ' HD3' ' HA ' ' A' ' 17' ' ' CYS . 50.7 Cg_endo -89.75 -73.34 0.0 OUTLIER 'Trans proline' 0 N--CA 1.454 -0.796 0 C-N-CA 122.957 2.438 . . . . 0.0 112.231 179.802 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' ILE . . . . . 0.612 HG13 ' H ' ' A' ' 20' ' ' PHE . 0.7 OUTLIER -56.47 -173.45 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.534 0.338 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.456 179.738 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' PHE . . . . . 0.612 ' H ' HG13 ' A' ' 19' ' ' ILE . 2.1 p90 -78.1 40.03 0.32 Allowed 'General case' 0 C--N 1.332 -0.196 0 CA-C-N 116.563 -0.29 . . . . 0.0 111.594 -179.753 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . 0.58 ' HB ' ' SG ' ' A' ' 35' ' ' CYS . 0.7 OUTLIER -89.48 -161.01 0.73 Allowed 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.567 -0.288 . . . . 0.0 110.631 179.448 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . 0.409 ' H ' ' HB ' ' A' ' 21' ' ' THR . 15.8 tttt -159.07 108.91 1.95 Allowed 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 120.721 0.296 . . . . 0.0 111.399 -179.953 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' ILE . . . . . 0.933 HD13 ' HB2' ' A' ' 33' ' ' LYS . 0.2 OUTLIER -60.39 126.61 18.51 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.226 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.735 179.592 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' GLN . . . . . 0.533 ' HB2' ' HE2' ' A' ' 36' ' ' LYS . 0.1 OUTLIER -111.66 -56.49 2.38 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.042 -0.527 . . . . 0.0 110.882 179.894 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -140.75 -160.96 8.5 Favored Glycine 0 N--CA 1.452 -0.29 0 C-N-CA 120.814 -0.708 . . . . 0.0 112.337 179.857 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -92.65 147.9 22.5 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.985 0.421 . . . . 0.0 111.231 179.917 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' CYS . . . . . 0.423 ' HB3' ' H ' ' A' ' 28' ' ' TYR . 0.1 OUTLIER -93.18 -92.71 0.16 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.951 -0.568 . . . . 0.0 111.002 -179.898 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' TYR . . . . . 0.423 ' H ' ' HB3' ' A' ' 27' ' ' CYS . 15.4 m-85 -61.24 -160.49 0.01 OUTLIER 'General case' 0 CA--C 1.53 0.209 0 CA-C-O 120.985 0.422 . . . . 0.0 111.46 -179.878 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 14.6 ttm-85 -50.08 -36.4 29.24 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 116.012 -0.54 . . . . 0.0 111.298 -179.905 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 154.44 34.08 0.03 OUTLIER Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.634 -0.793 . . . . 0.0 112.592 -179.974 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 31.8 mmtt -110.82 -20.58 12.42 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.924 0.392 . . . . 0.0 110.822 179.944 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -136.55 145.18 44.73 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.862 179.975 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . 0.933 ' HB2' HD13 ' A' ' 23' ' ' ILE . 0.1 OUTLIER -93.29 130.25 39.09 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.284 -0.416 . . . . 0.0 111.006 -179.799 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -69.27 127.67 33.89 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.547 179.679 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' CYS . . . . . 0.58 ' SG ' ' HB ' ' A' ' 21' ' ' THR . 6.8 t -131.44 132.78 44.58 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.169 -179.649 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . 0.586 ' HG2' ' HA ' ' A' ' 5' ' ' CYS . 0.0 OUTLIER . . . . . 0 C--O 1.25 1.083 0 CA-C-O 118.23 -0.891 . . . . 0.0 110.94 179.951 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.485 1.323 0 CA-C-O 120.921 0.391 . . . . 0.0 111.302 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 9.7 t-80 -60.95 105.93 0.53 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.076 -0.511 . . . . 0.0 111.104 -179.986 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 5.6 t80 -65.09 169.47 5.41 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.824 179.76 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 1.1 m120 -74.88 81.33 2.14 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 121.181 0.515 . . . . 0.0 110.532 179.71 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 1.2 m -111.64 -64.14 1.33 Allowed 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.482 -0.781 . . . . 0.0 111.086 -179.527 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 9.4 p -54.25 -15.0 0.98 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.215 0 CA-C-N 115.942 -0.572 . . . . 0.0 111.324 179.833 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -44.96 -53.31 7.81 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.914 -0.585 . . . . 0.0 111.592 -179.785 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -96.5 -22.26 17.21 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.395 -0.366 . . . . 0.0 111.072 -179.791 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 133.77 45.6 0.11 Allowed Glycine 0 N--CA 1.452 -0.275 0 C-N-CA 120.887 -0.673 . . . . 0.0 112.257 -179.957 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -99.71 174.27 26.66 Favored Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.784 -0.722 . . . . 0.0 112.731 -179.738 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 3.0 tp60 -149.29 154.43 39.01 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.778 0.323 . . . . 0.0 110.702 179.922 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . 0.453 ' HB3' ' HB2' ' A' ' 27' ' ' CYS . 0.0 OUTLIER -105.12 133.7 49.46 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.853 179.968 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . 0.496 HD13 ' HD3' ' A' ' 18' ' ' PRO . 3.4 mp -135.5 157.35 47.11 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.198 -0.456 . . . . 0.0 111.155 -179.672 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' TYR . . . . . 0.454 ' CD1' ' HB2' ' A' ' 32' ' ' ALA . 22.9 m-85 -74.6 -10.9 59.99 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.882 179.874 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -124.7 -179.7 4.62 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.687 179.992 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -54.75 144.36 22.52 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.165 179.88 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 8.1 m -45.63 142.99 3.21 Favored Pre-proline 0 C--N 1.331 -0.202 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.34 -179.876 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . 0.496 ' HD3' HD13 ' A' ' 13' ' ' LEU . 74.4 Cg_endo -79.05 -80.7 0.0 OUTLIER 'Trans proline' 0 C--N 1.345 0.386 0 C-N-CA 122.541 2.161 . . . . 0.0 112.384 179.997 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' ILE . . . . . 0.463 ' H ' ' HG2' ' A' ' 18' ' ' PRO . 0.9 OUTLIER -56.56 -170.34 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.535 0.402 0 CA-C-N 116.493 -0.321 . . . . 0.0 111.576 179.779 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' PHE . . . . . 0.454 ' N ' HG23 ' A' ' 19' ' ' ILE . 1.3 p90 -76.0 35.56 0.13 Allowed 'General case' 0 N--CA 1.463 0.183 0 CA-C-O 120.711 0.291 . . . . 0.0 111.417 179.987 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . 0.407 ' H ' ' C ' ' A' ' 19' ' ' ILE . 0.7 OUTLIER -82.09 -165.96 1.13 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.512 -0.313 . . . . 0.0 110.87 179.77 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . 0.807 ' HG3' HE22 ' A' ' 24' ' ' GLN . 0.0 OUTLIER -151.23 130.33 12.65 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.895 0.379 . . . . 0.0 110.479 179.636 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' ILE . . . . . 0.701 HG13 ' HB2' ' A' ' 33' ' ' LYS . 0.0 OUTLIER -81.27 133.12 29.97 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-N 116.158 -0.474 . . . . 0.0 111.206 -179.514 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' GLN . . . . . 0.807 HE22 ' HG3' ' A' ' 22' ' ' LYS . 0.0 OUTLIER -107.75 -66.98 0.99 Allowed 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.581 -0.736 . . . . 0.0 111.088 -179.84 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -132.04 -130.04 3.09 Favored Glycine 0 N--CA 1.452 -0.289 0 C-N-CA 120.769 -0.729 . . . . 0.0 112.56 -179.927 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . 0.591 ' HA ' ' HA ' ' A' ' 33' ' ' LYS . 44.4 p -125.11 153.67 42.61 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.054 0.455 . . . . 0.0 111.502 -179.807 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' CYS . . . . . 0.453 ' HB2' ' HB3' ' A' ' 12' ' ' CYS . 0.1 OUTLIER -100.56 -84.52 0.43 Allowed 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.558 -0.747 . . . . 0.0 111.299 -179.684 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 22.6 m-85 -61.12 -160.52 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.726 -0.67 . . . . 0.0 111.861 -179.447 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 10.7 ttt85 -49.72 -34.55 19.17 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 115.786 -0.643 . . . . 0.0 111.096 -179.918 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 149.6 22.07 0.07 OUTLIER Glycine 0 N--CA 1.451 -0.357 0 C-N-CA 120.646 -0.787 . . . . 0.0 112.738 179.81 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -98.93 -10.89 22.18 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.755 0.312 . . . . 0.0 110.968 179.881 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . 0.454 ' HB2' ' CD1' ' A' ' 14' ' ' TYR . . . -144.51 146.83 32.61 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.288 -0.415 . . . . 0.0 111.156 179.987 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . 0.701 ' HB2' HG13 ' A' ' 23' ' ' ILE . 0.0 OUTLIER -99.86 141.52 32.57 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.789 179.914 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -74.72 144.04 43.87 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.028 -0.533 . . . . 0.0 111.718 -179.404 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' CYS . . . . . 0.493 ' SG ' ' HE2' ' A' ' 33' ' ' LYS . 84.7 m -134.98 143.89 47.09 Favored 'General case' 0 C--N 1.332 -0.154 0 CA-C-N 115.806 -0.634 . . . . 0.0 110.55 179.59 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . 0.69 ' HE2' HE21 ' A' ' 24' ' ' GLN . 0.0 OUTLIER . . . . . 0 C--O 1.248 1.017 0 CA-C-O 118.252 -0.88 . . . . 0.0 111.081 179.962 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 74.7 m-20 . . . . . 0 N--CA 1.486 1.338 0 CA-C-O 120.805 0.336 . . . . 0.0 111.154 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 11.5 t-160 -60.24 96.08 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.059 -0.518 . . . . 0.0 110.943 179.986 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 9.7 t80 -57.51 172.66 0.33 Allowed 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.047 179.946 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 5.1 m120 -77.3 76.91 3.84 Favored 'General case' 0 N--CA 1.448 -0.541 0 CA-C-O 121.248 0.547 . . . . 0.0 110.577 179.778 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -110.08 -64.69 1.23 Allowed 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.384 -0.825 . . . . 0.0 110.392 179.788 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -54.59 -16.84 1.73 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.177 0 CA-C-N 115.915 -0.584 . . . . 0.0 111.1 179.47 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 40.0 t -45.5 -40.46 8.5 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 115.846 -0.615 . . . . 0.0 111.212 -179.984 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -115.16 -0.77 13.17 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.777 179.957 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 113.07 34.7 1.77 Allowed Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 120.798 -0.715 . . . . 0.0 112.551 179.877 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -86.22 170.85 43.51 Favored Glycine 0 N--CA 1.451 -0.359 0 C-N-CA 120.809 -0.71 . . . . 