data_1m8m_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 1m8m _Structure_validation_residue.Date_analyzed 2016-10-07 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 2.1 tp . . . . . 0 CA--C 1.526 0.049 0 CA-C-O 120.836 0.35 . . . . 0.0 110.831 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . 0.4 ' HA ' HG12 ' A' ' 58' ' ' VAL . 1.5 m -163.51 64.67 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.333 -0.146 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.092 179.908 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -61.06 159.31 11.91 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.189 -0.459 . . . . 0.0 111.005 179.941 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -71.91 -20.89 61.71 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.099 -0.501 . . . . 0.0 111.384 179.933 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . 0.428 HD12 ' CD2' ' A' ' 57' ' ' TYR . 0.5 OUTLIER 74.94 16.26 2.94 Favored 'General case' 0 N--CA 1.465 0.313 0 CA-C-N 116.33 -0.396 . . . . 0.0 111.277 179.96 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER 177.19 -77.72 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.181 0 CA-C-O 120.661 0.267 . . . . 0.0 110.97 179.851 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER 169.29 -34.17 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.442 -0.345 . . . . 0.0 110.905 -179.805 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' TYR . . . . . 0.432 ' CE2' HG11 ' A' ' 53' ' ' VAL . 19.4 t80 68.25 -62.58 0.36 Allowed 'General case' 0 N--CA 1.465 0.285 0 CA-C-N 116.145 -0.479 . . . . 0.0 111.265 -179.847 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 13.1 pt20 44.94 88.65 0.02 OUTLIER 'General case' 0 N--CA 1.463 0.201 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.391 -179.769 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 6.3 tp10 . . . . . 0 C--N 1.329 -0.287 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.969 179.918 . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.231 0.102 0 CA-C-O 120.732 0.301 . . . . 0.0 110.939 . . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 3.0 m -59.21 101.4 0.1 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.202 179.961 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 75.0 p -135.44 105.68 6.34 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 116.108 -0.497 . . . . 0.0 111.004 -179.849 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' MET . . . . . . . . . . . . . 1.8 mpp? -87.54 170.06 11.64 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.673 179.877 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 8.3 tptm -156.1 127.47 7.15 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.165 -179.824 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 10.8 ttmt 62.85 -79.79 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.147 179.896 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 179.16 61.05 0.08 OUTLIER Glycine 0 N--CA 1.452 -0.284 0 C-N-CA 120.667 -0.778 . . . . 0.0 112.44 -179.973 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 38.0 m-20 -83.97 4.16 31.0 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.565 0.221 . . . . 0.0 111.249 179.872 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 3.4 mm 57.66 172.21 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-O 120.972 0.415 . . . . 0.0 111.199 179.943 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . 0.608 ' N ' ' CD1' ' A' ' 31' ' ' LEU . 0.0 OUTLIER -173.78 151.12 1.78 Allowed 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.002 -0.544 . . . . 0.0 110.702 -179.184 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -79.59 175.72 10.36 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.207 179.607 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -173.08 173.07 3.76 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.009 0.433 . . . . 0.0 111.418 -179.788 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 1.3 tt -134.95 97.67 3.81 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.899 -0.591 . . . . 0.0 110.799 -179.944 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 9.8 m-20 62.2 -164.01 0.25 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.784 -179.924 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 4.4 m 69.56 43.36 1.01 Allowed 'General case' 0 N--CA 1.462 0.153 0 CA-C-O 120.897 0.38 . . . . 0.0 110.833 -179.891 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 54.0 m -110.14 -32.42 7.0 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.108 -0.497 . . . . 0.0 110.829 179.9 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 21.5 t-20 -113.54 -52.62 2.75 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.838 -179.981 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 4.6 ttmt -78.0 -58.37 3.3 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.902 179.947 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 19.4 m-20 -105.65 -176.12 2.99 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.854 179.976 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 41' ' ' TRP . . . . . 0.449 ' NE1' ' CZ2' ' A' ' 42' ' ' TRP . 11.9 p-90 -177.1 57.36 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.832 -179.972 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 42' ' ' TRP . . . . . 0.449 ' CZ2' ' NE1' ' A' ' 41' ' ' TRP . 1.8 m-90 -152.66 29.67 0.53 Allowed 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.982 -179.965 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 4.6 tttp -147.06 135.14 21.5 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.893 0.378 . . . . 0.0 111.165 -179.986 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 25.2 m -155.94 -174.97 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.914 179.811 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 31.9 tt0 -145.38 87.35 1.8 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.911 0.386 . . . . 0.0 110.902 179.942 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 20.1 t -80.11 -30.87 13.03 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.026 179.949 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 5.8 p30 -159.28 49.31 0.33 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.877 179.988 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 13.0 m-20 61.7 82.39 0.17 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.869 179.946 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -177.02 163.34 2.14 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.932 179.946 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 1.2 pt20 -69.93 86.12 0.52 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.814 179.919 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -58.34 152.81 28.89 Favored Glycine 0 C--N 1.332 0.351 0 C-N-CA 120.911 -0.661 . . . . 0.0 112.533 -179.967 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 3.8 m-85 -139.18 29.58 2.23 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.781 0.324 . . . . 0.0 110.911 179.896 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 53' ' ' VAL . . . . . 0.432 HG11 ' CE2' ' A' ' 15' ' ' TYR . 25.4 m -89.35 160.27 42.76 Favored Pre-proline 0 C--N 1.33 -0.278 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.965 -179.97 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_exo -54.78 -63.11 0.22 Allowed 'Trans proline' 0 C--N 1.346 0.413 0 C-N-CA 122.609 2.206 . . . . 0.0 112.124 179.934 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . 65.76 23.53 11.49 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.311 179.98 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . 0.447 ' O ' ' CG ' ' A' ' 57' ' ' TYR . . . -91.12 145.85 24.33 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.372 -0.376 . . . . 0.0 110.766 179.817 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 57' ' ' TYR . . . . . 0.447 ' CG ' ' O ' ' A' ' 56' ' ' ALA . 36.7 p90 44.35 39.79 3.32 Favored 'General case' 0 N--CA 1.463 0.216 0 CA-C-O 120.918 0.39 . . . . 0.0 111.208 -179.823 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 58' ' ' VAL . . . . . 0.426 ' HA ' ' CD1' ' A' ' 12' ' ' LEU . 73.1 t -74.27 -80.96 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 115.976 -0.556 . . . . 0.0 111.11 -179.944 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 60.0 mmtt -147.88 24.78 1.06 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.502 -0.317 . . . . 0.0 111.126 -179.837 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.464 0.226 0 CA-C-N 116.322 -0.399 . . . . 0.0 111.535 179.939 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.232 0.134 0 CA-C-O 120.775 0.321 . . . . 0.0 110.831 . . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 20.6 t -118.15 141.17 38.58 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.202 0 CA-C-N 116.277 -0.419 . . . . 0.0 111.253 -179.816 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 1.4 mt -99.17 -26.76 14.09 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.88 179.822 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . 65.27 51.71 1.57 Allowed 'General case' 0 C--N 1.333 -0.145 0 CA-C-N 116.209 -0.45 . . . . 0.0 111.124 -179.918 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 1.3 mp -56.96 124.89 20.23 Favored 'General case' 0 C--O 1.233 0.191 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.872 179.943 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 3.3 m-85 61.87 63.02 1.17 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.835 -179.89 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 13.5 m-20 -60.73 -80.83 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.012 179.98 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER 61.84 -165.27 0.23 Allowed 'General case' 0 C--N 1.332 -0.165 0 CA-C-N 116.412 -0.358 . . . . 0.0 110.908 179.987 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -69.91 -170.26 0.32 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.888 179.946 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.329 -0.29 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.901 179.906 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 5.5 pm0 . . . . . 0 C--O 1.232 0.14 0 CA-C-O 120.737 0.303 . . . . 0.0 110.961 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 7.9 t -139.65 161.03 27.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.916 -179.938 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 12.4 t -149.2 -161.78 1.42 Allowed 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.907 -179.9 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER 75.73 174.37 0.24 Allowed 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.84 0.353 . . . . 0.0 111.079 179.974 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -176.8 -164.83 0.11 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.877 179.985 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 2.0 mtpm? 62.97 165.92 0.12 Allowed 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.944 -179.947 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -63.43 -121.8 0.01 OUTLIER Glycine 0 N--CA 1.451 -0.334 0 C-N-CA 120.724 -0.751 . . . . 0.0 112.54 -179.972 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER 62.95 144.99 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.792 0.33 . . . . 0.0 110.987 -179.896 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 10.6 mm -85.4 163.27 2.73 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.354 -0.385 . . . . 0.0 110.998 179.989 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . 0.417 HD12 ' N ' ' A' ' 32' ' ' THR . 0.2 OUTLIER -130.31 -106.07 0.28 Allowed 'General case' 0 CA--C 1.537 0.476 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.885 -179.891 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' THR . . . . . 0.417 ' N ' HD12 ' A' ' 31' ' ' LEU . 51.9 m -168.51 161.95 11.91 Favored 'General case' 0 N--CA 1.462 0.132 0 CA-C-O 120.83 0.348 . . . . 0.0 110.819 179.909 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -149.49 -170.08 3.54 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.916 179.914 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -150.12 102.84 3.13 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.909 179.868 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 77.9 m-20 62.58 -80.12 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.937 -179.895 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 1.2 m 62.72 150.27 0.03 OUTLIER 'General case' 0 C--N 1.333 -0.144 0 CA-C-O 120.917 0.389 . . . . 0.0 111.018 179.882 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 1.4 t -145.82 -47.93 0.21 Allowed 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.688 179.873 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 51.9 p-10 -100.47 -161.6 0.88 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.526 179.771 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . 0.409 ' O ' ' CD1' ' A' ' 41' ' ' TRP . 0.0 OUTLIER -47.72 97.77 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.916 0.389 . . . . 0.0 111.004 179.922 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 6.7 p-10 -69.14 122.9 19.73 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.213 -179.719 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 41' ' ' TRP . . . . . 0.424 ' CE3' ' HA ' ' A' ' 42' ' ' TRP . 49.2 p-90 -177.12 -35.03 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.291 179.905 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 42' ' ' TRP . . . . . 0.461 ' CE3' ' N ' ' A' ' 42' ' ' TRP . 0.0 OUTLIER -46.82 -96.84 0.0 OUTLIER 'General case' 0 CA--C 1.535 0.387 0 CA-C-N 116.399 -0.364 . . . . 0.0 111.935 -179.305 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 10.9 tttp -89.29 128.38 35.86 Favored 'General case' 0 C--N 1.334 -0.092 0 CA-C-O 120.849 0.357 . . . . 0.0 111.042 -179.836 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 40.3 t -114.15 -31.89 2.04 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.051 -179.995 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 5.2 tm-20 62.99 33.58 14.73 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.946 -179.991 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 10.2 p -84.28 151.92 3.81 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.041 179.93 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 2.1 t-20 -62.92 166.65 5.45 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.998 -179.973 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 9.3 m-20 61.08 24.56 14.65 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.125 -0.488 . . . . 0.0 111.11 179.932 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 177.46 -170.02 0.08 Allowed 'General case' 0 C--N 1.333 -0.129 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.748 179.896 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 1.7 tt0 -103.52 -57.34 2.05 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.856 179.972 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 145.93 90.2 0.1 OUTLIER Glycine 0 C--N 1.332 0.331 0 C-N-CA 120.917 -0.659 . . . . 0.0 112.555 -179.986 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 22.0 m-85 -164.23 31.28 0.07 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.735 0.302 . . . . 0.0 110.953 179.991 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 19.0 m -62.24 129.74 92.47 Favored Pre-proline 0 C--N 1.329 -0.295 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.999 179.92 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 52.2 Cg_exo -55.17 -47.42 26.38 Favored 'Trans proline' 0 C--N 1.349 0.567 0 C-N-CA 122.43 2.087 . . . . 0.0 112.266 179.983 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . 67.49 -70.97 0.11 Allowed 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.035 -179.992 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . 63.06 -80.29 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.211 -0.449 . . . . 0.0 111.189 -179.981 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 32.8 p90 -131.01 128.97 41.43 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.809 179.926 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 36.6 t -152.36 -70.99 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.165 -179.884 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 11.3 mtmt -144.59 -68.02 0.32 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.891 -179.875 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 7.3 pttt . . . . . 0 C--N 1.328 -0.33 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.993 -179.89 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 9.7 mt . . . . . 0 C--O 1.231 0.122 0 CA-C-O 120.861 0.362 . . . . 0.0 110.901 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 11.0 t -146.08 80.78 0.13 Allowed 'Isoleucine or valine' 0 C--O 1.232 0.176 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.116 -179.914 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -62.1 -177.23 0.12 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.391 -0.368 . . . . 0.0 110.903 179.95 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -87.37 -27.58 22.71 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.283 -179.798 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 4.6 tp 75.1 -62.97 0.43 Allowed 'General case' 0 N--CA 1.464 0.249 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.803 -179.983 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -136.45 34.26 2.74 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.82 179.909 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 2.4 p30 46.88 -174.43 0.01 OUTLIER 'General case' 0 N--CA 1.463 0.194 0 CA-C-N 115.978 -0.555 . . . . 0.0 111.629 179.938 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' TYR . . . . . 0.419 ' CE1' ' HD2' ' A' ' 54' ' ' PRO . 7.0 t80 -119.41 -26.87 5.71 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 116.094 -0.503 . . . . 0.0 111.245 -179.862 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 8.3 tt0 64.85 120.02 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 120.95 0.405 . . . . 0.0 110.75 -179.759 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 26.9 pt-20 . . . . . 0 C--N 1.33 -0.273 0 CA-C-N 116.233 -0.439 . . . . 0.0 111.024 -179.992 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 4.9 mm-40 . . . . . 0 C--O 1.231 0.121 0 CA-C-O 120.837 0.351 . . . . 0.0 110.974 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 17.7 t -124.62 150.68 29.56 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.156 -0.474 . . . . 0.0 111.187 -179.972 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 10.3 t -140.82 -169.04 2.72 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.884 179.909 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' MET . . . . . . . . . . . . . 7.2 ptp -167.34 62.32 0.08 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.936 179.971 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 13.1 mmtt -61.63 166.21 4.4 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.88 -179.994 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 3.3 ttpt 60.4 -169.66 0.15 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.837 179.913 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -95.78 35.79 4.15 Favored Glycine 0 N--CA 1.45 -0.403 0 C-N-CA 120.805 -0.712 . . . . 0.0 112.55 179.927 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 12.4 p30 -57.79 172.16 0.42 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.713 0.292 . . . . 0.0 110.891 -179.971 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -123.13 -172.33 0.73 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.012 -179.862 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . 0.447 ' N ' ' CD1' ' A' ' 31' ' ' LEU . 0.0 OUTLIER -149.55 -177.01 5.63 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.815 -179.833 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 15.4 t -104.26 -47.0 4.26 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.072 -179.928 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER 66.5 152.78 0.07 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.785 179.924 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 14.8 tp -57.95 -62.29 1.92 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.888 179.958 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 34.4 t30 -147.05 -76.95 0.18 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.83 179.861 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER 172.86 127.35 0.02 OUTLIER 'General case' 0 N--CA 1.462 0.125 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.942 179.932 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 37' ' ' THR . . . . . 0.424 ' CG2' ' CH2' ' A' ' 42' ' ' TRP . 3.2 t 179.34 127.11 0.07 Allowed 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.801 179.981 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 25.2 m-80 -59.4 -82.35 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.886 179.966 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 2.4 tttp 46.9 -166.71 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.797 0.332 . . . . 0.0 111.204 179.804 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 40' ' ' ASP . . . . . 0.408 ' O ' ' CE3' ' A' ' 41' ' ' TRP . 1.5 t0 -96.41 85.07 3.83 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.88 179.733 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 41' ' ' TRP . . . . . 0.457 ' CG ' ' N ' ' A' ' 42' ' ' TRP . 0.0 OUTLIER 85.39 170.95 0.07 Allowed 'General case' 0 N--CA 1.466 0.367 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.788 -179.806 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 42' ' ' TRP . . . . . 0.457 ' N ' ' CG ' ' A' ' 41' ' ' TRP . 6.3 t-105 -155.87 141.43 17.8 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.864 -179.93 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 23.3 mttp -58.4 111.6 1.28 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.949 -179.943 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 23.1 t -99.1 76.46 0.65 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.189 -0.46 . . . . 0.0 111.12 179.971 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 3.1 tm-20 -66.28 -58.3 5.66 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.847 179.957 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 2.5 t 68.33 30.1 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.029 179.915 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 8.8 m120 63.39 35.1 12.44 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.94 179.959 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 1.2 t70 -179.33 167.21 1.5 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.91 179.844 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 25.3 mmm180 55.42 -165.95 0.11 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.025 179.991 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 5.8 mm-40 -80.61 -74.67 0.3 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.95 -179.965 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 153.73 -22.95 0.72 Allowed Glycine 0 C--N 1.333 0.415 0 C-N-CA 120.846 -0.692 . . . . 0.0 112.592 -179.965 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 42.9 m-85 -55.89 96.35 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 120.817 0.341 . . . . 0.0 111.128 -179.975 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 12.2 t -150.82 92.88 3.8 Favored Pre-proline 0 C--N 1.328 -0.36 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.046 179.9 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 54' ' ' PRO . . . . . 0.419 ' HD2' ' CE1' ' A' ' 15' ' ' TYR . 51.3 Cg_exo -53.12 87.46 0.03 OUTLIER 'Trans proline' 0 C--N 1.345 0.365 0 C-N-CA 122.617 2.211 . . . . 0.0 112.386 -179.971 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -60.32 -25.39 65.75 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.047 179.928 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . 64.48 -78.09 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.19 -179.915 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 57' ' ' TYR . . . . . 0.401 ' O ' ' CD1' ' A' ' 57' ' ' TYR . 47.2 p90 -161.47 127.68 3.8 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.028 179.955 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 24.2 t -145.78 126.82 7.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.018 179.853 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 8.9 mmtt 60.56 -167.82 0.18 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.756 -179.868 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 20.4 mttt . . . . . 0 C--N 1.329 -0.299 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.999 -179.972 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.232 0.143 0 CA-C-O 120.879 0.371 . . . . 0.0 110.879 . . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 15.1 m -150.82 44.34 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.218 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.046 179.942 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -51.08 113.94 1.06 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.12 -179.899 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -56.45 94.11 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.185 -0.462 . . . . 0.0 111.03 179.866 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . 0.425 HD11 ' CE1' ' A' ' 57' ' ' TYR . 0.6 OUTLIER -55.0 -24.93 26.62 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.184 -179.958 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -138.17 84.9 2.06 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.398 -0.364 . . . . 0.0 111.069 -179.959 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -81.35 -160.2 0.32 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.623 179.711 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' TYR . . . . . 0.416 ' CD1' ' HB ' ' A' ' 24' ' ' THR . 0.9 OUTLIER 76.77 -164.8 0.05 Allowed 'General case' 0 N--CA 1.464 0.266 0 CA-C-O 120.76 0.314 . . . . 0.0 111.032 179.745 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 5.3 mt-30 75.6 -67.48 0.24 Allowed 'General case' 0 C--N 1.333 -0.129 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.787 -179.769 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 6.6 tt0 . . . . . 0 C--N 1.33 -0.248 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.014 179.933 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 2.1 mt-10 . . . . . 0 C--O 1.231 0.104 0 CA-C-O 120.83 0.348 . . . . 0.0 110.968 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 7.4 t -132.48 154.94 40.83 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.02 179.904 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' THR . . . . . 0.416 ' HB ' ' CD1' ' A' ' 15' ' ' TYR . 0.7 OUTLIER -105.6 -77.7 0.58 Allowed 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.217 -179.883 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' MET . . . . . 0.407 ' HG2' ' O ' ' A' ' 24' ' ' THR . 