0.0 112.559 -179.946 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -150.12 156.48 41.72 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.823 0.344 . . . . 0.0 110.854 179.977 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 0.2 OUTLIER -75.77 117.02 17.08 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.232 -179.88 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . 0.566 ' HG ' ' HD3' ' A' ' 18' ' ' PRO . 1.5 mm? -102.92 105.9 16.35 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.231 179.238 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 7.3 m-85 -50.82 -20.56 1.33 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.361 -179.714 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -125.55 176.11 7.08 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.805 179.827 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -52.52 146.29 10.13 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.108 -0.496 . . . . 0.0 111.047 179.912 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . 0.416 ' HA ' ' HD3' ' A' ' 18' ' ' PRO . 0.0 OUTLIER -45.2 122.07 5.02 Favored Pre-proline 0 C--N 1.33 -0.239 0 CA-C-N 115.939 -0.573 . . . . 0.0 111.255 -179.765 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . 0.566 ' HD3' ' HG ' ' A' ' 13' ' ' LEU . 58.2 Cg_endo -88.43 -72.5 0.0 OUTLIER 'Trans proline' 0 N--CA 1.456 -0.732 0 C-N-CA 122.788 2.326 . . . . 0.0 112.524 -179.829 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' ILE . . . . . 0.701 HG12 ' H ' ' A' ' 20' ' ' PHE . 9.0 tt -55.92 -176.01 0.02 OUTLIER 'Isoleucine or valine' 0 CA--C 1.533 0.306 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.457 179.967 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' PHE . . . . . 0.701 ' H ' HG12 ' A' ' 19' ' ' ILE . 0.6 OUTLIER -76.62 32.17 0.13 Allowed 'General case' 0 C--N 1.33 -0.249 0 N-CA-C 112.032 0.382 . . . . 0.0 112.032 -179.391 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . 0.44 ' HB ' ' H ' ' A' ' 22' ' ' LYS . 0.9 OUTLIER -83.37 -154.3 0.15 Allowed 'General case' 0 C--N 1.332 -0.161 0 CA-C-O 120.575 0.226 . . . . 0.0 110.693 179.322 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . 0.44 ' H ' ' HB ' ' A' ' 21' ' ' THR . 0.1 OUTLIER -158.01 105.58 1.96 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.546 -0.297 . . . . 0.0 110.675 179.694 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' ILE . . . . . 0.564 ' HB ' ' SG ' ' A' ' 35' ' ' CYS . 0.0 OUTLIER -64.75 137.78 24.33 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.238 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.737 -179.999 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -112.77 -69.84 0.84 Allowed 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.72 179.822 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -127.68 -143.58 5.74 Favored Glycine 0 N--CA 1.45 -0.426 0 C-N-CA 120.92 -0.657 . . . . 0.0 112.487 179.986 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -115.77 143.65 45.09 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.042 0.449 . . . . 0.0 111.429 -179.845 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' CYS . . . . . 0.435 ' HB3' ' H ' ' A' ' 28' ' ' TYR . 2.1 t -81.89 -88.39 0.08 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.805 -0.634 . . . . 0.0 110.629 179.835 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' TYR . . . . . 0.435 ' H ' ' HB3' ' A' ' 27' ' ' CYS . 15.7 m-85 -62.12 -153.41 0.01 OUTLIER 'General case' 0 CA--C 1.532 0.262 0 CA-C-N 116.076 -0.511 . . . . 0.0 111.459 179.824 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -50.17 -35.86 27.95 Favored 'General case' 0 C--N 1.333 -0.119 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.577 -179.766 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 149.5 28.27 0.06 OUTLIER Glycine 0 N--CA 1.452 -0.295 0 C-N-CA 120.585 -0.817 . . . . 0.0 112.699 -179.943 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 1.6 mttp -102.12 -26.31 13.41 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.928 0.394 . . . . 0.0 110.607 179.871 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -122.75 139.74 53.65 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.922 179.943 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . 0.476 ' HE2' HG13 ' A' ' 23' ' ' ILE . 14.5 mtpt -92.59 120.86 33.44 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.363 -0.38 . . . . 0.0 110.743 179.918 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -64.13 111.71 2.68 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.01 -0.541 . . . . 0.0 111.033 -179.822 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' CYS . . . . . 0.564 ' SG ' ' HB ' ' A' ' 23' ' ' ILE . 1.8 m -106.69 138.44 42.86 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.821 -179.896 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.048 0 CA-C-O 118.213 -0.899 . . . . 0.0 111.055 179.72 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 9.1 t70 . . . . . 0 N--CA 1.486 1.372 0 CA-C-O 120.846 0.355 . . . . 0.0 111.161 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -59.95 117.42 5.04 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.794 -179.939 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 2.4 t80 -64.93 156.44 31.11 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.591 179.894 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 6.4 p-10 -72.15 83.94 1.01 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 121.309 0.576 . . . . 0.0 111.324 -179.618 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' CYS . . . . . 0.416 ' HA ' ' HG2' ' A' ' 36' ' ' LYS . 0.0 OUTLIER -97.76 -65.21 0.98 Allowed 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.475 -0.784 . . . . 0.0 110.009 179.38 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 14.6 p -53.9 -18.4 2.23 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 115.141 -0.936 . . . . 0.0 111.389 179.676 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 6.8 t -42.19 -48.73 4.89 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 115.975 -0.557 . . . . 0.0 111.532 -179.632 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -111.84 -22.23 11.22 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.375 -0.375 . . . . 0.0 110.794 179.868 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 133.17 53.25 0.08 OUTLIER Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.934 -0.65 . . . . 0.0 112.258 -179.962 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -89.98 -178.54 44.7 Favored Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.823 -0.703 . . . . 0.0 112.69 -179.762 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -149.32 141.19 23.7 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.748 0.309 . . . . 0.0 110.649 -179.962 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -93.2 125.79 37.97 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.912 -179.936 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -123.51 155.18 38.04 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.771 179.867 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 85.8 m-85 -82.47 -31.38 29.41 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.978 -179.808 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -104.1 171.98 7.05 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.793 179.926 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -54.9 149.55 11.38 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.064 -0.517 . . . . 0.0 111.242 -179.931 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . 0.425 ' HA ' ' HD3' ' A' ' 18' ' ' PRO . 0.1 OUTLIER -45.43 123.53 5.68 Favored Pre-proline 0 C--N 1.33 -0.278 0 CA-C-N 115.692 -0.686 . . . . 0.0 111.051 179.932 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . 0.425 ' HD3' ' HA ' ' A' ' 17' ' ' CYS . 42.2 Cg_endo -90.63 -72.96 0.0 OUTLIER 'Trans proline' 0 N--CA 1.456 -0.723 0 C-N-CA 122.876 2.384 . . . . 0.0 112.864 -179.51 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' ILE . . . . . 0.659 HG13 ' H ' ' A' ' 20' ' ' PHE . 1.6 tp -56.13 -170.97 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.536 0.407 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.617 -179.728 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' PHE . . . . . 0.659 ' H ' HG13 ' A' ' 19' ' ' ILE . 4.5 p90 -71.03 23.12 0.04 OUTLIER 'General case' 0 CA--C 1.531 0.236 0 N-CA-C 112.227 0.455 . . . . 0.0 112.227 -179.347 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . 0.451 ' H ' ' C ' ' A' ' 19' ' ' ILE . 0.8 OUTLIER -81.91 -165.73 1.06 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.537 0.208 . . . . 0.0 110.642 179.406 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . 0.405 ' H ' ' HB ' ' A' ' 21' ' ' THR . 40.0 tttp -161.97 117.31 1.97 Allowed 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 120.876 0.369 . . . . 0.0 111.13 179.928 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' ILE . . . . . 0.431 ' HB ' ' NZ ' ' A' ' 33' ' ' LYS . 0.8 OUTLIER -67.45 135.74 27.94 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.853 179.745 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' GLN . . . . . 0.58 ' HB2' ' NZ ' ' A' ' 36' ' ' LYS . 1.7 mp0 -114.7 -42.43 3.26 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.895 -0.593 . . . . 0.0 110.826 -179.924 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -154.54 -131.32 1.49 Allowed Glycine 0 N--CA 1.451 -0.363 0 C-N-CA 120.899 -0.667 . . . . 0.0 112.371 179.922 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . 0.601 ' HA ' ' HA ' ' A' ' 33' ' ' LYS . 15.6 p -122.49 141.15 51.95 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.841 0.353 . . . . 0.0 111.177 179.886 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' CYS . . . . . 0.466 ' HB3' ' H ' ' A' ' 28' ' ' TYR . 0.2 OUTLIER -82.99 -91.29 0.08 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.013 -0.54 . . . . 0.0 111.056 -179.842 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' TYR . . . . . 0.466 ' H ' ' HB3' ' A' ' 27' ' ' CYS . 23.7 m-85 -60.94 -168.02 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.166 0 CA-C-O 120.962 0.411 . . . . 0.0 111.206 -179.985 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 5.4 ttt-85 -50.39 -35.86 30.17 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 115.985 -0.552 . . . . 0.0 111.301 -179.938 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 159.66 44.39 0.02 OUTLIER Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.676 -0.773 . . . . 0.0 112.593 179.962 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 9.8 mtpt -119.73 -14.16 9.05 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.896 0.379 . . . . 0.0 110.651 179.798 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -154.35 147.27 24.48 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.668 179.858 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . 0.601 ' HA ' ' HA ' ' A' ' 26' ' ' THR . 0.0 OUTLIER -92.08 146.03 24.05 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.977 0.418 . . . . 0.0 110.937 -179.843 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 0.2 OUTLIER -77.63 135.2 38.09 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.895 -0.593 . . . . 0.0 111.091 -179.74 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 0.9 OUTLIER -136.57 128.97 30.16 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.972 179.88 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . 0.58 ' NZ ' ' HB2' ' A' ' 24' ' ' GLN . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.054 0 CA-C-O 118.245 -0.883 . . . . 0.0 110.748 179.802 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.485 1.325 0 CA-C-O 120.849 0.357 . . . . 0.0 111.032 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 7.2 t-80 -60.04 107.32 0.61 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.709 179.847 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 2.4 t80 -63.81 167.29 6.18 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.619 179.834 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 1.4 t-20 -80.47 76.91 7.29 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.344 0.592 . . . . 0.0 110.265 179.567 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' CYS . . . . . 