0.0 OUTLIER 47.77 -174.34 0.01 OUTLIER 'General case' 0 CA--C 1.53 0.188 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.432 -179.815 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -178.23 104.72 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.299 -0.409 . . . . 0.0 110.894 -179.935 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 9.7 ptpp? 178.84 165.45 0.87 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.828 179.864 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -95.21 23.0 35.46 Favored Glycine 0 N--CA 1.45 -0.417 0 C-N-CA 120.773 -0.727 . . . . 0.0 112.519 179.941 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 10.7 m-20 -72.29 165.15 25.04 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.736 0.303 . . . . 0.0 110.788 179.945 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 5.4 mm -86.24 167.25 1.83 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.078 180.0 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . 0.496 ' N ' ' CD1' ' A' ' 31' ' ' LEU . 0.0 OUTLIER -153.11 166.44 32.46 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.78 -179.719 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 76.5 m -103.71 160.14 15.02 Favored 'General case' 0 N--CA 1.462 0.13 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.043 -179.97 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 5.0 mt -122.93 -169.83 1.99 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.938 -179.94 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 27.9 tp -161.51 86.33 0.66 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.831 179.976 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 3.3 m120 61.62 81.83 0.18 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.82 179.929 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 13.2 p -125.24 -79.24 0.61 Allowed 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.961 179.966 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 51.9 m 62.39 145.1 0.02 OUTLIER 'General case' 0 C--N 1.333 -0.152 0 CA-C-N 116.231 -0.441 . . . . 0.0 111.078 179.993 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER 56.69 168.77 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.054 179.894 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 5.1 mmtm 59.0 -111.78 0.57 Allowed 'General case' 0 CA--C 1.534 0.335 0 CA-C-N 116.086 -0.507 . . . . 0.0 110.898 179.994 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 59.9 t0 -178.46 -68.6 0.01 OUTLIER 'General case' 0 C--O 1.231 0.085 0 CA-C-O 120.829 0.347 . . . . 0.0 110.867 179.99 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 41' ' ' TRP . . . . . . . . . . . . . 43.0 p90 -73.99 125.41 28.2 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.867 -179.974 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 42' ' ' TRP . . . . . . . . . . . . . 4.8 m95 -167.59 81.18 0.19 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.911 -179.951 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 7.9 mtpp 58.29 91.01 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.027 179.968 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . 0.401 ' CG2' ' HB ' ' A' ' 53' ' ' VAL . 18.8 t -89.73 139.65 17.15 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.111 179.937 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 1.3 pt-20 -160.54 137.63 9.15 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.889 179.943 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 12.4 p -156.43 -45.61 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.32 -0.4 . . . . 0.0 111.156 -179.919 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 2.1 t-20 -178.09 37.91 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.91 -179.923 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 46.2 m-20 -136.12 -70.04 0.48 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.951 179.986 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 31.6 mtp85 -157.64 -177.63 6.73 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.838 179.931 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 10.5 mm-40 -112.38 140.32 47.2 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.931 179.997 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 136.82 153.69 6.52 Favored Glycine 0 C--N 1.332 0.338 0 C-N-CA 120.956 -0.64 . . . . 0.0 112.497 179.956 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 13.0 p90 -59.36 158.98 8.5 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.768 0.318 . . . . 0.0 110.998 -179.971 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 53' ' ' VAL . . . . . 0.401 ' HB ' ' CG2' ' A' ' 44' ' ' VAL . 22.0 t -147.97 139.31 13.66 Favored Pre-proline 0 C--N 1.328 -0.33 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.151 -179.844 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 50.8 Cg_exo -53.41 101.35 0.06 OUTLIER 'Trans proline' 0 C--N 1.347 0.481 0 C-N-CA 122.535 2.157 . . . . 0.0 112.191 179.944 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -55.84 -41.8 74.83 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.112 -0.494 . . . . 0.0 111.101 179.998 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . 0.413 ' O ' ' CD2' ' A' ' 57' ' ' TYR . . . 52.19 53.21 12.83 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.18 -0.463 . . . . 0.0 111.131 179.981 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 57' ' ' TYR . . . . . 0.427 ' O ' ' CG ' ' A' ' 57' ' ' TYR . 0.0 OUTLIER 63.16 119.65 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.611 -179.814 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 58' ' ' VAL . . . . . 0.408 ' CG1' ' N ' ' A' ' 59' ' ' LYS . 0.5 OUTLIER -131.07 -168.54 0.58 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.826 -179.758 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . 0.408 ' N ' ' CG1' ' A' ' 58' ' ' VAL . 0.0 OUTLIER -49.85 -77.14 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.791 0.329 . . . . 0.0 111.13 -179.93 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.33 -0.241 0 CA-C-N 116.352 -0.385 . . . . 0.0 110.905 179.979 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.232 0.152 0 CA-C-O 120.712 0.291 . . . . 0.0 110.825 . . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 5.1 t 63.64 134.25 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.236 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.111 179.796 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . 0.405 ' CD2' ' N ' ' A' ' 10' ' ' LEU . 0.2 OUTLIER -130.04 144.88 51.58 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.737 179.853 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . 0.48 ' HA ' ' CZ ' ' A' ' 13' ' ' TYR . . . -62.92 80.74 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.422 -179.832 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 2.1 mt -103.25 32.05 3.97 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.789 179.942 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . 0.48 ' CZ ' ' HA ' ' A' ' 11' ' ' ALA . 0.0 OUTLIER -86.46 -60.04 2.11 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.384 -0.371 . . . . 0.0 110.43 179.522 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . 0.437 ' HA ' ' HA ' ' A' ' 26' ' ' LYS . 58.6 t0 50.21 89.3 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.177 179.798 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' TYR . . . . . 0.415 ' O ' ' CB ' ' A' ' 16' ' ' GLN . 0.5 OUTLIER -129.34 -78.62 0.56 Allowed 'General case' 0 C--N 1.332 -0.155 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.095 179.787 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' GLN . . . . . 0.415 ' CB ' ' O ' ' A' ' 15' ' ' TYR . 0.0 OUTLIER 164.09 177.58 0.02 OUTLIER 'General case' 0 N--CA 1.465 0.301 0 CA-C-O 120.817 0.342 . . . . 0.0 110.795 179.979 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 57.1 mt-10 . . . . . 0 C--N 1.328 -0.351 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.111 179.907 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.231 0.114 0 CA-C-O 120.784 0.326 . . . . 0.0 110.953 . . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -150.21 -68.36 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.201 179.99 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER 56.79 178.95 0.04 OUTLIER 'General case' 0 C--O 1.232 0.151 0 CA-C-N 116.11 -0.495 . . . . 0.0 111.062 -179.852 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -178.87 -173.57 0.31 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.856 -179.803 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . 0.437 ' HA ' ' HA ' ' A' ' 14' ' ' ASP . 0.0 OUTLIER -138.25 -173.05 3.42 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.007 179.946 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 5.1 ttpm? 63.43 120.66 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.015 -0.539 . . . . 0.0 111.002 179.901 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -58.82 -86.13 0.03 OUTLIER Glycine 0 N--CA 1.452 -0.242 0 C-N-CA 120.701 -0.761 . . . . 0.0 112.437 179.816 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 2.1 t0 49.05 28.58 2.11 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.806 0.336 . . . . 0.0 111.129 179.935 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 4.6 mm 58.98 168.42 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.091 -179.975 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . 0.513 ' N ' ' CD1' ' A' ' 31' ' ' LEU . 0.0 OUTLIER -157.15 -175.75 5.59 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.755 -179.635 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 86.7 m -126.27 161.72 27.11 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.976 179.941 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 2.3 mt -129.28 -170.11 2.22 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.2 -0.454 . . . . 0.0 111.011 -179.911 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 9.3 tt -176.2 92.48 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.955 179.984 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 1.7 t30 61.27 89.8 0.07 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.891 -179.962 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 10.7 t -169.53 119.74 0.67 Allowed 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.861 179.965 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -122.94 170.36 10.2 Favored 'General case' 0 N--CA 1.462 0.129 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.827 -179.969 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 8.3 m-80 64.09 -79.09 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.979 179.984 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -73.71 170.33 15.47 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.856 179.938 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 11.2 p30 -132.47 39.02 3.41 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.905 -179.99 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 41' ' ' TRP . . . . . 0.411 ' CD1' ' HA ' ' A' ' 56' ' ' ALA . 41.9 p-90 -159.3 31.65 0.2 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.0 -0.546 . . . . 0.0 110.684 179.942 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 42' ' ' TRP . . . . . . . . . . . . . 21.8 m95 -71.36 -47.76 54.38 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.086 -0.506 . . . . 0.0 111.138 -179.806 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 1.7 ttpm? -167.05 90.4 0.37 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.458 -0.337 . . . . 0.0 111.275 -179.852 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 23.3 t -98.82 136.32 30.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.295 -0.412 . . . . 0.0 110.78 179.444 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -110.89 -67.53 0.99 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.092 -179.651 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 4.1 t 74.41 75.86 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 116.361 -0.381 . . . . 0.0 111.077 -179.817 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 36.6 m-20 68.6 -67.6 0.2 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.952 -179.99 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 1.2 t0 -121.9 -164.58 1.17 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.805 179.982 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER 67.47 140.11 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.35 -0.386 . . . . 0.0 110.837 -179.993 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -69.3 -169.25 0.19 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.947 -179.967 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -80.44 -158.45 17.89 Favored Glycine 0 C--N 1.334 0.429 0 C-N-CA 120.95 -0.643 . . . . 0.0 112.425 -179.942 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 2.2 m-85 59.74 108.88 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.83 0.348 . . . . 0.0 110.821 -179.978 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 62.8 t -143.12 100.84 5.31 Favored Pre-proline 0 C--N 1.328 -0.327 0 CA-C-N 116.266 -0.425 . . . . 0.0 111.196 -179.821 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 54' ' ' PRO . . . . . 0.422 ' O ' ' CB ' ' A' ' 55' ' ' ALA . 31.1 Cg_exo -59.47 -148.85 0.01 OUTLIER 'Trans proline' 0 C--N 1.347 0.467 0 C-N-CA 122.977 2.451 . . . . 0.0 111.966 179.931 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 55' ' ' ALA . . . . . 0.422 ' CB ' ' O ' ' A' ' 54' ' ' PRO . . . 81.06 -39.02 0.14 Allowed 'General case' 0 C--O 1.232 0.155 0 CA-C-O 120.818 0.342 . . . . 0.0 110.651 -179.299 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . 0.411 ' HA ' ' CD1' ' A' ' 41' ' ' TRP . . . 68.52 -75.31 0.07 Allowed 'General case' 0 N--CA 1.453 -0.28 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.152 179.674 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -54.08 160.89 1.4 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.893 179.91 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 6.6 p -179.89 -47.92 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.025 179.925 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -179.58 178.22 0.67 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.474 -0.33 . . . . 0.0 110.826 179.459 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 7.4 ttpp . . . . . 0 C--N 1.329 -0.293 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.868 179.953 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . 0.516 ' O ' ' CG2' ' A' ' 9' ' ' VAL . 1.6 mt . . . . . 0 CA--C 1.527 0.079 0 CA-C-O 120.468 0.175 . . . . 0.0 110.919 . . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . 0.516 ' CG2' ' O ' ' A' ' 8' ' ' LEU . 1.0 OUTLIER 76.59 33.29 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.466 0.35 0 CA-C-N 115.982 -0.554 . . . . 0.0 111.441 -179.837 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -44.99 111.59 0.34 Allowed 'General case' 0 N--CA 1.463 0.181 0 CA-C-N 115.962 -0.563 . . . . 0.0 111.2 179.69 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . 0.401 ' CB ' ' CB ' ' A' ' 55' ' ' ALA . . . -53.11 98.94 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 116.037 -0.529 . . . . 0.0 111.191 -179.931 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . 0.447 ' CD1' ' CZ ' ' A' ' 57' ' ' TYR . 0.5 OUTLIER -52.04 157.54 1.28 Allowed 'General case' 0 C--O 1.231 0.129 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.854 -179.938 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 1.2 m-85 67.95 -70.71 0.12 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.778 -179.809 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER 56.8 104.42 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.915 -179.991 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 0.7 OUTLIER -96.08 -175.68 3.46 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.148 -179.698 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 16.6 pt20 -122.43 177.75 5.26 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.792 179.921 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . 0.504 ' HG2' ' HA ' ' A' ' 23' ' ' VAL . 0.3 OUTLIER . . . . . 0 C--N 1.33 -0.263 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.958 -179.898 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . 0.405 ' OE1' ' CE1' ' A' ' 52' ' ' PHE . 27.9 mm-40 . . . . . 0 C--O 1.232 0.139 0 CA-C-O 120.832 0.348 . . . . 0.0 110.886 . . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . 0.504 ' HA ' ' HG2' ' A' ' 17' ' ' GLU . 31.5 m -58.45 179.81 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.049 179.975 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -171.35 -165.93 0.43 Allowed 'General case' 0 N--CA 1.463 0.217 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.502 179.906 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -177.3 117.16 0.1 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.422 -0.354 . . . . 0.0 110.878 179.878 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.84 -166.12 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.989 -179.83 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 22.6 mmtt 64.44 151.25 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.842 179.934 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -94.13 40.77 2.69 Favored Glycine 0 N--CA 1.451 -0.354 0 C-N-CA 120.772 -0.728 . . . . 0.0 112.504 -179.925 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 2.9 t0 -58.27 -176.98 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.691 0.281 . . . . 0.0 110.725 179.843 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 0.6 OUTLIER -103.9 -179.45 0.64 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-O 120.774 0.321 . . . . 0.0 111.026 179.97 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . 0.501 ' N ' ' CD1' ' A' ' 31' ' ' LEU . 0.0 OUTLIER -150.68 -157.94 0.86 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.768 -179.376 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' THR . . . . . 0.419 ' CG2' ' N ' ' A' ' 33' ' ' LEU . 9.8 t -131.84 -53.99 0.99 Allowed 'General case' 0 N--CA 1.462 0.133 0 CA-C-O 120.765 0.317 . . . . 0.0 111.526 -179.696 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . 0.492 ' CD2' ' HB2' ' A' ' 31' ' ' LEU . 1.9 mm? 62.34 138.09 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.931 0.396 . . . . 0.0 111.179 -179.985 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 6.8 mp -68.35 -74.2 0.13 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.868 179.947 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 7.9 p30 -154.98 31.18 0.4 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.854 179.953 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 3.3 m -70.65 139.44 51.3 Favored 'General case' 0 C--N 1.333 -0.144 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.822 -179.979 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 35.0 m -161.88 69.24 0.29 Allowed 'General case' 0 C--N 1.332 -0.158 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.844 179.968 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 2.3 m120 -158.49 -175.23 5.2 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.93 -179.898 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 1.2 pttt -69.14 -171.18 0.3 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.904 -179.98 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 3.1 p30 46.68 -175.55 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.235 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.672 -179.922 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 41' ' ' TRP . . . . . 0.463 ' CG ' ' N ' ' A' ' 42' ' ' TRP . 0.0 OUTLIER -69.01 -171.67 0.33 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.082 -0.508 . . . . 0.0 111.068 -179.698 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 42' ' ' TRP . . . . . 0.463 ' N ' ' CG ' ' A' ' 41' ' ' TRP . 5.4 m95 -166.67 154.25 9.58 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.938 179.955 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 7.9 tttp -63.67 113.25 3.24 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.965 179.994 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 16.4 m -103.27 -174.7 0.42 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.088 179.789 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -175.79 93.26 0.06 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.914 0.388 . . . . 0.0 110.928 179.857 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 11.2 p -131.98 -44.9 0.65 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.12 179.931 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 10.9 p-10 -107.87 -172.15 2.01 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.784 179.985 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 59.7 m-20 -57.07 -75.73 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.899 179.976 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -80.28 108.52 13.96 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.775 179.93 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -158.49 -178.17 7.07 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.977 179.989 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 132.82 -7.06 5.19 Favored Glycine 0 CA--C 1.519 0.339 0 C-N-CA 120.935 -0.65 . . . . 0.0 112.754 -179.939 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 52' ' ' PHE . . . . . 0.405 ' CE1' ' OE1' ' A' ' 22' ' ' GLU . 58.9 m-85 -136.25 -80.85 0.4 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.662 0.267 . . . . 0.0 110.719 179.965 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 30.2 t 50.34 97.66 0.04 OUTLIER Pre-proline 0 C--N 1.332 -0.187 0 CA-C-N 116.414 -0.357 . . . . 0.0 111.497 179.725 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 84.8 Cg_exo -47.17 -59.93 1.07 Allowed 'Trans proline' 0 C--N 1.347 0.481 0 C-N-CA 122.615 2.21 . . . . 0.0 112.48 179.958 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 55' ' ' ALA . . . . . 0.401 ' CB ' ' CB ' ' A' ' 11' ' ' ALA . . . 63.12 17.03 9.85 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.543 -179.986 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . 54.26 -88.85 0.02 OUTLIER 'General case' 0 CA--C 1.531 0.222 0 CA-C-N 116.577 -0.283 . . . . 0.0 111.423 179.949 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 57' ' ' TYR . . . . . 0.497 ' O ' ' CG1' ' A' ' 58' ' ' VAL . 25.1 p90 -124.2 -23.5 4.52 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.651 -0.25 . . . . 0.0 111.504 -179.811 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 58' ' ' VAL . . . . . 0.497 ' CG1' ' O ' ' A' ' 57' ' ' TYR . 9.9 p 52.82 162.86 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.464 0.274 0 CA-C-O 121.04 0.448 . . . . 0.0 111.724 -179.912 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 6.4 mmmt -73.01 -48.62 34.78 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.835 -179.772 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--N 1.33 -0.26 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.882 179.994 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 1.2 pp . . . . . 0 C--O 1.232 0.162 0 CA-C-O 120.963 0.411 . . . . 0.0 110.731 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 11.6 t 70.89 161.07 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.015 -179.871 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -144.49 -164.52 1.93 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.145 179.418 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . 0.409 ' O ' ' CB ' ' A' ' 55' ' ' ALA . . . -137.44 15.37 2.97 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.181 179.643 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER 65.65 -67.02 0.14 Allowed 'General case' 0 C--O 1.231 0.117 0 CA-C-O 120.953 0.406 . . . . 0.0 110.535 -179.756 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . 0.402 ' N ' ' O ' ' A' ' 11' ' ' ALA . 6.6 p90 -156.02 170.24 22.6 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.967 -0.56 . . . . 0.0 110.398 179.609 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 4.9 p-10 -46.53 159.67 0.09 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.379 -0.373 . . . . 0.0 111.081 179.729 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' TYR . . . . . 0.407 ' CE2' ' HD2' ' A' ' 54' ' ' PRO . 10.7 t80 -115.24 -35.99 4.5 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.387 -0.37 . . . . 0.0 111.151 -179.906 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER 64.99 143.62 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.773 -179.925 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 7.4 pt-20 . . . . . 0 C--N 1.33 -0.277 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.857 -179.975 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 69.9 mm-40 . . . . . 0 C--O 1.231 0.118 0 CA-C-O 120.814 0.34 . . . . 0.0 110.996 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 26.5 t -153.27 -48.51 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.002 179.911 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 99.1 m 63.27 -80.13 0.03 OUTLIER 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.007 -0.542 . . . . 0.0 111.072 179.91 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER 62.16 149.83 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.882 179.968 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -140.32 104.19 4.74 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.956 -179.943 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 4.0 mtpp 61.69 151.76 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.883 -179.945 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -62.76 -83.41 0.07 OUTLIER Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 120.597 -0.811 . . . . 0.0 112.359 179.851 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . 0.408 ' O ' ' CD1' ' A' ' 30' ' ' ILE . 30.1 m-20 52.19 -90.49 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.467 0.175 . . . . 0.0 111.1 -179.967 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . 0.408 ' CD1' ' O ' ' A' ' 29' ' ' ASP . 0.2 OUTLIER -147.1 -173.02 0.36 Allowed 'Isoleucine or valine' 0 C--O 1.232 0.143 0 CA-C-O 120.832 0.349 . . . . 0.0 110.892 179.896 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . 0.432 HD13 ' N ' ' A' ' 31' ' ' LEU . 0.1 OUTLIER -163.65 -98.13 0.02 OUTLIER 'General case' 0 CA--C 1.534 0.33 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.27 179.736 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' THR . . . . . 0.453 ' O ' ' CB ' ' A' ' 33' ' ' LEU . 20.8 m -168.53 -95.75 0.01 OUTLIER 'General case' 0 CA--C 1.53 0.185 0 N-CA-C 110.495 -0.187 . . . . 0.0 110.495 179.182 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . 0.453 ' CB ' ' O ' ' A' ' 32' ' ' THR . 0.4 OUTLIER 160.35 -66.1 0.0 OUTLIER 'General case' 0 N--CA 1.463 0.211 0 CA-C-O 120.872 0.368 . . . . 