0.645 ' HA ' ' HD2' ' A' ' 36' ' ' LYS . 0.0 OUTLIER -101.3 -63.54 1.13 Allowed 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.085 -0.961 . . . . 0.0 110.643 -179.722 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 10.8 p -54.29 -16.91 1.6 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-N 115.827 -0.624 . . . . 0.0 111.134 179.586 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -38.03 -48.61 1.22 Allowed 'General case' 0 N--CA 1.462 0.174 0 CA-C-N 115.788 -0.642 . . . . 0.0 111.89 -179.725 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -109.28 -29.05 8.66 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.433 -0.349 . . . . 0.0 111.095 -179.916 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 142.69 45.52 0.05 OUTLIER Glycine 0 N--CA 1.452 -0.249 0 C-N-CA 120.804 -0.713 . . . . 0.0 112.428 -179.924 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -97.91 169.21 24.08 Favored Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.732 -0.747 . . . . 0.0 112.567 -179.882 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 12.7 mt-30 -143.11 148.86 37.3 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.75 0.31 . . . . 0.0 110.63 179.978 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . 0.494 ' HA ' ' O ' ' A' ' 33' ' ' LYS . 0.0 OUTLIER -103.0 125.11 49.62 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.297 -0.411 . . . . 0.0 111.222 -179.903 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -122.62 143.56 49.68 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.41 179.623 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 26.8 m-85 -60.31 -10.58 4.87 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.351 -0.386 . . . . 0.0 111.261 -179.755 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -114.07 155.69 25.5 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.788 179.613 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -54.95 157.82 3.06 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.284 179.823 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . 0.434 ' HB2' HG22 ' A' ' 23' ' ' ILE . 0.1 OUTLIER -44.91 112.08 1.42 Allowed Pre-proline 0 C--N 1.327 -0.39 0 CA-C-N 115.452 -0.794 . . . . 0.0 111.2 179.926 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 60.9 Cg_endo -87.78 -72.46 0.0 OUTLIER 'Trans proline' 0 N--CA 1.457 -0.619 0 C-N-CA 122.724 2.282 . . . . 0.0 112.664 -179.839 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' ILE . . . . . 0.587 HG12 ' H ' ' A' ' 20' ' ' PHE . 4.6 tt -56.37 -169.85 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.534 0.34 0 CA-C-N 116.321 -0.4 . . . . 0.0 111.588 -179.979 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' PHE . . . . . 0.587 ' H ' HG12 ' A' ' 19' ' ' ILE . 5.8 p90 -76.64 36.01 0.16 Allowed 'General case' 0 CA--C 1.53 0.179 0 N-CA-C 111.859 0.318 . . . . 0.0 111.859 -179.616 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . 0.436 ' HB ' ' HB3' ' A' ' 35' ' ' CYS . 0.3 OUTLIER -88.08 -161.21 0.7 Allowed 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.662 0.268 . . . . 0.0 110.758 179.39 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . 0.422 ' H ' ' HB ' ' A' ' 21' ' ' THR . 1.4 tttm -157.58 103.1 1.91 Allowed 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.86 0.362 . . . . 0.0 111.028 -179.931 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' ILE . . . . . 0.524 HD13 ' HB3' ' A' ' 33' ' ' LYS . 1.4 tp -69.67 131.91 33.63 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.224 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.994 179.745 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' GLN . . . . . 0.502 ' HB2' ' HE3' ' A' ' 36' ' ' LYS . 18.6 mt-30 -114.29 -66.5 1.08 Allowed 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.125 179.346 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -125.52 167.07 17.99 Favored Glycine 0 N--CA 1.449 -0.478 0 CA-C-N 115.511 -0.768 . . . . 0.0 111.401 179.175 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 1.7 p -75.77 154.62 36.19 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 121.261 0.553 . . . . 0.0 111.16 -179.955 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' CYS . . . . . 0.493 ' HB3' ' H ' ' A' ' 28' ' ' TYR . 5.4 t -84.35 -96.15 0.06 Allowed 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.317 -0.856 . . . . 0.0 111.252 -179.55 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' TYR . . . . . 0.493 ' H ' ' HB3' ' A' ' 27' ' ' CYS . 61.7 m-85 -61.65 -144.06 0.0 OUTLIER 'General case' 0 CA--C 1.534 0.349 0 CA-C-N 115.982 -0.554 . . . . 0.0 111.628 -179.796 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . 0.403 ' HD2' HH11 ' A' ' 29' ' ' ARG . 7.6 mtt180 -48.16 -42.82 30.63 Favored 'General case' 0 C--O 1.232 0.133 0 CA-C-O 120.801 0.334 . . . . 0.0 111.402 -179.625 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 153.39 24.62 0.04 OUTLIER Glycine 0 N--CA 1.451 -0.363 0 C-N-CA 120.767 -0.73 . . . . 0.0 112.566 -179.94 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -99.86 -40.85 7.49 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.75 0.309 . . . . 0.0 110.932 179.953 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -97.76 139.26 33.89 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.887 179.937 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . 0.524 ' HB3' HD13 ' A' ' 23' ' ' ILE . 0.8 OUTLIER -91.63 126.53 36.74 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.914 0.388 . . . . 0.0 110.881 -179.937 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -83.08 104.39 13.24 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.911 -0.586 . . . . 0.0 111.045 179.869 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' CYS . . . . . 0.519 ' SG ' ' HB ' ' A' ' 23' ' ' ILE . 30.4 m -98.24 144.13 28.0 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.742 179.947 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . 0.645 ' HD2' ' HA ' ' A' ' 5' ' ' CYS . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.073 0 CA-C-O 118.198 -0.906 . . . . 0.0 110.872 179.753 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 . . . . . 0 N--CA 1.487 1.399 0 CA-C-O 120.864 0.364 . . . . 0.0 111.185 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 6.0 t-80 -60.15 109.22 0.92 Allowed 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.673 179.942 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 5.7 t80 -57.5 158.8 5.47 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.744 179.962 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -70.24 82.41 0.53 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.215 0.531 . . . . 0.0 110.819 -179.916 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' CYS . . . . . 0.794 ' HA ' ' HG2' ' A' ' 36' ' ' LYS . 0.1 OUTLIER -100.8 -72.96 0.66 Allowed 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.475 -0.784 . . . . 0.0 110.29 179.596 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . 0.525 ' HA ' ' H ' ' A' ' 10' ' ' GLY . 9.9 p -54.0 -17.58 1.83 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 115.621 -0.718 . . . . 0.0 111.247 179.452 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -45.03 -48.65 11.67 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-N 115.834 -0.621 . . . . 0.0 111.443 -179.895 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 55.2 p -115.18 -4.35 12.46 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.94 179.991 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 123.46 53.43 0.2 Allowed Glycine 0 N--CA 1.452 -0.284 0 C-N-CA 120.725 -0.75 . . . . 0.0 112.494 179.886 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . 0.525 ' H ' ' HA ' ' A' ' 6' ' ' VAL . . . -97.09 171.16 26.75 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.804 -0.712 . . . . 0.0 112.467 -179.972 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 6.1 tp-100 -148.6 145.93 28.02 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.806 0.336 . . . . 0.0 110.911 -179.999 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . 0.458 ' HB3' ' HB2' ' A' ' 27' ' ' CYS . 0.1 OUTLIER -100.6 110.71 22.87 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.04 -179.893 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . 0.46 ' O ' ' HG3' ' A' ' 33' ' ' LYS . 11.0 mt -119.67 147.64 44.31 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.918 179.891 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 1.4 m-85 -88.86 16.29 7.12 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.957 179.934 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . 0.452 ' O ' ' HD3' ' A' ' 33' ' ' LYS . 8.5 p -139.79 158.4 44.15 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.89 179.908 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -48.79 140.66 8.3 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.381 -179.879 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . 0.43 ' HA ' ' HD3' ' A' ' 18' ' ' PRO . 0.2 OUTLIER -45.96 123.88 6.53 Favored Pre-proline 0 C--N 1.332 -0.176 0 CA-C-N 115.888 -0.596 . . . . 0.0 111.379 -179.875 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . 0.43 ' HD3' ' HA ' ' A' ' 17' ' ' CYS . 56.8 Cg_endo -89.38 -73.65 0.0 OUTLIER 'Trans proline' 0 N--CA 1.455 -0.747 0 C-N-CA 122.895 2.396 . . . . 0.0 112.69 -179.812 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' ILE . . . . . 0.667 HG12 ' H ' ' A' ' 20' ' ' PHE . 6.6 tt -56.47 -174.21 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.535 0.375 0 CA-C-N 116.492 -0.322 . . . . 0.0 111.567 -179.894 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' PHE . . . . . 0.667 ' H ' HG12 ' A' ' 19' ' ' ILE . 50.8 p90 -70.1 17.63 0.06 Allowed 'General case' 0 CA--C 1.531 0.224 0 N-CA-C 112.472 0.545 . . . . 0.0 112.472 -179.285 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . 0.513 ' OG1' HG22 ' A' ' 19' ' ' ILE . 0.7 OUTLIER -74.91 -174.24 2.15 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.744 0.307 . . . . 0.0 110.683 179.417 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . 0.484 ' HG3' ' HZ1' ' A' ' 36' ' ' LYS . 10.0 ptmt -147.31 127.65 13.95 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.999 179.807 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' ILE . . . . . 0.707 ' HB ' ' HE3' ' A' ' 33' ' ' LYS . 0.2 OUTLIER -81.26 119.78 31.56 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.645 179.802 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' GLN . . . . . 0.704 ' HB2' ' HE2' ' A' ' 36' ' ' LYS . 0.9 OUTLIER -95.75 -46.72 6.47 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.763 -179.892 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -152.06 -127.13 1.28 Allowed Glycine 0 N--CA 1.45 -0.391 0 C-N-CA 120.9 -0.667 . . . . 0.0 112.226 179.838 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . 0.576 ' HA ' ' HA ' ' A' ' 33' ' ' LYS . 17.0 p -131.96 138.76 48.44 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.864 0.364 . . . . 0.0 111.16 179.844 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' CYS . . . . . 0.458 ' HB2' ' HB3' ' A' ' 12' ' ' CYS . 0.1 OUTLIER -71.85 -85.09 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.903 179.995 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' TYR . . . . . 0.414 ' H ' ' HB3' ' A' ' 27' ' ' CYS . 8.5 m-85 -60.84 -168.46 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.193 179.916 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 10.7 tpt180 -50.22 -31.9 15.14 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.049 -0.523 . . . . 0.0 111.148 179.934 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 157.38 36.9 0.02 OUTLIER Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 120.795 -0.717 . . . . 0.0 112.58 179.98 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 1.7 mtpp -113.2 -8.63 13.53 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.804 0.335 . . . . 0.0 110.776 179.886 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -150.86 151.39 32.16 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.288 179.989 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . 0.707 ' HE3' ' HB ' ' A' ' 23' ' ' ILE . 0.0 OUTLIER -97.97 139.59 33.58 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.753 -0.658 . . . . 