0.0 110.663 179.99 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 1.6 mp 63.91 -169.5 0.19 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.816 -179.836 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 4.1 m120 -57.06 125.96 25.05 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.005 -179.936 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 4.3 m -161.75 -44.55 0.04 OUTLIER 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.868 -179.909 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 10.2 p 55.98 31.4 17.88 Favored 'General case' 0 N--CA 1.463 0.2 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.962 -179.937 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 5.8 m-80 -177.65 -174.25 0.45 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.843 -179.954 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -114.23 86.04 2.34 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.853 179.951 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 40' ' ' ASP . . . . . 0.459 ' O ' ' N ' ' A' ' 42' ' ' TRP . 36.1 t70 -177.39 58.57 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.866 179.911 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 41' ' ' TRP . . . . . 0.427 ' CD1' ' N ' ' A' ' 41' ' ' TRP . 0.0 OUTLIER 43.85 -89.0 0.01 OUTLIER 'General case' 0 N--CA 1.467 0.386 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.521 179.894 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 42' ' ' TRP . . . . . 0.459 ' N ' ' O ' ' A' ' 40' ' ' ASP . 0.0 OUTLIER 67.76 -73.01 0.09 Allowed 'General case' 0 C--N 1.333 -0.151 0 CA-C-O 120.695 0.283 . . . . 0.0 110.919 179.952 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 4.1 ttpt -138.47 61.98 1.57 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.878 0.37 . . . . 0.0 111.02 -179.903 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . 0.435 ' CG1' ' CG2' ' A' ' 53' ' ' VAL . 1.5 p -100.41 139.22 22.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.703 179.768 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 7.7 pt-20 -119.06 166.39 12.95 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.916 179.953 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 16.1 t -129.18 84.78 0.84 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.292 -179.876 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER 58.9 107.57 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.975 179.885 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 6.3 p-10 43.38 73.47 0.14 Allowed 'General case' 0 N--CA 1.463 0.222 0 CA-C-N 116.065 -0.516 . . . . 0.0 111.514 179.891 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 12.9 mmm180 -146.42 -177.63 5.73 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.855 179.973 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 1.2 tp-100 -85.54 -69.23 0.67 Allowed 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.076 179.983 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 162.68 -175.79 39.04 Favored Glycine 0 C--N 1.333 0.412 0 C-N-CA 120.869 -0.681 . . . . 0.0 112.521 -179.975 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 52' ' ' PHE . . . . . 0.404 ' CD2' ' O ' ' A' ' 42' ' ' TRP . 0.7 OUTLIER 57.99 105.64 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.79 0.328 . . . . 0.0 110.943 179.997 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 53' ' ' VAL . . . . . 0.46 ' CG2' ' O ' ' A' ' 53' ' ' VAL . 17.0 m -135.4 65.8 63.68 Favored Pre-proline 0 CA--C 1.532 0.275 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.313 179.84 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 54' ' ' PRO . . . . . 0.407 ' HD2' ' CE2' ' A' ' 15' ' ' TYR . 3.2 Cg_exo -74.75 52.99 3.1 Favored 'Trans proline' 0 C--N 1.346 0.432 0 C-N-CA 122.887 2.392 . . . . 0.0 112.048 179.9 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 55' ' ' ALA . . . . . 0.409 ' CB ' ' O ' ' A' ' 11' ' ' ALA . . . -59.96 -30.24 68.96 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 121.017 0.437 . . . . 0.0 110.825 179.8 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -179.12 -163.04 0.05 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.9 -0.591 . . . . 0.0 111.018 179.999 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 57' ' ' TYR . . . . . 0.449 ' CD2' ' N ' ' A' ' 58' ' ' VAL . 48.3 p90 -59.12 -49.37 78.13 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.365 -179.737 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 58' ' ' VAL . . . . . 0.449 ' N ' ' CD2' ' A' ' 57' ' ' TYR . 8.5 t 72.24 155.63 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-O 120.894 0.378 . . . . 0.0 110.774 -179.673 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 7.7 ptmt -57.63 176.57 0.13 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.98 -179.902 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 13.2 mmtm . . . . . 0 C--N 1.329 -0.305 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.829 179.926 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 2.0 tp . . . . . 0 C--O 1.231 0.132 0 CA-C-O 120.644 0.259 . . . . 0.0 110.93 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . 0.409 ' CG1' HG11 ' A' ' 58' ' ' VAL . 0.0 OUTLIER 179.44 123.63 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.463 0.209 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.104 -179.95 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -126.11 142.82 51.37 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.73 179.678 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -52.07 -25.76 9.41 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.308 -0.405 . . . . 0.0 111.065 179.886 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER 67.8 -69.64 0.14 Allowed 'General case' 0 N--CA 1.461 0.115 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.868 179.914 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . 0.402 ' CD1' ' OH ' ' A' ' 57' ' ' TYR . 0.2 OUTLIER -73.34 -72.06 0.28 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.846 179.84 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . 0.409 ' O ' ' HG2' ' A' ' 25' ' ' MET . 2.2 p30 167.11 -60.39 0.0 OUTLIER 'General case' 0 N--CA 1.463 0.211 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.976 179.949 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' TYR . . . . . 0.457 ' CG ' ' HA ' ' A' ' 24' ' ' THR . 38.7 p90 -176.67 -163.54 0.1 Allowed 'General case' 0 N--CA 1.463 0.195 0 CA-C-O 120.856 0.36 . . . . 0.0 110.806 -179.779 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' GLN . . . . . 0.414 ' N ' ' CD2' ' A' ' 15' ' ' TYR . 26.5 pt20 -138.21 -47.47 0.53 Allowed 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.926 179.768 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . 0.411 ' HB2' ' CE2' ' A' ' 15' ' ' TYR . 2.9 tm-20 . . . . . 0 C--N 1.331 -0.237 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.038 -179.883 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 1.3 mt-10 . . . . . 0 N--CA 1.463 0.198 0 CA-C-O 120.941 0.401 . . . . 0.0 110.905 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . 0.433 ' CG2' ' N ' ' A' ' 24' ' ' THR . 1.1 p -178.28 -92.46 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.535 0.403 0 CA-C-N 116.013 -0.54 . . . . 0.0 110.666 179.61 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' THR . . . . . 0.457 ' HA ' ' CG ' ' A' ' 15' ' ' TYR . 2.1 t 39.59 81.83 0.02 OUTLIER 'General case' 0 N--CA 1.466 0.355 0 N-CA-C 111.929 0.344 . . . . 0.0 111.929 179.568 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' MET . . . . . 0.409 ' HG2' ' O ' ' A' ' 14' ' ' ASP . 0.0 OUTLIER -97.86 -25.98 14.84 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.413 -0.358 . . . . 0.0 111.377 -179.987 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 61.85 152.47 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.351 -0.386 . . . . 0.0 111.219 179.817 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 23.6 mtmt 63.83 157.32 0.07 Allowed 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.073 -0.512 . . . . 0.0 111.185 179.73 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -99.26 35.51 4.65 Favored Glycine 0 C--N 1.331 0.251 0 C-N-CA 120.845 -0.693 . . . . 0.0 112.376 179.923 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 63.4 m-20 -60.25 172.55 0.81 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.728 0.299 . . . . 0.0 110.771 179.951 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 12.8 mm -86.95 167.31 1.78 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.068 179.982 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . 0.532 ' N ' ' CD1' ' A' ' 31' ' ' LEU . 0.0 OUTLIER -158.13 -94.44 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.897 -179.458 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 3.4 t -179.65 -154.46 0.02 OUTLIER 'General case' 0 CA--C 1.53 0.201 0 N-CA-C 110.175 -0.305 . . . . 0.0 110.175 179.808 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -169.7 115.19 0.54 Allowed 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.911 0.386 . . . . 0.0 111.102 179.723 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -59.51 107.28 0.56 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.713 179.848 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 4.2 t-20 65.95 -167.47 0.21 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.64 -179.858 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 3.6 m -62.71 169.57 3.05 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-N 116.332 -0.395 . . . . 0.0 110.835 -179.997 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 37' ' ' THR . . . . . 0.406 ' O ' ' N ' ' A' ' 39' ' ' LYS . 9.2 t -107.95 -47.65 3.53 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.862 179.912 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 50.9 t30 64.9 -73.36 0.06 Allowed 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.148 179.927 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . 0.406 ' N ' ' O ' ' A' ' 37' ' ' THR . 0.0 OUTLIER -176.66 38.7 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.404 -0.362 . . . . 0.0 110.878 -179.967 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 7.3 m-20 -129.17 153.67 47.5 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.163 -0.472 . . . . 0.0 110.98 -179.978 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 41' ' ' TRP . . . . . 0.462 ' CG ' ' N ' ' A' ' 42' ' ' TRP . 18.3 p90 -58.39 -48.41 80.73 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.876 -179.982 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 42' ' ' TRP . . . . . 0.462 ' N ' ' CG ' ' A' ' 41' ' ' TRP . 77.7 m95 61.75 139.69 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.099 -0.501 . . . . 0.0 111.151 179.912 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . 0.415 ' O ' ' N ' ' A' ' 45' ' ' GLU . 0.1 OUTLIER -56.45 -22.12 29.99 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.361 -179.863 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 49.1 t 62.7 -77.89 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.228 0 CA-C-N 116.479 -0.328 . . . . 0.0 111.135 -179.908 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . 0.415 ' N ' ' O ' ' A' ' 43' ' ' LYS . 24.4 mt-10 71.93 161.46 0.24 Allowed 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.053 179.998 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 11.2 p -174.46 -47.74 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.175 179.908 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER 169.82 148.86 0.03 OUTLIER 'General case' 0 N--CA 1.463 0.212 0 CA-C-O 120.907 0.384 . . . . 0.0 111.042 179.885 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 44.6 m-20 55.43 25.64 7.95 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.035 -0.53 . . . . 0.0 111.356 179.72 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -165.53 -81.35 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.473 -0.33 . . . . 0.0 110.85 179.865 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . 0.409 ' HA ' ' CB ' ' A' ' 45' ' ' GLU . 2.1 tt0 52.24 94.18 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.457 179.79 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 133.86 128.03 2.81 Favored Glycine 0 C--N 1.333 0.38 0 C-N-CA 120.683 -0.77 . . . . 0.0 113.107 179.642 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 24.1 m-85 60.75 111.97 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.977 0.417 . . . . 0.0 111.746 179.393 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 76.9 t -157.73 90.93 2.3 Favored Pre-proline 0 C--N 1.329 -0.3 0 CA-C-N 115.861 -0.609 . . . . 0.0 110.285 179.499 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 31.6 Cg_exo -59.41 134.23 57.27 Favored 'Trans proline' 0 C--N 1.347 0.463 0 C-N-CA 122.797 2.331 . . . . 0.0 112.414 -179.544 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -99.96 63.3 1.18 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.782 179.625 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -47.08 -29.73 2.35 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.156 -0.474 . . . . 0.0 111.262 -179.83 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 57' ' ' TYR . . . . . 0.457 ' CD1' ' N ' ' A' ' 57' ' ' TYR . 0.0 OUTLIER -157.41 -74.84 0.09 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.375 179.922 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 58' ' ' VAL . . . . . 0.409 HG11 ' CG1' ' A' ' 9' ' ' VAL . 0.2 OUTLIER 52.48 -179.51 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.079 -0.51 . . . . 0.0 111.15 179.745 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -85.06 153.11 22.94 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.91 -179.959 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 C--N 1.329 -0.319 0 CA-C-N 116.152 -0.477 . . . . 0.0 110.876 -179.993 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 3.1 mm? . . . . . 