0.0 110.739 179.827 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 34' ' ' CYS . . . . . 0.47 ' O ' ' HA ' ' A' ' 23' ' ' ILE . 0.0 OUTLIER -87.76 134.26 33.71 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.913 179.981 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 35' ' ' CYS . . . . . 0.581 ' SG ' ' HE3' ' A' ' 33' ' ' LYS . 1.0 OUTLIER -130.94 125.73 34.22 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.169 -179.971 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . 0.794 ' HG2' ' HA ' ' A' ' 5' ' ' CYS . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.047 0 CA-C-O 118.199 -0.905 . . . . 0.0 110.75 179.661 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 N--CA 1.486 1.342 0 CA-C-O 120.827 0.346 . . . . 0.0 111.152 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' HIS . . . . . 0.504 ' HE1' HG12 ' A' ' 6' ' ' VAL . 11.7 t-80 -60.36 107.5 0.67 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.109 -179.856 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 10.4 t80 -62.87 160.89 13.74 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.742 179.642 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 6.7 t-20 -64.09 91.58 0.07 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.222 0.534 . . . . 0.0 110.213 179.623 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -119.51 -75.87 0.58 Allowed 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.485 -0.78 . . . . 0.0 109.71 179.928 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . 0.504 HG12 ' HE1' ' A' ' 2' ' ' HIS . 8.1 p -54.68 -13.72 0.84 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.191 0 CA-C-N 115.76 -0.655 . . . . 0.0 110.688 178.794 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 41.3 t -38.58 -50.89 1.62 Allowed 'General case' 0 N--CA 1.462 0.146 0 CA-C-N 115.76 -0.654 . . . . 0.0 111.288 179.926 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -110.75 -22.95 11.32 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.903 -0.589 . . . . 0.0 110.75 179.957 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 147.88 41.23 0.04 OUTLIER Glycine 0 N--CA 1.452 -0.273 0 C-N-CA 120.736 -0.745 . . . . 0.0 112.536 179.937 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . 0.483 ' H ' ' HA ' ' A' ' 6' ' ' VAL . . . -88.53 170.54 38.78 Favored Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.821 -0.704 . . . . 0.0 112.55 179.993 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -143.74 145.76 32.65 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.787 0.327 . . . . 0.0 110.887 -179.937 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . 0.445 ' C ' HD22 ' A' ' 13' ' ' LEU . 1.9 m -95.88 134.68 38.58 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.861 179.934 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . 0.445 HD22 ' C ' ' A' ' 12' ' ' CYS . 3.8 mm? -122.75 152.22 40.82 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.849 -179.874 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 90.5 m-85 -88.39 4.54 45.92 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.696 179.833 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . 0.468 ' O ' ' HD2' ' A' ' 33' ' ' LYS . 5.6 t -153.99 -176.22 5.75 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.858 179.954 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -49.8 137.49 16.24 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.048 -0.524 . . . . 0.0 111.38 -179.945 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . 0.406 ' HA ' ' HD3' ' A' ' 18' ' ' PRO . 0.1 OUTLIER -45.86 146.05 2.13 Favored Pre-proline 0 C--N 1.332 -0.183 0 CA-C-N 115.952 -0.567 . . . . 0.0 111.316 179.982 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . 0.406 ' HD3' ' HA ' ' A' ' 17' ' ' CYS . 53.0 Cg_endo -90.94 -80.37 0.0 OUTLIER 'Trans proline' 0 N--CA 1.454 -0.795 0 C-N-CA 122.969 2.446 . . . . 0.0 112.656 -179.754 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' ILE . . . . . 0.643 HG12 ' H ' ' A' ' 20' ' ' PHE . 6.1 tt -56.17 -172.38 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.534 0.346 0 CA-C-N 116.375 -0.375 . . . . 0.0 111.664 -179.866 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' PHE . . . . . 0.643 ' H ' HG12 ' A' ' 19' ' ' ILE . 0.2 OUTLIER -75.84 36.6 0.14 Allowed 'General case' 0 CA--C 1.531 0.236 0 N-CA-C 111.947 0.351 . . . . 0.0 111.947 -179.533 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . 0.432 ' OG1' HG22 ' A' ' 19' ' ' ILE . 0.0 OUTLIER -85.81 -162.95 0.79 Allowed 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 120.526 0.203 . . . . 0.0 110.657 179.354 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . 0.588 ' HG3' HE22 ' A' ' 24' ' ' GLN . 2.1 pttt -155.66 122.22 5.25 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.937 0.399 . . . . 0.0 111.527 -179.907 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' ILE . . . . . 0.463 ' HB ' ' HE3' ' A' ' 33' ' ' LYS . 0.3 OUTLIER -75.66 125.72 35.6 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.47 179.434 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' GLN . . . . . 0.588 HE22 ' HG3' ' A' ' 22' ' ' LYS . 1.6 mp0 -103.48 -44.07 5.23 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.174 -0.467 . . . . 0.0 111.104 -179.739 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -146.89 -143.69 3.91 Favored Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.739 -0.743 . . . . 0.0 112.627 -179.92 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . 0.786 ' HA ' ' HA ' ' A' ' 33' ' ' LYS . 0.0 OUTLIER -120.14 140.41 51.13 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.851 0.357 . . . . 0.0 111.217 -179.908 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 41.6 t -85.97 -80.5 0.23 Allowed 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.89 179.913 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 2.9 m-85 -60.27 -173.72 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.813 -0.63 . . . . 0.0 110.943 179.932 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -50.57 -28.13 8.06 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.934 179.772 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 161.76 10.42 0.04 OUTLIER Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.886 -0.673 . . . . 0.0 112.536 179.954 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -96.74 -16.01 21.09 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.754 0.312 . . . . 0.0 111.161 -179.886 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . 0.405 ' O ' HG22 ' A' ' 26' ' ' THR . . . -134.93 150.45 50.4 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.828 179.912 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . 0.786 ' HA ' ' HA ' ' A' ' 26' ' ' THR . 0.0 OUTLIER -108.57 143.1 38.05 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.832 179.9 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -79.09 125.4 29.36 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.637 179.97 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -126.15 140.12 52.82 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.818 -179.896 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . 0.435 ' HE3' ' HB2' ' A' ' 24' ' ' GLN . 0.0 OUTLIER . . . . . 0 C--O 1.248 1.021 0 CA-C-O 118.22 -0.895 . . . . 0.0 110.895 179.798 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.487 1.377 0 CA-C-O 120.8 0.333 . . . . 0.0 111.224 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 2.0 t-80 -59.98 109.25 0.91 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.844 -179.935 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 9.1 t80 -61.38 167.5 3.24 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.688 179.737 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -77.65 77.27 4.17 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.235 0.541 . . . . 0.0 110.684 179.813 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 0.4 OUTLIER -103.89 -76.29 0.6 Allowed 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.298 -0.865 . . . . 0.0 110.494 179.943 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . 0.64 ' HA ' ' H ' ' A' ' 10' ' ' GLY . 7.5 p -54.13 -17.76 2.04 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.153 0 CA-C-N 116.019 -0.537 . . . . 0.0 111.126 179.579 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -45.34 -59.04 2.89 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 115.834 -0.621 . . . . 0.0 111.552 -179.912 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 52.4 p -98.81 -20.11 17.05 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.367 -0.379 . . . . 0.0 111.245 -179.643 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 144.49 53.81 0.03 OUTLIER Glycine 0 N--CA 1.452 -0.267 0 C-N-CA 120.688 -0.768 . . . . 0.0 112.605 -179.963 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . 0.64 ' H ' ' HA ' ' A' ' 6' ' ' VAL . . . -105.02 159.79 15.53 Favored Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.78 -0.724 . . . . 0.0 112.465 179.924 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 1.2 mt-30 -125.25 153.21 43.54 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.761 0.315 . . . . 0.0 110.909 -179.926 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . 0.449 ' C ' HD22 ' A' ' 13' ' ' LEU . 3.1 m -118.59 119.7 35.28 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.086 -179.773 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . 0.449 HD22 ' C ' ' A' ' 12' ' ' CYS . 3.2 mm? -124.82 159.1 31.81 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.722 179.928 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 34.2 m-85 -88.56 -5.52 58.14 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.341 -0.39 . . . . 0.0 111.165 -179.921 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . 0.441 ' O ' ' HD3' ' A' ' 33' ' ' LYS . 2.4 t -128.4 -179.3 4.95 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.372 -0.377 . . . . 0.0 110.917 -179.877 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -48.84 141.64 7.25 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.087 179.966 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . 0.419 ' HA ' ' HD3' ' A' ' 18' ' ' PRO . 0.9 OUTLIER -45.63 141.63 3.85 Favored Pre-proline 0 C--N 1.329 -0.318 0 CA-C-N 115.907 -0.588 . . . . 0.0 111.455 -179.756 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . 0.419 ' HD3' ' HA ' ' A' ' 17' ' ' CYS . 38.9 Cg_endo -89.84 -81.59 0.0 OUTLIER 'Trans proline' 0 N--CA 1.453 -0.885 0 C-N-CA 122.91 2.407 . . . . 0.0 112.357 179.94 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' ILE . . . . . 0.71 HG13 ' H ' ' A' ' 20' ' ' PHE . 4.3 tp -56.57 -173.95 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.535 0.393 0 CA-C-N 116.406 -0.361 . . . . 0.0 111.638 179.976 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' PHE . . . . . 0.71 ' H ' HG13 ' A' ' 19' ' ' ILE . 7.5 p90 -71.62 21.36 0.05 Allowed 'General case' 0 CA--C 1.535 0.371 0 N-CA-C 112.939 0.718 . . . . 0.0 112.939 -178.876 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . 0.492 ' OG1' HG22 ' A' ' 19' ' ' ILE . 0.2 OUTLIER -75.71 -172.21 1.81 Allowed 'General case' 0 N--CA 1.463 0.187 0 C-N-CA 121.051 -0.259 . . . . 0.0 110.86 179.288 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 6.4 tttp -145.94 111.59 5.53 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 120.789 0.328 . . . . 0.0 111.093 -179.749 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' ILE . . . . . 0.487 ' HB ' ' HE3' ' A' ' 33' ' ' LYS . 0.2 OUTLIER -58.72 123.97 11.91 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.189 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.009 -179.96 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -99.36 -25.6 14.42 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.84 179.923 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -178.74 -116.87 0.52 Allowed Glycine 0 N--CA 1.451 -0.358 0 C-N-CA 120.828 -0.701 . . . . 0.0 112.391 179.957 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . 0.707 ' HA ' ' HA ' ' A' ' 33' ' ' LYS . 1.0 OUTLIER -133.78 143.57 48.49 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.983 0.42 . . . . 0.0 111.352 -179.961 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 10.4 t -81.9 -79.3 0.18 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.903 -0.59 . . . . 0.0 110.968 179.973 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 11.3 m-85 -61.28 -160.5 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.002 -0.545 . . . . 0.0 111.427 -179.928 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 12.0 mtm180 -50.13 -39.2 42.37 Favored 'General case' 0 C--N 1.332 -0.156 0 CA-C-N 115.997 -0.547 . . . . 0.0 111.18 -179.944 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 159.26 33.16 0.02 OUTLIER Glycine 0 N--CA 1.451 -0.328 0 C-N-CA 120.811 -0.709 . . . . 0.0 112.486 179.937 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 2.0 mmpt? -107.77 -32.08 7.78 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.894 0.378 . . . . 0.0 110.788 -179.971 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -121.3 150.67 41.07 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.013 -0.54 . . . . 0.0 110.875 179.932 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . 0.707 ' HA ' ' HA ' ' A' ' 26' ' ' THR . 0.0 OUTLIER -90.32 145.39 25.01 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.985 -179.872 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 34' ' ' CYS . . . . . 0.416 ' O ' ' HA ' ' A' ' 23' ' ' ILE . 0.0 OUTLIER -95.03 135.7 36.24 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.976 179.948 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 35' ' ' CYS . . . . . 0.579 ' SG ' ' HE3' ' A' ' 33' ' ' LYS . 1.1 m -129.26 140.27 51.51 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.046 -0.525 . . . . 0.0 110.57 179.93 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . 0.607 ' HE3' ' H ' ' A' ' 36' ' ' LYS . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.07 0 CA-C-O 118.179 -0.915 . . . . 0.0 111.063 179.844 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.486 1.354 0 CA-C-O 120.82 0.343 . . . . 0.0 111.302 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 2.0 t-80 -59.61 109.92 1.02 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.674 179.815 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 6.5 t80 -63.89 160.51 17.44 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.752 179.897 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -71.83 82.77 0.9 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.184 0.516 . . . . 0.0 110.546 179.727 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -99.66 -67.43 0.85 Allowed 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.469 -0.787 . . . . 0.0 110.498 179.948 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 4.2 p -54.78 -15.5 1.31 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.516 179.645 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -42.63 -52.98 4.65 Favored 'General case' 0 N--CA 1.464 0.252 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.518 -179.646 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 10.7 p -101.73 -1.21 33.0 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.903 -179.904 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 112.89 30.36 2.8 Favored Glycine 0 N--CA 1.451 -0.328 0 C-N-CA 120.7 -0.762 . . . . 0.0 112.168 -179.868 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -84.49 165.01 40.31 Favored Glycine 0 N--CA 1.45 -0.388 0 C-N-CA 120.849 -0.691 . . . . 0.0 112.711 -179.869 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -146.38 142.6 28.37 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.643 0.259 . . . . 0.0 110.674 179.94 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . 0.459 ' HA ' ' O ' ' A' ' 33' ' ' LYS . 0.0 OUTLIER -97.1 122.54 40.21 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.887 0.375 . . . . 0.0 111.173 -179.868 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -117.02 147.36 42.4 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.729 179.785 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -51.0 -33.96 27.17 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.059 -0.519 . . . . 0.0 111.4 -179.609 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -108.65 163.26 13.41 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.793 179.957 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -52.86 155.2 2.46 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.543 179.473 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . 0.518 ' SG ' ' HB ' ' A' ' 23' ' ' ILE . 3.1 m -44.93 138.66 4.11 Favored Pre-proline 0 C--N 1.327 -0.41 0 CA-C-N 115.901 -0.591 . . . . 0.0 111.342 -179.573 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . 0.433 ' HD3' ' HA ' ' A' ' 17' ' ' CYS . 50.2 Cg_endo -88.28 -71.87 0.01 OUTLIER 'Trans proline' 0 N--CA 1.454 -0.837 0 C-N-CA 122.996 2.464 . . . . 0.0 111.801 179.62 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' ILE . . . . . 0.458 ' C ' ' H ' ' A' ' 21' ' ' THR . 1.5 tt -56.97 -168.76 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.535 0.396 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.036 179.177 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' PHE . . . . . 0.45 ' N ' HG23 ' A' ' 19' ' ' ILE . 2.1 p90 -73.43 23.43 0.07 Allowed 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.583 0.23 . . . . 0.0 111.538 179.917 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . 0.458 ' H ' ' C ' ' A' ' 19' ' ' ILE . 0.2 OUTLIER -65.23 -169.45 0.05 OUTLIER 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 120.766 0.317 . . . . 0.0 111.116 179.844 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -156.15 111.0 2.88 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.701 179.996 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' ILE . . . . . 0.769 HG13 ' HB3' ' A' ' 33' ' ' LYS . 0.0 OUTLIER -75.9 132.66 32.73 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-O 121.044 0.45 . . . . 0.0 111.202 -179.779 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' GLN . . . . . 0.464 ' NE2' ' HE2' ' A' ' 36' ' ' LYS . 0.3 OUTLIER -92.98 -43.57 8.86 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.719 -0.673 . . . . 0.0 110.37 179.42 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -159.47 -138.76 2.53 Favored Glycine 0 N--CA 1.45 -0.399 0 CA-C-N 115.613 -0.721 . . . . 0.0 112.05 179.942 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . 0.411 HG22 ' HE3' ' A' ' 33' ' ' LYS . 4.1 p -120.71 145.34 47.58 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 120.89 0.376 . . . . 0.0 111.028 179.775 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -80.89 -88.4 0.08 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.971 -179.929 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 8.0 m-85 -61.23 -161.69 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.231 179.908 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -50.29 -34.38 23.24 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.972 179.956 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 151.93 48.6 0.02 OUTLIER Glycine 0 N--CA 1.452 -0.27 0 C-N-CA 120.801 -0.714 . . . . 0.0 112.466 179.878 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -116.43 -35.05 4.39 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.769 0.318 . . . . 0.0 110.917 179.968 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -123.79 140.59 52.83 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.221 -179.973 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . 0.769 ' HB3' HG13 ' A' ' 23' ' ' ILE . 1.0 OUTLIER -85.74 130.68 34.5 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.879 -179.953 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -80.82 112.23 18.01 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.534 179.703 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 35' ' ' CYS . . . . . 0.527 ' SG ' ' HB ' ' A' ' 23' ' ' ILE . 68.8 m -113.46 151.37 31.52 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.949 -0.568 . . . . 0.0 110.522 179.982 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . 0.464 ' HE2' ' NE2' ' A' ' 24' ' ' GLN . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.027 0 CA-C-O 118.232 -0.89 . . . . 0.0 110.93 179.704 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 18.4 m-20 . . . . . 0 N--CA 1.486 1.371 0 CA-C-O 120.81 0.338 . . . . 0.0 111.165 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' HIS . . . . . 0.444 ' CE1' HG12 ' A' ' 6' ' ' VAL . 4.1 t-80 -60.35 110.2 1.19 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.841 -179.984 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 3.4 t80 -58.93 150.77 23.45 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.402 179.623 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' ASN . . . . . 0.507 ' OD1' ' HB2' ' A' ' 7' ' ' SER . 4.4 t30 -64.5 86.41 0.05 OUTLIER 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.274 0.559 . . . . 0.0 110.562 179.947 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' CYS . . . . . 0.436 ' HA ' ' HG2' ' A' ' 36' ' ' LYS . 0.1 OUTLIER -116.82 -74.54 0.6 Allowed 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.449 -0.796 . . . . 0.0 110.103 -179.991 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . 0.449 ' HA ' ' H ' ' A' ' 10' ' ' GLY . 5.5 p -55.65 -8.17 0.4 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.192 0 CA-C-N 115.946 -0.57 . . . . 0.0 111.21 178.95 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . 0.507 ' HB2' ' OD1' ' A' ' 4' ' ' ASN . 2.3 t -31.61 -54.02 0.26 Allowed 'General case' 0 N--CA 1.464 0.227 0 CA-C-N 115.755 -0.657 . . . . 0.0 111.553 -179.702 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -115.34 -40.19 3.47 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.695 -0.684 . . . . 0.0 110.754 179.826 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 178.38 41.48 0.07 OUTLIER Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 120.965 -0.636 . . . . 0.0 112.236 -179.975 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . 0.449 ' H ' ' HA ' ' A' ' 6' ' ' VAL . . . -94.3 162.77 24.9 Favored Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 120.818 -0.706 . . . . 0.0 112.682 -179.798 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 2.1 pt20 -150.25 150.61 31.77 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.736 0.303 . . . . 0.0 110.675 179.988 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . 0.51 ' HB3' ' HB2' ' A' ' 27' ' ' CYS . 0.0 OUTLIER -98.45 114.69 27.15 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.948 0.404 . . . . 0.0 111.384 -179.893 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . 0.422 HD22 ' HG3' ' A' ' 18' ' ' PRO . 0.2 OUTLIER -99.69 133.99 43.23 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.211 179.429 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER -53.27 -21.92 6.18 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.398 -0.365 . . . . 0.0 111.184 -179.792 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -114.32 159.24 20.44 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.585 179.618 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -53.22 155.87 2.51 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.332 -0.395 . . . . 0.0 111.131 179.891 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -39.6 112.52 0.78 Allowed Pre-proline 0 C--N 1.328 -0.331 0 CA-C-N 115.427 -0.806 . . . . 0.0 111.749 -179.563 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . 0.422 ' HG3' HD22 ' A' ' 13' ' ' LEU . 60.5 Cg_endo -83.56 -72.6 0.01 OUTLIER 'Trans proline' 0 N--CA 1.459 -0.519 0 C-N-CA 122.689 2.26 . . . . 0.0 112.281 179.784 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' ILE . . . . . 0.439 ' C ' ' H ' ' A' ' 21' ' ' THR . 1.2 tt -56.46 -172.8 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.534 0.334 0 CA-C-N 116.408 -0.36 . . . . 0.0 111.375 179.741 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' PHE . . . . . 0.431 ' N ' HG23 ' A' ' 19' ' ' ILE . 38.0 p90 -72.92 24.56 0.06 Allowed 'General case' 0 CA--C 1.53 0.205 0 N-CA-C 111.983 0.364 . . . . 0.0 111.983 -179.66 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . 0.439 ' H ' ' C ' ' A' ' 19' ' ' ILE . 0.8 OUTLIER -76.88 -162.99 0.31 Allowed 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.626 0.25 . . . . 