0 CA--C 1.521 -0.143 0 CA-C-O 121.017 0.437 . . . . 0.0 110.959 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . 0.405 ' CG2' ' CD1' ' A' ' 31' ' ' LEU . 23.4 m -151.93 -148.14 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.45 -0.454 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.595 -179.651 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . 0.43 ' CD2' ' CD ' ' A' ' 59' ' ' LYS . 0.9 OUTLIER -169.07 31.41 0.02 OUTLIER 'General case' 0 C--N 1.334 -0.082 0 CA-C-O 120.808 0.337 . . . . 0.0 111.173 -179.993 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . 61.07 -81.55 0.02 OUTLIER 'General case' 0 CA--C 1.529 0.15 0 CA-C-N 116.22 -0.446 . . . . 0.0 111.261 179.817 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . 0.404 ' CD1' ' HA ' ' A' ' 58' ' ' VAL . 1.0 OUTLIER 64.81 -77.29 0.04 OUTLIER 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 116.387 -0.37 . . . . 0.0 110.853 -179.786 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . 0.402 ' CD2' ' HB2' ' A' ' 56' ' ' ALA . 1.2 m-85 -103.72 62.88 0.77 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 121.083 0.468 . . . . 0.0 110.606 179.775 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 14.0 m-20 -126.38 70.23 1.24 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.042 -0.527 . . . . 0.0 111.075 -179.948 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' TYR . . . . . 0.415 ' O ' ' CD2' ' A' ' 15' ' ' TYR . 84.0 t80 -145.5 63.41 1.27 Allowed 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.893 -179.973 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER 179.15 170.86 0.92 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.924 179.926 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 27.8 tp10 . . . . . 0 C--N 1.331 -0.23 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.727 179.967 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 49.0 tt0 . . . . . 0 CA--C 1.526 0.047 0 CA-C-O 120.752 0.31 . . . . 0.0 110.956 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 21.5 t -106.74 147.17 12.34 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.262 -0.427 . . . . 0.0 111.114 -179.971 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' THR . . . . . 0.403 ' OG1' ' CD1' ' A' ' 15' ' ' TYR . 1.0 OUTLIER -178.76 107.54 0.04 OUTLIER 'General case' 0 C--N 1.333 -0.11 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.023 179.927 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' MET . . . . . 0.405 ' O ' ' HG2' ' A' ' 25' ' ' MET . 0.0 OUTLIER -160.98 125.91 3.65 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.873 179.875 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 1.8 mmmm -128.89 -160.73 1.05 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.956 -179.675 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 5.0 tttm 78.89 -179.67 0.11 Allowed 'General case' 0 N--CA 1.464 0.229 0 CA-C-O 120.864 0.364 . . . . 0.0 110.953 -179.883 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -57.03 -20.12 33.18 Favored Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.934 -0.65 . . . . 0.0 112.896 -179.768 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -47.91 134.66 13.21 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.762 0.315 . . . . 0.0 111.202 -179.85 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -104.92 -168.55 0.25 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.88 179.989 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . 0.405 ' CD1' ' CG2' ' A' ' 9' ' ' VAL . 0.0 OUTLIER -146.04 -82.26 0.14 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.917 -179.808 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER 165.97 -56.67 0.0 OUTLIER 'General case' 0 N--CA 1.466 0.33 0 CA-C-O 120.893 0.378 . . . . 0.0 110.692 -179.939 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER 58.91 98.89 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.965 179.91 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 1.2 pt? -57.47 -167.19 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.977 179.929 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 7.0 p-10 -59.08 88.58 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.897 179.988 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 11.0 t -59.68 159.97 7.93 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.956 179.908 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 1.4 t -140.29 117.68 11.4 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.832 -179.986 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 16.4 m-80 -60.76 89.91 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.877 179.987 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -177.41 -39.78 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.835 179.953 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 9.1 p-10 -130.79 -175.4 3.65 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.958 -179.918 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 41' ' ' TRP . . . . . 0.479 ' O ' ' CG ' ' A' ' 42' ' ' TRP . 0.1 OUTLIER -80.88 -0.9 41.13 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.381 -179.988 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 42' ' ' TRP . . . . . 0.479 ' CG ' ' O ' ' A' ' 41' ' ' TRP . 32.2 p90 45.79 -172.92 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.247 0 CA-C-O 120.853 0.358 . . . . 0.0 111.34 -179.971 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -126.36 162.92 24.42 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.003 -179.773 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 11.1 t -144.23 157.69 15.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.061 -0.518 . . . . 0.0 111.105 179.99 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . 0.409 ' O ' HG13 ' A' ' 46' ' ' VAL . 5.5 mm-40 -101.68 -165.29 1.18 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.827 -179.91 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 46' ' ' VAL . . . . . 0.409 HG13 ' O ' ' A' ' 45' ' ' GLU . 0.4 OUTLIER 80.07 7.81 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.532 0.265 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.43 179.983 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 3.0 t-20 -113.8 -36.22 4.9 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.852 0.358 . . . . 0.0 110.953 179.921 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER 73.55 7.03 5.09 Favored 'General case' 0 CA--C 1.532 0.285 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.328 -179.966 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -87.77 -70.24 0.64 Allowed 'General case' 0 C--O 1.231 0.122 0 CA-C-O 120.881 0.372 . . . . 0.0 110.826 179.851 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 2.4 tt0 -164.31 -68.89 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.9 -179.926 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 171.22 -153.25 20.08 Favored Glycine 0 C--N 1.332 0.341 0 C-N-CA 120.857 -0.687 . . . . 0.0 112.523 -179.982 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 10.8 m-85 60.62 113.41 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.773 0.32 . . . . 0.0 110.956 -179.976 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 21.4 t -141.64 136.96 15.85 Favored Pre-proline 0 C--N 1.329 -0.311 0 CA-C-N 116.382 -0.372 . . . . 0.0 111.282 -179.96 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 54' ' ' PRO . . . . . 0.42 ' HA ' ' CD1' ' A' ' 41' ' ' TRP . 47.5 Cg_exo -55.73 -55.08 3.28 Favored 'Trans proline' 0 C--N 1.347 0.498 0 C-N-CA 122.586 2.191 . . . . 0.0 112.294 179.93 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . 71.96 -62.3 0.47 Allowed 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.375 -179.982 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . 0.402 ' HB2' ' CD2' ' A' ' 13' ' ' TYR . . . 70.76 -70.89 0.14 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.132 -179.822 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 57' ' ' TYR . . . . . 0.456 ' CD1' ' N ' ' A' ' 57' ' ' TYR . 0.8 OUTLIER -149.25 -62.87 0.23 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.999 179.766 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 58' ' ' VAL . . . . . 0.429 HG23 ' HG ' ' A' ' 10' ' ' LEU . 7.7 p 39.8 49.56 0.31 Allowed 'Isoleucine or valine' 0 CA--C 1.53 0.206 0 CA-C-N 116.218 -0.446 . . . . 0.0 112.113 179.861 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . 0.43 ' CD ' ' CD2' ' A' ' 10' ' ' LEU . 15.5 mttm 74.8 30.64 0.96 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.76 -179.688 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--N 1.33 -0.258 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.895 -179.757 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 1.8 mt . . . . . 0 CA--C 1.521 -0.146 0 CA-C-O 120.907 0.384 . . . . 0.0 110.992 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 22.3 t -144.28 -38.63 0.14 Allowed 'Isoleucine or valine' 0 N--CA 1.454 -0.242 0 CA-C-N 115.91 -0.586 . . . . 0.0 111.381 179.849 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 3.2 mt 67.79 159.45 0.15 Allowed 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.365 -0.38 . . . . 0.0 110.546 -179.618 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -108.79 -24.59 11.22 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.931 179.702 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 27.4 mt 52.54 50.17 18.82 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-N 116.196 -0.457 . . . . 0.0 111.003 179.997 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . 0.409 ' CD2' ' HG2' ' A' ' 27' ' ' LYS . 3.6 t80 75.65 152.31 0.13 Allowed 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 115.907 -0.588 . . . . 0.0 111.09 -179.989 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . 0.413 ' OD1' ' N ' ' A' ' 14' ' ' ASP . 0.4 OUTLIER -45.81 155.32 0.18 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.921 -0.581 . . . . 0.0 111.374 179.837 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' TYR . . . . . 0.438 ' CZ ' ' HB2' ' A' ' 54' ' ' PRO . 42.5 t80 -71.17 -66.57 0.6 Allowed 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.787 -179.966 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' GLN . . . . . 0.405 ' O ' ' CB ' ' A' ' 17' ' ' GLU . 18.5 tt0 -177.46 -34.51 0.01 OUTLIER 'General case' 0 CA--C 1.53 0.201 0 CA-C-N 116.306 -0.406 . . . . 0.0 111.469 -179.75 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . 0.432 ' N ' ' CG2' ' A' ' 24' ' ' THR . 34.3 mt-10 . . . . . 0 N--CA 1.467 0.408 0 CA-C-N 116.277 -0.419 . . . . 0.0 110.753 -179.618 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 13.9 tt0 . . . . . 0 C--O 1.232 0.179 0 CA-C-O 120.667 0.27 . . . . 0.0 111.054 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 35.4 t 59.7 78.92 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.243 0 CA-C-N 116.504 -0.317 . . . . 0.0 111.007 -179.883 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' THR . . . . . 0.432 ' CG2' ' N ' ' A' ' 17' ' ' GLU . 41.7 p -158.87 177.11 11.52 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-O 121.022 0.439 . . . . 0.0 111.496 -179.657 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -98.87 -161.45 0.88 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.684 -0.689 . . . . 0.0 110.329 179.541 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 3.2 mmtp -147.88 174.35 11.94 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.84 0.353 . . . . 0.0 111.124 179.516 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . 0.409 ' HG2' ' CD2' ' A' ' 13' ' ' TYR . 21.7 mtmm -57.37 102.14 0.08 Allowed 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.453 -179.854 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 45.5 37.05 6.33 Favored Glycine 0 C--N 1.332 0.32 0 C-N-CA 121.065 -0.588 . . . . 0.0 113.032 179.766 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 33.5 t0 -90.24 15.6 10.12 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.742 0.306 . . . . 0.0 111.396 179.817 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 2.4 mm 54.45 174.91 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.2 0 CA-C-O 120.943 0.401 . . . . 0.0 111.378 179.908 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . 0.603 ' N ' ' CD1' ' A' ' 31' ' ' LEU . 0.0 OUTLIER -177.84 -170.85 0.27 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.383 -179.313 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 86.8 m -122.94 163.06 21.09 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-O 121.12 0.486 . . . . 0.0 111.159 179.924 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . 0.5 ' CD2' ' N ' ' A' ' 33' ' ' LEU . 0.6 OUTLIER -120.93 -61.06 1.6 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.881 -0.599 . . . . 0.0 110.955 -179.762 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER 61.88 115.84 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.92 179.978 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 92.9 m-20 60.77 87.59 0.09 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.926 179.965 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 9.2 m -163.36 166.1 23.31 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.807 -179.988 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 4.2 m -145.87 -65.18 0.31 Allowed 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.015 179.975 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 18.9 p-10 -142.56 -49.14 0.35 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.907 -179.953 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -123.56 92.83 3.77 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.861 -179.915 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 40' ' ' ASP . . . . . 