0.0 110.669 179.527 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . 0.402 ' H ' ' HB ' ' A' ' 21' ' ' THR . 8.1 pttp -155.14 111.82 3.24 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.92 0.391 . . . . 0.0 111.0 179.813 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' ILE . . . . . 0.963 HG13 ' HB3' ' A' ' 33' ' ' LYS . 0.0 OUTLIER -74.53 131.41 35.02 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.869 -179.979 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' GLN . . . . . 0.491 ' HB2' ' HZ2' ' A' ' 36' ' ' LYS . 2.2 mp0 -100.56 -39.38 7.94 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.053 -0.522 . . . . 0.0 110.72 179.68 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -157.15 -151.17 5.92 Favored Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.823 -0.703 . . . . 0.0 112.381 -179.986 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . 0.871 HG23 ' HE3' ' A' ' 33' ' ' LYS . 0.0 OUTLIER -115.24 149.48 37.68 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.012 0.434 . . . . 0.0 111.208 -179.931 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' CYS . . . . . 0.51 ' HB2' ' HB3' ' A' ' 12' ' ' CYS . 0.0 OUTLIER -91.4 -87.59 0.2 Allowed 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.764 -0.653 . . . . 0.0 111.199 -179.891 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' TYR . . . . . 0.41 ' H ' ' HB3' ' A' ' 27' ' ' CYS . 5.0 m-85 -61.08 -164.01 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.496 -179.743 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -50.24 -33.03 18.22 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.952 -0.567 . . . . 0.0 111.199 -179.907 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 151.35 41.12 0.03 OUTLIER Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 120.673 -0.775 . . . . 0.0 112.742 179.851 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 23.5 mtpt -115.57 -24.39 8.33 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.748 0.309 . . . . 0.0 110.975 179.882 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -129.96 141.82 50.72 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.13 179.97 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . 0.963 ' HB3' HG13 ' A' ' 23' ' ' ILE . 1.5 mmpt? -93.99 133.66 37.2 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.05 -179.982 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -77.31 117.56 18.93 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.382 179.574 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 35' ' ' CYS . . . . . 0.563 ' SG ' ' HB ' ' A' ' 23' ' ' ILE . 20.1 m -118.35 146.13 44.61 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.026 -179.579 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . 0.491 ' HZ2' ' HB2' ' A' ' 24' ' ' GLN . 5.2 mtmm . . . . . 0 C--O 1.249 1.037 0 CA-C-O 118.29 -0.862 . . . . 0.0 110.851 179.624 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.486 1.368 0 CA-C-O 120.827 0.346 . . . . 0.0 111.154 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 8.7 t-80 -60.71 100.82 0.12 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.028 -0.533 . . . . 0.0 111.037 -179.921 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 10.8 t80 -67.2 174.64 3.07 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.717 179.669 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 4' ' ' ASN . . . . . 0.519 ' O ' ' ND2' ' A' ' 4' ' ' ASN . 0.8 OUTLIER -77.1 89.14 3.6 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 121.635 0.731 . . . . 0.0 110.117 179.508 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -118.06 -78.54 0.58 Allowed 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.313 -0.858 . . . . 0.0 109.345 179.954 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . 0.793 ' HA ' ' H ' ' A' ' 10' ' ' GLY . 10.4 p -54.47 -20.27 4.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 115.672 -0.695 . . . . 0.0 110.112 178.248 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 10.4 t -44.86 -43.19 8.59 Favored 'General case' 0 C--O 1.232 0.171 0 CA-C-N 115.29 -0.868 . . . . 0.0 111.406 179.989 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 23.0 p -97.53 -36.37 10.33 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.076 -179.793 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 153.85 50.29 0.01 OUTLIER Glycine 0 N--CA 1.453 -0.218 0 C-N-CA 120.686 -0.768 . . . . 0.0 112.531 -179.937 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . 0.793 ' H ' ' HA ' ' A' ' 6' ' ' VAL . . . -120.9 -177.14 15.63 Favored Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.768 -0.73 . . . . 0.0 112.578 -179.973 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 32.9 mt-30 -147.1 150.83 35.78 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 120.851 0.358 . . . . 0.0 111.138 -179.946 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 3.2 m -96.79 122.67 40.01 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.389 179.483 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 3.3 mt -132.75 159.01 40.94 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.377 -0.374 . . . . 0.0 111.07 -179.681 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 28.2 m-85 -88.34 -9.93 51.12 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.924 -179.923 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 1.6 m -113.56 167.12 10.86 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.134 -179.862 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -52.98 147.3 9.5 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.04 -0.527 . . . . 0.0 111.318 -179.942 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -45.6 120.7 5.07 Favored Pre-proline 0 C--N 1.328 -0.351 0 CA-C-N 115.666 -0.697 . . . . 0.0 111.469 -179.89 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 58.9 Cg_endo -84.01 -75.42 0.0 OUTLIER 'Trans proline' 0 N--CA 1.458 -0.579 0 C-N-CA 122.599 2.2 . . . . 0.0 112.455 179.876 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 19' ' ' ILE . . . . . 0.476 HG22 ' OG1' ' A' ' 21' ' ' THR . 0.3 OUTLIER -56.36 -172.48 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.534 0.34 0 CA-C-N 116.493 -0.322 . . . . 0.0 111.478 179.956 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 20' ' ' PHE . . . . . 0.426 ' N ' HG23 ' A' ' 19' ' ' ILE . 3.0 p90 -75.34 33.5 0.11 Allowed 'General case' 0 CA--C 1.531 0.227 0 N-CA-C 112.113 0.412 . . . . 0.0 112.113 -179.398 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . 0.476 ' OG1' HG22 ' A' ' 19' ' ' ILE . 0.6 OUTLIER -90.52 -168.95 2.24 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.761 0.315 . . . . 0.0 110.64 179.306 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . 0.539 ' HG3' HE22 ' A' ' 24' ' ' GLN . 11.6 ptpt -151.95 129.86 11.73 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.264 -0.426 . . . . 0.0 110.819 179.649 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 23' ' ' ILE . . . . . 0.699 ' HB ' ' HE3' ' A' ' 33' ' ' LYS . 0.2 OUTLIER -80.76 127.45 39.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.846 -179.811 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 24' ' ' GLN . . . . . 0.539 HE22 ' HG3' ' A' ' 22' ' ' LYS . 0.0 OUTLIER -105.68 -35.89 7.25 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.813 -0.63 . . . . 0.0 110.894 -179.734 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -161.21 -128.05 0.92 Allowed Glycine 0 N--CA 1.451 -0.362 0 C-N-CA 120.788 -0.72 . . . . 0.0 112.503 179.974 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . 0.472 ' HA ' ' HA ' ' A' ' 33' ' ' LYS . 40.9 p -127.72 150.37 49.81 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.992 0.425 . . . . 0.0 111.145 -179.947 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 15.0 t -93.75 -83.59 0.32 Allowed 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.776 -0.647 . . . . 0.0 111.186 -179.671 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 43.2 m-85 -60.85 -169.45 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.59 -179.658 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 12.9 mtp180 -45.92 -44.03 14.34 Favored 'General case' 0 N--CA 1.462 0.135 0 CA-C-N 115.876 -0.602 . . . . 0.0 111.377 -179.866 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 163.1 48.37 0.02 OUTLIER Glycine 0 N--CA 1.452 -0.285 0 C-N-CA 120.635 -0.793 . . . . 0.0 112.649 179.983 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 30.5 mttt -128.97 -18.62 3.73 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.844 0.354 . . . . 0.0 111.009 179.976 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -136.0 147.58 48.04 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.056 179.917 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . 0.699 ' HE3' ' HB ' ' A' ' 23' ' ' ILE . 0.0 OUTLIER -91.58 148.09 22.53 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.815 -179.979 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -94.45 126.27 39.62 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.905 -0.589 . . . . 0.0 111.272 -179.798 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 35' ' ' CYS . . . . . 0.53 ' SG ' ' HE3' ' A' ' 33' ' ' LYS . 0.8 OUTLIER -122.51 143.63 49.59 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.411 179.506 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . 0.536 ' HE2' ' HB2' ' A' ' 24' ' ' GLN . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.058 0 CA-C-O 118.236 -0.888 . . . . 0.0 111.087 -179.894 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.486 1.372 0 CA-C-O 120.802 0.334 . . . . 0.0 111.198 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 8.6 t-80 -60.47 101.09 0.12 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.889 179.88 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 3' ' ' TYR . . . . . 0.418 ' HB3' ' SG ' ' A' ' 5' ' ' CYS . 2.2 t80 -62.16 163.56 7.99 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.275 179.703 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 19.2 t-20 -79.21 74.36 5.78 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 121.491 0.662 . . . . 0.0 110.525 179.807 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 5' ' ' CYS . . . . . 0.78 ' HA ' ' HG2' ' A' ' 36' ' ' LYS . 0.0 OUTLIER -104.49 -55.83 2.29 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 114.984 -1.007 . . . . 0.0 109.934 179.696 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . 0.53 ' HA ' ' N ' ' A' ' 10' ' ' GLY . 1.6 p -55.68 -8.08 0.39 Allowed 'Isoleucine or valine' 0 CA--C 1.53 0.182 0 CA-C-N 115.713 -0.676 . . . . 0.0 111.404 179.048 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . 0.422 ' H ' ' C ' ' A' ' 5' ' ' CYS . 4.2 t -35.58 -52.95 0.68 Allowed 'General case' 0 N--CA 1.464 0.24 0 CA-C-N 115.877 -0.602 . . . . 0.0 111.72 -179.472 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 8.6 p -115.04 -10.98 12.17 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.861 -179.942 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 145.16 31.44 0.08 OUTLIER Glycine 0 N--CA 1.45 -0.39 0 C-N-CA 120.854 -0.688 . . . . 0.0 112.304 -179.84 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . 0.53 ' N ' ' HA ' ' A' ' 6' ' ' VAL . . . -62.27 175.38 7.0 Favored Glycine 0 N--CA 1.45 -0.429 0 C-N-CA 120.905 -0.664 . . . . 0.0 112.527 -179.974 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 3.2 pt20 -150.26 156.82 42.28 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.895 0.378 . . . . 0.0 111.175 -179.831 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 3.3 m -128.17 111.61 13.63 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.79 179.864 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 1.1 pt? -140.14 148.51 41.75 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.97 179.949 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 27.2 m-85 -63.31 -33.01 74.58 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.03 -0.532 . . . . 0.0 111.462 -179.58 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -79.7 148.96 31.35 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.39 -0.368 . . . . 0.0 111.316 -179.682 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . 0.452 ' HA ' ' HD3' ' A' ' 33' ' ' LYS . . . -55.16 154.79 5.34 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.118 179.698 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -41.4 122.9 2.2 Favored Pre-proline 0 C--N 1.327 -0.377 0 CA-C-N 115.397 -0.819 . . . . 0.0 111.786 -179.635 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 59.3 Cg_endo -86.98 -77.14 0.0 OUTLIER 'Trans proline' 0 N--CA 1.456 -0.694 0 C-N-CA 122.771 2.314 . . . . 0.0 112.314 179.609 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 19' ' ' ILE . . . . . 0.483 HG22 ' OG1' ' A' ' 21' ' ' THR . 0.3 OUTLIER -56.54 -171.74 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.535 0.367 0 CA-C-N 116.452 -0.34 . . . . 0.0 111.387 179.727 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 20' ' ' PHE . . . . . 0.448 ' N ' HG23 ' A' ' 19' ' ' ILE . 0.7 OUTLIER -71.25 19.38 0.06 Allowed 'General case' 0 CA--C 1.531 0.238 0 N-CA-C 112.414 0.524 . . . . 0.0 112.414 -179.426 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . 0.483 ' OG1' HG22 ' A' ' 19' ' ' ILE . 0.3 OUTLIER -73.99 -170.57 0.94 Allowed 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.761 0.315 . . . . 0.0 110.625 179.388 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . 0.476 ' HG2' ' OXT' ' A' ' 36' ' ' LYS . 0.7 OUTLIER -150.76 122.73 8.18 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.79 179.822 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 23' ' ' ILE . . . . . 0.883 ' HB ' ' HE3' ' A' ' 33' ' ' LYS . 0.2 OUTLIER -71.61 130.18 35.2 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-O 120.975 0.416 . . . . 0.0 110.402 179.913 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 24' ' ' GLN . . . . . 0.691 HE21 ' HE2' ' A' ' 36' ' ' LYS . 0.0 OUTLIER -111.95 -4.56 14.5 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.856 -0.611 . . . . 0.0 111.13 -179.298 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 163.82 -135.4 3.77 Favored Glycine 0 N--CA 1.45 -0.412 0 C-N-CA 120.879 -0.677 . . . . 0.0 112.229 -179.993 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . 0.671 ' HA ' ' HA ' ' A' ' 33' ' ' LYS . 1.2 p -127.3 149.71 49.91 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 121.029 0.442 . . . . 0.0 111.286 179.883 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 27' ' ' CYS . . . . . 0.417 ' HB3' ' H ' ' A' ' 28' ' ' TYR . 4.2 t -88.08 -82.47 0.23 Allowed 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.607 -0.724 . . . . 0.0 111.014 -179.691 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 28' ' ' TYR . . . . . 0.417 ' H ' ' HB3' ' A' ' 27' ' ' CYS . 60.8 m-85 -61.13 -165.95 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.682 -179.841 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -49.22 -42.43 40.39 Favored 'General case' 0 C--N 1.333 -0.139 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.337 -179.813 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 163.94 50.21 0.02 OUTLIER Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.724 -0.75 . . . . 0.0 112.557 179.896 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -124.78 -37.96 2.42 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.78 0.324 . . . . 0.0 110.835 179.948 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -121.54 145.92 47.47 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.887 179.921 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . 0.883 ' HE3' ' HB ' ' A' ' 23' ' ' ILE . 0.0 OUTLIER -94.98 145.56 24.85 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.835 -179.941 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 34' ' ' CYS . . . . . 0.674 ' HB3' HE22 ' A' ' 24' ' ' GLN . 0.0 OUTLIER -90.66 142.96 27.21 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.208 -179.969 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 35' ' ' CYS . . . . . 0.577 ' SG ' ' HE3' ' A' ' 33' ' ' LYS . 1.2 m -138.68 142.07 39.0 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.973 179.933 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . 0.78 ' HG2' ' HA ' ' A' ' 5' ' ' CYS . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.066 0 CA-C-O 118.217 -0.897 . . . . 0.0 110.987 179.803 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 17.9 m-20 . . . . . 0 N--CA 1.486 1.368 0 CA-C-O 120.857 0.36 . . . . 0.0 111.271 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 15.2 t-80 -59.89 104.35 0.29 Allowed 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.936 179.991 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 6.0 t80 -61.15 174.58 0.65 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.958 -0.564 . . . . 0.0 110.693 179.731 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -79.55 79.37 6.03 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 121.264 0.554 . . . . 0.0 110.274 179.569 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -109.21 -65.01 1.18 Allowed 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.3 -0.864 . . . . 0.0 110.691 -179.748 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . 0.52 ' HA ' ' H ' ' A' ' 10' ' ' GLY . 0.3 OUTLIER -53.93 -17.83 1.93 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 115.672 -0.694 . . . . 0.0 111.143 179.923 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -45.46 -35.99 4.14 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-N 115.916 -0.584 . . . . 0.0 111.183 179.899 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -114.89 -13.7 11.95 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.801 179.845 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 123.81 41.58 0.41 Allowed Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.85 -0.691 . . . . 0.0 112.496 -179.973 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . 0.52 ' H ' ' HA ' ' A' ' 6' ' ' VAL . . . -92.23 174.89 37.4 Favored Glycine 0 N--CA 1.452 -0.284 0 C-N-CA 120.785 -0.721 . . . . 0.0 112.417 179.978 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 1.2 tt0 -147.45 150.87 35.44 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.764 0.316 . . . . 0.0 110.874 179.919 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . 0.436 ' C ' HD22 ' A' ' 13' ' ' LEU . 1.7 m -93.49 139.37 30.8 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.132 -0.485 . . . . 0.0 111.264 -179.71 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . 0.436 HD22 ' C ' ' A' ' 12' ' ' CYS . 3.2 mm? -126.35 142.41 51.54 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.459 179.657 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 2.0 m-85 -74.67 -1.91 23.9 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.396 -0.366 . . . . 0.0 111.209 -179.761 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . 0.505 ' O ' ' HD2' ' A' ' 33' ' ' LYS . 0.4 OUTLIER -149.91 -179.05 6.83 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.813 179.852 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -44.97 137.18 4.28 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.213 179.984 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . 0.452 ' SG ' ' HD2' ' A' ' 18' ' ' PRO . 0.5 OUTLIER -45.49 141.77 3.61 Favored Pre-proline 0 C--N 1.33 -0.268 0 CA-C-N 115.919 -0.582 . . . . 0.0 111.691 -179.568 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . 0.452 ' HD2' ' SG ' ' A' ' 17' ' ' CYS . 68.3 Cg_endo -79.3 -83.92 0.0 OUTLIER 'Trans proline' 0 C--N 1.348 0.545 0 C-N-CA 122.618 2.212 . . . . 0.0 112.641 -179.982 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 19' ' ' ILE . . . . . 0.475 HG12 ' H ' ' A' ' 20' ' ' PHE . 3.6 tt -56.17 -176.07 0.02 OUTLIER 'Isoleucine or valine' 0 CA--C 1.533 0.308 0 CA-C-O 120.784 0.326 . . . . 0.0 111.593 -179.768 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 20' ' ' PHE . . . . . 0.475 ' H ' HG12 ' A' ' 19' ' ' ILE . 0.4 OUTLIER -76.3 35.19 0.14 Allowed 'General case' 0 C--N 1.331 -0.205 0 N-CA-C 111.996 0.369 . . . . 0.0 111.996 -179.368 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . 0.467 ' HB ' ' H ' ' A' ' 22' ' ' LYS . 0.0 OUTLIER -75.9 -152.46 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.792 -0.185 . . . . 0.0 110.507 179.441 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . 0.467 ' H ' ' HB ' ' A' ' 21' ' ' THR . 8.0 ttmm -160.45 108.59 1.63 Allowed 'General case' 0 C--O 1.231 0.122 0 CA-C-O 120.859 0.361 . . . . 0.0 111.838 -179.744 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 23' ' ' ILE . . . . . 0.911 HD13 ' HB2' ' A' ' 33' ' ' LYS . 0.1 OUTLIER -66.12 133.21 31.29 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.197 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.852 179.344 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 24' ' ' GLN . . . . . 0.676 ' HB2' ' NZ ' ' A' ' 36' ' ' LYS . 0.0 OUTLIER -114.54 -68.53 0.92 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.614 179.537 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -121.98 164.19 15.16 Favored Glycine 0 N--CA 1.452 -0.295 0 C-N-CA 121.032 -0.604 . . . . 0.0 111.931 179.632 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . 0.591 ' HA ' ' HA ' ' A' ' 33' ' ' LYS . 1.0 OUTLIER -75.5 153.02 37.76 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.07 0.462 . . . . 0.0 111.622 -179.802 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 18.4 t -100.67 -78.74 0.51 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.655 -0.702 . . . . 0.0 110.911 -179.903 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 3.4 m-85 -60.3 -174.69 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.989 179.931 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 20.0 ttm-85 -50.6 -25.86 4.67 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.873 179.783 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 156.26 9.59 0.06 OUTLIER Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.971 -0.633 . . . . 0.0 112.162 179.851 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -98.64 -14.01 20.06 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.685 0.279 . . . . 0.0 111.11 -179.858 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -138.51 141.95 39.35 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.411 -0.359 . . . . 0.0 110.555 179.896 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . 0.911 ' HB2' HD13 ' A' ' 23' ' ' ILE . 0.0 OUTLIER -107.53 141.71 38.55 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.95 0.405 . . . . 0.0 110.776 -179.889 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -84.11 131.27 34.8 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.025 -0.534 . . . . 0.0 111.668 -179.466 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -115.9 156.33 26.36 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 115.774 -0.648 . . . . 0.0 111.089 179.907 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . 0.676 ' NZ ' ' HB2' ' A' ' 24' ' ' GLN . 0.1 OUTLIER . . . . . 0 C--O 1.249 1.051 0 CA-C-O 118.412 -0.804 . . . . 0.0 111.005 -179.792 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.487 1.381 0 CA-C-O 120.78 0.324 . . . . 0.0 111.213 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 6.3 t-80 -60.28 108.3 0.78 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.853 179.999 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 6.1 t80 -62.51 169.73 2.83 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.986 179.847 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 1.7 m120 -76.01 86.46 2.92 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.083 0.468 . . . . 0.0 110.764 179.89 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -114.93 -74.58 0.61 Allowed 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.652 -0.704 . . . . 0.0 110.441 179.862 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . 0.43 ' HA ' ' H ' ' A' ' 10' ' ' GLY . 7.3 p -54.23 -15.34 1.08 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 115.67 -0.695 . . . . 0.0 111.05 179.467 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -44.18 -57.12 3.61 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-N 115.901 -0.59 . . . . 0.0 111.386 -179.932 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 1.2 m -99.81 -27.81 13.44 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.872 179.986 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 147.23 53.09 0.02 OUTLIER Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.78 -0.724 . . . . 0.0 112.432 -179.926 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . 0.43 ' H ' ' HA ' ' A' ' 6' ' ' VAL . . . -121.53 166.86 14.32 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.849 -0.691 . . . . 0.0 112.386 -179.973 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 1.9 tp60 -147.96 151.63 36.14 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.742 0.306 . . . . 0.0 110.398 179.86 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . 0.423 ' HB3' ' HB3' ' A' ' 27' ' ' CYS . 1.6 m -65.58 120.91 13.77 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.865 0.364 . . . . 0.0 111.093 -179.742 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . 0.522 ' HB3' ' O ' ' A' ' 15' ' ' SER . 0.4 OUTLIER -99.74 109.85 22.27 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.934 -0.576 . . . . 0.0 110.478 179.752 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 14' ' ' TYR . . . . . 0.42 ' HA ' ' HB2' ' A' ' 32' ' ' ALA . 5.2 m-85 -52.89 -19.96 2.96 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.015 -0.539 . . . . 0.0 111.096 -179.893 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . 0.522 ' O ' ' HB3' ' A' ' 13' ' ' LEU . 0.7 OUTLIER -133.19 169.94 16.15 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.16 179.368 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -50.75 142.67 10.94 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.568 -0.287 . . . . 0.0 110.743 179.852 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -44.97 126.35 5.33 Favored Pre-proline 0 C--N 1.331 -0.203 0 CA-C-N 116.132 -0.485 . . . . 0.0 111.237 -179.571 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 59.1 Cg_endo -90.05 -72.67 0.0 OUTLIER 'Trans proline' 0 N--CA 1.456 -0.724 0 C-N-CA 122.978 2.452 . . . . 0.0 112.74 -179.554 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 19' ' ' ILE . . . . . 0.765 HG13 ' H ' ' A' ' 20' ' ' PHE . 5.2 tp -56.02 -172.92 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.533 0.292 0 CA-C-N 116.344 -0.389 . . . . 0.0 111.501 -179.86 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 20' ' ' PHE . . . . . 0.765 ' H ' HG13 ' A' ' 19' ' ' ILE . 8.1 p90 -74.47 33.13 0.09 Allowed 'General case' 0 C--N 1.331 -0.205 0 N-CA-C 111.693 0.257 . . . . 0.0 111.693 -179.765 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . 0.47 ' HB ' ' H ' ' A' ' 22' ' ' LYS . 0.6 OUTLIER -81.17 -150.78 0.08 Allowed 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.582 -0.281 . . . . 0.0 110.617 179.447 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . 0.776 ' HG3' HE22 ' A' ' 24' ' ' GLN . 2.6 tptp -167.11 108.71 0.65 Allowed 'General case' 0 C--N 1.332 -0.158 0 CA-C-O 120.798 0.333 . . . . 0.0 110.954 179.991 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 23' ' ' ILE . . . . . 0.68 HG13 ' HE2' ' A' ' 33' ' ' LYS . 0.0 OUTLIER -68.27 138.65 22.11 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.614 179.665 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 24' ' ' GLN . . . . . 0.776 HE22 ' HG3' ' A' ' 22' ' ' LYS . 0.0 OUTLIER -108.94 -69.93 0.83 Allowed 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.842 -179.984 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -131.51 -146.74 5.84 Favored Glycine 0 N--CA 1.451 -0.34 0 CA-C-N 115.689 -0.687 . . . . 0.0 112.159 179.995 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . 0.62 ' HA ' ' HA ' ' A' ' 33' ' ' LYS . 9.6 p -113.96 147.93 37.75 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 121.012 0.434 . . . . 0.0 111.338 -179.942 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 27' ' ' CYS . . . . . 0.423 ' HB3' ' HB3' ' A' ' 12' ' ' CYS . 51.7 t -94.15 -92.8 0.18 Allowed 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.705 -0.68 . . . . 0.0 111.016 -179.779 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 16.7 m-85 -61.4 -156.29 0.01 OUTLIER 'General case' 0 CA--C 1.53 0.193 0 CA-C-N 115.978 -0.555 . . . . 0.0 111.604 -179.858 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 3.4 mmm-85 -50.59 -43.94 56.71 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 115.978 -0.556 . . . . 0.0 111.364 -179.896 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 161.31 26.68 0.02 OUTLIER Glycine 0 N--CA 1.453 -0.217 0 C-N-CA 120.691 -0.766 . . . . 0.0 112.679 179.992 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -105.26 -15.16 15.13 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.887 0.375 . . . . 0.0 110.694 179.911 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . 0.42 ' HB2' ' HA ' ' A' ' 14' ' ' TYR . . . -140.84 126.69 19.26 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.737 -179.993 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . 0.68 ' HE2' HG13 ' A' ' 23' ' ' ILE . 0.0 OUTLIER -93.03 132.04 37.49 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.779 0.324 . . . . 0.0 110.778 179.877 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -55.72 120.16 6.87 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.715 179.82 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 35' ' ' CYS . . . . . 0.512 ' SG ' ' HB ' ' A' ' 23' ' ' ILE . 0.9 OUTLIER -122.2 141.74 51.15 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.017 -179.672 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.028 0 CA-C-O 118.223 -0.894 . . . . 0.0 110.901 179.844 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 19.4 m-20 . . . . . 0 N--CA 1.486 1.357 0 CA-C-O 120.821 0.343 . . . . 0.0 111.027 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 13.9 t-80 -60.91 94.91 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.09 179.841 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 21.0 t80 -65.01 161.53 18.53 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.655 179.572 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -60.75 100.02 0.1 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.347 0.594 . . . . 0.0 110.153 179.509 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 5' ' ' CYS . . . . . 0.743 ' HA ' ' HG2' ' A' ' 36' ' ' LYS . 0.1 OUTLIER -130.34 -82.42 0.54 Allowed 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.545 -0.752 . . . . 0.0 109.918 -179.712 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . 0.428 ' HA ' ' H ' ' A' ' 10' ' ' GLY . 7.1 p -54.49 -15.26 1.13 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.183 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.702 178.872 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -44.75 -47.09 10.77 Favored 'General case' 0 C--N 1.333 -0.14 0 CA-C-N 115.669 -0.696 . . . . 0.0 111.519 -179.91 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 3.3 p -114.12 -3.11 13.29 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.288 -0.415 . . . . 0.0 111.11 -179.847 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 124.38 38.23 0.53 Allowed Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 120.678 -0.772 . . . . 0.0 112.617 179.947 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . 0.428 ' H ' ' HA ' ' A' ' 6' ' ' VAL . . . -102.54 169.99 19.88 Favored Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.802 -0.714 . . . . 0.0 112.333 179.925 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -150.34 144.84 25.76 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.866 0.365 . . . . 0.0 110.928 179.9 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . 0.465 ' HB3' ' HB2' ' A' ' 27' ' ' CYS . 0.0 OUTLIER -92.47 136.05 33.54 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.006 179.866 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 1.9 mp -131.51 162.67 29.72 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.847 -179.885 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 59.3 m-85 -79.73 -45.19 19.35 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.944 -179.993 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -89.21 171.67 9.63 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.13 -179.861 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -55.21 152.53 8.01 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.079 -0.509 . . . . 0.0 111.459 179.994 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . 0.43 ' HA ' ' HD3' ' A' ' 18' ' ' PRO . 0.1 OUTLIER -45.36 127.05 6.02 Favored Pre-proline 0 C--N 1.329 -0.289 0 CA-C-N 115.603 -0.726 . . . . 0.0 111.373 -179.988 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . 0.43 ' HD3' ' HA ' ' A' ' 17' ' ' CYS . 57.1 Cg_endo -89.18 -78.62 0.0 OUTLIER 'Trans proline' 0 N--CA 1.456 -0.721 0 C-N-CA 122.758 2.305 . . . . 0.0 112.589 -179.953 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 19' ' ' ILE . . . . . 0.776 HG13 ' H ' ' A' ' 20' ' ' PHE . 5.4 tp -56.45 -171.93 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.535 0.371 0 CA-C-N 116.496 -0.32 . . . . 0.0 111.732 -179.793 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 20' ' ' PHE . . . . . 0.776 ' H ' HG13 ' A' ' 19' ' ' ILE . 2.1 p90 -69.77 19.8 0.04 OUTLIER 'General case' 0 N--CA 1.463 0.222 0 N-CA-C 112.314 0.487 . . . . 0.0 112.314 -179.315 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . 0.452 ' H ' ' C ' ' A' ' 19' ' ' ILE . 0.6 OUTLIER -73.25 -159.63 0.07 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.567 0.222 . . . . 0.0 110.651 179.473 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . 0.405 ' H ' ' HB ' ' A' ' 21' ' ' THR . 8.8 tptp -160.63 117.82 2.42 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.931 0.396 . . . . 0.0 111.421 -179.948 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 23' ' ' ILE . . . . . 0.58 HD12 ' HE3' ' A' ' 33' ' ' LYS . 0.6 OUTLIER -73.04 131.0 35.51 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.606 179.31 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 24' ' ' GLN . . . . . 0.885 ' HB2' ' HE2' ' A' ' 36' ' ' LYS . 1.7 tp-100 -113.31 -68.63 0.91 Allowed 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.618 179.915 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -126.54 -138.46 4.82 Favored Glycine 0 N--CA 1.45 -0.428 0 C-N-CA 120.847 -0.692 . . . . 0.0 112.074 179.697 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . 0.662 ' HA ' ' HA ' ' A' ' 33' ' ' LYS . 3.1 p -125.3 146.61 49.48 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 120.932 0.396 . . . . 0.0 111.17 179.93 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 27' ' ' CYS . . . . . 0.465 ' HB2' ' HB3' ' A' ' 12' ' ' CYS . 0.0 OUTLIER -86.44 -81.88 0.21 Allowed 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.808 -0.633 . . . . 0.0 111.169 -179.717 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 24.0 m-85 -61.02 -165.27 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.905 -0.589 . . . . 0.0 111.887 -179.598 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -50.52 -34.48 25.44 Favored 'General case' 0 C--N 1.333 -0.152 0 CA-C-N 115.87 -0.605 . . . . 0.0 111.419 -179.929 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 153.91 41.37 0.02 OUTLIER Glycine 0 N--CA 1.452 -0.235 0 C-N-CA 120.726 -0.75 . . . . 0.0 112.491 -179.915 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 15.2 mttm -116.76 -23.53 8.09 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.841 0.353 . . . . 0.0 110.88 179.923 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -136.33 145.67 45.72 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.911 179.952 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . 0.662 ' HA ' ' HA ' ' A' ' 26' ' ' THR . 0.0 OUTLIER -98.26 138.95 34.78 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.918 -179.875 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -78.07 138.29 38.69 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.753 179.958 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 35' ' ' CYS . . . . . 0.414 ' SG ' ' NZ ' ' A' ' 33' ' ' LYS . 1.2 m -125.88 131.5 52.35 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.965 -179.839 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . 0.885 ' HE2' ' HB2' ' A' ' 24' ' ' GLN . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.054 0 CA-C-O 118.247 -0.882 . . . . 0.0 110.919 179.908 . . . . . . . . 2 2 . 1 stop_ save_