0.421 ' HB2' ' CE3' ' A' ' 42' ' ' TRP . 5.1 p30 -177.68 165.81 2.11 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.174 -0.467 . . . . 0.0 110.915 179.854 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 41' ' ' TRP . . . . . . . . . . . . . 10.2 p90 -134.54 -47.61 0.76 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.875 179.931 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 42' ' ' TRP . . . . . 0.421 ' CE3' ' HB2' ' A' ' 40' ' ' ASP . 1.0 OUTLIER 62.17 -81.24 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.99 179.987 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 5.2 pttt -178.32 103.1 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.811 179.915 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . 0.406 HG11 ' CG1' ' A' ' 46' ' ' VAL . 11.7 t -49.31 -41.89 15.31 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.899 179.816 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 3.8 tt0 58.28 41.35 23.5 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.112 -0.495 . . . . 0.0 111.238 179.689 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 46' ' ' VAL . . . . . 0.406 ' CG1' HG11 ' A' ' 44' ' ' VAL . 14.4 p -102.77 -24.09 4.16 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-O 120.92 0.39 . . . . 0.0 110.959 179.599 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 5.6 p30 -100.08 -171.23 2.0 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.617 179.664 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 23.2 t0 -109.91 63.26 0.6 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.811 0.339 . . . . 0.0 111.037 -179.879 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 54.6 ttt-85 -177.14 104.81 0.05 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.073 179.883 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 24.2 tp60 61.94 -81.57 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.121 -0.49 . . . . 0.0 111.043 179.763 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 127.75 -2.02 6.92 Favored Glycine 0 C--N 1.334 0.448 0 C-N-CA 120.795 -0.717 . . . . 0.0 112.962 -179.869 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 2.2 m-85 -44.66 -82.0 0.01 OUTLIER 'General case' 0 CA--C 1.53 0.178 0 CA-C-N 116.825 0.313 . . . . 0.0 111.395 -179.816 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 2.8 t 49.47 84.62 0.2 Allowed Pre-proline 0 C--N 1.332 -0.186 0 CA-C-N 116.467 -0.333 . . . . 0.0 111.308 179.912 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 54' ' ' PRO . . . . . 0.438 ' HB2' ' CZ ' ' A' ' 15' ' ' TYR . 56.1 Cg_exo -51.29 139.94 43.44 Favored 'Trans proline' 0 C--N 1.345 0.393 0 C-N-CA 122.54 2.16 . . . . 0.0 112.177 179.886 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -86.95 55.81 3.73 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.336 -179.757 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -94.62 36.91 1.14 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.433 179.209 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -175.79 -168.68 0.3 Allowed 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.655 -179.239 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 48.3 t 63.37 157.13 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.575 178.868 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 10.0 ptpt -55.92 120.5 7.51 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.945 179.952 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.329 -0.309 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.866 -179.9 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . 0.437 ' N ' ' CD1' ' A' ' 8' ' ' LEU . 0.0 OUTLIER . . . . . 0 C--O 1.231 0.103 0 CA-C-O 120.82 0.343 . . . . 0.0 110.869 . . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 98.9 t -111.99 -95.32 0.1 OUTLIER 'Isoleucine or valine' 0 CA--C 1.534 0.362 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.167 -179.965 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . 0.408 ' HB2' ' CG1' ' A' ' 58' ' ' VAL . 2.0 mt 166.49 -54.56 0.0 OUTLIER 'General case' 0 N--CA 1.464 0.233 0 CA-C-O 120.882 0.372 . . . . 0.0 110.92 179.953 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . 64.66 43.79 4.12 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.942 -179.473 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . 0.451 ' N ' HD23 ' A' ' 12' ' ' LEU . 0.0 OUTLIER -56.99 155.98 7.44 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.086 -179.999 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . 0.4 ' CD2' ' OH ' ' A' ' 57' ' ' TYR . 0.1 OUTLIER 77.88 -5.16 2.14 Favored 'General case' 0 N--CA 1.463 0.218 0 CA-C-N 116.005 -0.543 . . . . 0.0 111.777 -179.907 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . 0.429 ' HA ' ' O ' ' A' ' 25' ' ' MET . 5.8 p-10 43.47 95.77 0.01 OUTLIER 'General case' 0 N--CA 1.462 0.146 0 CA-C-O 120.893 0.378 . . . . 0.0 111.657 179.799 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 15' ' ' TYR . . . . . 0.434 ' CZ ' ' HG2' ' A' ' 54' ' ' PRO . 10.3 t80 -74.44 116.11 14.75 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.069 -179.915 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 5.6 pt20 -88.04 -166.0 1.47 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.679 179.867 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 1.6 pt-20 . . . . . 0 C--N 1.328 -0.348 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.897 -179.94 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 2.2 mp0 . . . . . 0 N--CA 1.457 -0.083 0 CA-C-O 120.749 0.309 . . . . 0.0 110.93 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 27.2 m -134.93 134.82 53.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.399 179.951 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 18.0 m -130.83 154.29 48.2 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.76 179.928 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 25' ' ' MET . . . . . 0.429 ' O ' ' HA ' ' A' ' 14' ' ' ASP . 31.2 mtm -150.09 57.49 0.96 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.959 0.409 . . . . 0.0 110.959 -179.94 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 2.4 tppt? -40.44 120.77 1.29 Allowed 'General case' 0 N--CA 1.465 0.312 0 CA-C-N 115.899 -0.591 . . . . 0.0 111.908 -179.789 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 4.6 mptt 53.61 174.15 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.011 -0.54 . . . . 0.0 111.44 179.624 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -82.34 61.45 4.71 Favored Glycine 0 N--CA 1.452 -0.299 0 C-N-CA 120.904 -0.665 . . . . 0.0 112.241 179.786 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -96.87 29.86 2.89 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.909 0.385 . . . . 0.0 110.883 179.91 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . 0.41 HG23 ' HB2' ' A' ' 8' ' ' LEU . 0.4 OUTLIER 51.97 178.08 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.238 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.187 -179.939 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . 0.548 ' N ' ' CD1' ' A' ' 31' ' ' LEU . 0.0 OUTLIER -164.69 18.82 0.05 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.893 -179.057 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 32' ' ' THR . . . . . 0.446 ' O ' ' CD2' ' A' ' 31' ' ' LEU . 0.6 OUTLIER 52.02 178.2 0.02 OUTLIER 'General case' 0 N--CA 1.465 0.275 0 CA-C-O 120.858 0.361 . . . . 0.0 111.165 179.924 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -179.85 163.99 1.16 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.927 0.394 . . . . 0.0 111.102 -179.981 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 4.1 mp -102.16 35.38 2.41 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.938 -0.574 . . . . 0.0 110.798 179.935 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 1.7 m-20 64.68 134.76 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.919 -179.961 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 4.6 m -103.4 -172.73 2.16 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.905 179.918 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -177.22 67.89 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.984 179.971 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 35.7 t-20 -172.81 -94.01 0.01 OUTLIER 'General case' 0 CA--C 1.532 0.27 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.773 179.789 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER 173.58 38.4 0.0 OUTLIER 'General case' 0 C--O 1.232 0.179 0 CA-C-O 120.672 0.272 . . . . 0.0 111.071 179.904 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 40' ' ' ASP . . . . . 0.479 ' O ' ' CG ' ' A' ' 41' ' ' TRP . 2.4 p-10 176.26 87.22 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.571 -0.286 . . . . 0.0 111.088 179.881 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 41' ' ' TRP . . . . . 0.49 ' CH2' ' CD2' ' A' ' 52' ' ' PHE . 66.8 p-90 45.69 -174.89 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.285 0 CA-C-N 116.07 -0.514 . . . . 0.0 111.603 179.833 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 42' ' ' TRP . . . . . . . . . . . . . 1.3 m95 175.82 86.38 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.833 -179.989 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 9.7 mttp 59.16 61.61 2.04 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.878 179.842 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . 0.431 ' CG2' ' CG2' ' A' ' 53' ' ' VAL . 82.0 t -77.72 83.36 0.88 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.942 179.827 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 6.3 mp0 -101.75 101.72 12.25 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.939 -179.89 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 11.7 t -58.85 -30.47 42.82 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.047 179.858 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 63.4 m-20 -150.97 -57.36 0.16 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.773 179.888 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 8.9 p-10 -179.2 149.2 0.4 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.055 -0.521 . . . . 0.0 110.878 179.902 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 49' ' ' ARG . . . . . 0.471 ' HG2' ' O ' ' A' ' 49' ' ' ARG . 0.0 OUTLIER 76.21 -9.33 1.48 Allowed 'General case' 0 CA--C 1.536 0.405 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.629 179.901 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 24.0 mm-40 -94.37 -168.73 1.9 Allowed 'General case' 0 C--N 1.332 -0.17 0 CA-C-O 120.786 0.327 . . . . 0.0 110.835 179.636 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 134.65 166.76 11.26 Favored Glycine 0 C--N 1.334 0.442 0 C-N-CA 120.812 -0.708 . . . . 0.0 112.693 179.877 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 52' ' ' PHE . . . . . 0.49 ' CD2' ' CH2' ' A' ' 41' ' ' TRP . 5.2 m-85 62.86 107.9 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.839 0.352 . . . . 0.0 111.161 179.855 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 53' ' ' VAL . . . . . 0.431 ' CG2' ' CG2' ' A' ' 44' ' ' VAL . 30.2 m -155.88 105.0 2.12 Favored Pre-proline 0 CA--C 1.531 0.242 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.146 179.752 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 54' ' ' PRO . . . . . 0.434 ' HG2' ' CZ ' ' A' ' 15' ' ' TYR . 32.1 Cg_exo -59.02 93.97 0.08 OUTLIER 'Trans proline' 0 C--N 1.346 0.446 0 C-N-CA 122.539 2.16 . . . . 0.0 112.368 -179.775 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -61.47 89.94 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.912 179.826 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -53.04 -80.26 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.209 -0.451 . . . . 0.0 111.174 -179.793 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 57' ' ' TYR . . . . . 0.411 ' CD2' ' O ' ' A' ' 57' ' ' TYR . 20.2 p90 -133.57 98.09 4.11 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.39 -0.368 . . . . 0.0 110.729 179.802 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 58' ' ' VAL . . . . . 0.408 ' CG1' ' HB2' ' A' ' 10' ' ' LEU . 1.8 t -133.11 167.97 25.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.371 -179.709 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -79.74 148.21 31.59 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.862 179.817 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.329 -0.285 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.049 -179.971 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.231 0.122 0 CA-C-O 120.763 0.316 . . . . 0.0 110.977 . . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 0.7 OUTLIER -164.36 172.64 0.22 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.195 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.074 -179.93 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -132.36 -37.94 1.07 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.51 -179.785 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . 73.52 67.39 0.1 Allowed 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 121.018 0.437 . . . . 0.0 110.123 -178.972 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 1.2 mp -80.55 12.15 3.27 Favored 'General case' 0 CA--C 1.531 0.213 0 CA-C-N 115.938 -0.574 . . . . 0.0 111.707 -179.639 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . 0.461 ' N ' ' CD1' ' A' ' 13' ' ' TYR . 0.0 OUTLIER -50.8 177.61 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.171 0 CA-C-O 120.903 0.382 . . . . 0.0 111.175 179.983 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 9.7 p30 -173.14 36.85 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.755 179.859 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 15' ' ' TYR . . . . . 0.4 ' CD1' ' N ' ' A' ' 16' ' ' GLN . 7.1 t80 -83.73 153.49 24.13 Favored 'General case' 0 C--N 1.333 -0.15 0 CA-C-N 116.086 -0.506 . . . . 0.0 111.1 -179.849 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 16' ' ' GLN . . . . . 0.4 ' N ' ' CD1' ' A' ' 15' ' ' TYR . 10.0 mp0 -145.87 90.16 1.96 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.865 179.908 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 4.4 tt0 . . . . . 0 C--N 1.329 -0.32 0 CA-C-N 116.35 -0.387 . . . . 0.0 111.146 -179.76 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 C--O 1.23 0.074 0 CA-C-O 120.795 0.331 . . . . 0.0 110.868 . . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 38.8 t -148.02 110.64 0.68 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.078 -179.978 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 2.7 t -179.17 104.52 0.03 OUTLIER 'General case' 0 N--CA 1.462 0.16 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.954 179.941 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 25' ' ' MET . . . . . 0.423 ' HG2' ' CE2' ' A' ' 13' ' ' TYR . 2.2 mpp? -140.03 170.44 15.85 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.98 179.888 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -176.07 -179.37 1.12 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.876 179.979 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 13.1 mmmt 71.18 -169.75 0.15 Allowed 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.938 -179.994 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -116.06 25.04 9.64 Favored Glycine 0 C--N 1.332 0.337 0 C-N-CA 120.815 -0.707 . . . . 0.0 112.622 -179.842 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 56.4 t0 -65.3 120.97 13.75 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.841 0.353 . . . . 0.0 110.582 179.769 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 5.2 mt -59.71 166.49 0.62 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.114 -179.684 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . 0.441 ' CD1' ' N ' ' A' ' 31' ' ' LEU . 0.0 OUTLIER -148.22 -167.37 2.79 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.132 -178.928 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 14.8 t -102.36 -47.94 4.33 Favored 'General case' 0 C--N 1.333 -0.127 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.849 179.964 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER 64.99 170.86 0.2 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.844 179.81 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -93.05 -77.43 0.44 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.985 179.984 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 20.0 t-20 -138.03 -44.24 0.52 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.952 -179.936 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 3.1 t 69.02 112.25 0.05 OUTLIER 'General case' 0 N--CA 1.462 0.168 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.866 179.991 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 8.9 t -177.5 160.8 1.66 Allowed 'General case' 0 C--O 1.231 0.124 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.815 179.873 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 8.7 m120 60.41 172.82 0.09 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.888 -179.913 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -114.83 107.63 15.67 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.986 -180.0 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 40' ' ' ASP . . . . . 0.46 ' O ' ' N ' ' A' ' 42' ' ' TRP . 1.5 m-20 -178.63 81.44 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.081 -0.508 . . . . 0.0 110.893 179.944 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 41' ' ' TRP . . . . . 0.576 ' CG ' ' N ' ' A' ' 42' ' ' TRP . 0.0 OUTLIER 65.18 -65.05 0.16 Allowed 'General case' 0 CA--C 1.532 0.258 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.931 -179.906 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 42' ' ' TRP . . . . . 0.576 ' N ' ' CG ' ' A' ' 41' ' ' TRP . 3.8 t-105 57.89 115.93 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.189 -0.46 . . . . 0.0 111.402 -179.869 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 2.5 ptpp? -71.95 -177.21 1.94 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.373 179.417 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . 0.424 ' HB ' ' CG1' ' A' ' 53' ' ' VAL . 0.3 OUTLIER -118.53 -40.87 2.28 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-O 120.868 0.366 . . . . 0.0 111.131 179.975 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER 61.49 114.1 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.022 -179.964 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 21.4 t -141.04 -57.31 0.25 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.048 179.88 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 7.9 m-80 -129.81 -174.82 3.41 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.752 179.93 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 16.6 m-20 -68.44 73.22 0.22 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.886 179.984 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -156.01 26.94 0.37 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.959 -179.954 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER 56.94 -167.61 0.12 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.393 -0.367 . . . . 0.0 110.943 179.919 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -91.18 -108.58 1.5 Allowed Glycine 0 C--N 1.332 0.349 0 C-N-CA 120.958 -0.639 . . . . 0.0 112.538 179.993 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 19.6 m-85 55.41 79.53 0.15 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.86 0.362 . . . . 0.0 110.562 -179.941 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 53' ' ' VAL . . . . . 0.424 ' CG1' ' HB ' ' A' ' 44' ' ' VAL . 1.5 p 179.0 92.73 0.17 Allowed Pre-proline 0 C--N 1.327 -0.377 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.708 -179.498 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_exo -52.56 130.85 38.41 Favored 'Trans proline' 0 C--N 1.346 0.424 0 C-N-CA 122.535 2.156 . . . . 0.0 112.295 -179.878 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -64.15 -52.37 59.37 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.057 -0.519 . . . . 0.0 110.969 -179.979 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . 0.437 ' O ' ' HD1' ' A' ' 57' ' ' TYR . . . 58.61 47.12 13.67 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.058 179.987 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 57' ' ' TYR . . . . . 0.476 ' CD1' ' C ' ' A' ' 57' ' ' TYR . 0.0 OUTLIER 81.56 147.15 0.09 Allowed 'General case' 0 N--CA 1.464 0.271 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.688 -179.827 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 8.2 p -178.49 -47.69 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.365 -179.788 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER 178.79 -167.87 0.08 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.361 -0.382 . . . . 0.0 110.788 -179.91 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--N 1.33 -0.281 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.815 179.925 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 69.3 tt0 . . . . . 0 C--O 1.232 0.132 0 CA-C-O 120.732 0.301 . . . . 0.0 110.914 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 2.1 tp -178.5 -71.71 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.831 179.876 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . 0.4 ' HA ' HG12 ' A' ' 58' ' ' VAL . 1.5 m -163.51 64.67 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.333 -0.146 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.092 179.908 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -61.06 159.31 11.91 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.189 -0.459 . . . . 0.0 111.005 179.941 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -71.91 -20.89 61.71 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.099 -0.501 . . . . 0.0 111.384 179.933 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . 0.428 HD12 ' CD2' ' A' ' 57' ' ' TYR . 0.5 OUTLIER 74.94 16.26 2.94 Favored 'General case' 0 N--CA 1.465 0.313 0 CA-C-N 116.33 -0.396 . . . . 0.0 111.277 179.96 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER 177.19 -77.72 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.181 0 CA-C-O 120.661 0.267 . . . . 0.0 110.97 179.851 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER 169.29 -34.17 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.442 -0.345 . . . . 0.0 110.905 -179.805 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' TYR . . . . . 0.432 ' CE2' HG11 ' A' ' 53' ' ' VAL . 19.4 t80 68.25 -62.58 0.36 Allowed 'General case' 0 N--CA 1.465 0.285 0 CA-C-N 116.145 -0.479 . . . . 0.0 111.265 -179.847 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 13.1 pt20 44.94 88.65 0.02 OUTLIER 'General case' 0 N--CA 1.463 0.201 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.391 -179.769 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 6.3 tp10 -58.11 -63.72 1.16 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.969 179.918 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -176.69 106.85 0.07 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.917 -179.953 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER 59.61 161.54 0.1 OUTLIER Pre-proline 0 C--N 1.33 -0.261 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.889 179.975 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.55 63.16 1.67 Allowed 'Trans proline' 0 C--N 1.345 0.387 0 C-N-CA 122.607 2.204 . . . . 0.0 112.306 -179.986 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -134.68 -61.6 0.76 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.871 179.987 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -88.17 -169.58 2.63 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.939 179.946 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 3.0 m -59.21 101.4 0.1 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.202 179.961 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 75.0 p -135.44 105.68 6.34 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 116.108 -0.497 . . . . 0.0 111.004 -179.849 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' MET . . . . . . . . . . . . . 1.8 mpp? -87.54 170.06 11.64 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.673 179.877 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 8.3 tptm -156.1 127.47 7.15 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.165 -179.824 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 10.8 ttmt 62.85 -79.79 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.147 179.896 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 179.16 61.05 0.08 OUTLIER Glycine 0 N--CA 1.452 -0.284 0 C-N-CA 120.667 -0.778 . . . . 0.0 112.44 -179.973 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 38.0 m-20 -83.97 4.16 31.0 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.565 0.221 . . . . 0.0 111.249 179.872 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 3.4 mm 57.66 172.21 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-O 120.972 0.415 . . . . 0.0 111.199 179.943 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . 0.608 ' N ' ' CD1' ' A' ' 31' ' ' LEU . 0.0 OUTLIER -173.78 151.12 1.78 Allowed 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.002 -0.544 . . . . 0.0 110.702 -179.184 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -79.59 175.72 10.36 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.207 179.607 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -173.08 173.07 3.76 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.009 0.433 . . . . 0.0 111.418 -179.788 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 1.3 tt -134.95 97.67 3.81 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.899 -0.591 . . . . 0.0 110.799 -179.944 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 9.8 m-20 62.2 -164.01 0.25 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.784 -179.924 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 4.4 m 69.56 43.36 1.01 Allowed 'General case' 0 N--CA 1.462 0.153 0 CA-C-O 120.897 0.38 . . . . 0.0 110.833 -179.891 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 54.0 m -110.14 -32.42 7.0 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.108 -0.497 . . . . 0.0 110.829 179.9 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 21.5 t-20 -113.54 -52.62 2.75 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.838 -179.981 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 4.6 ttmt -78.0 -58.37 3.3 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.902 179.947 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 19.4 m-20 -105.65 -176.12 2.99 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.854 179.976 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' TRP . . . . . 0.449 ' NE1' ' CZ2' ' A' ' 42' ' ' TRP . 11.9 p-90 -177.1 57.36 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.832 -179.972 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' TRP . . . . . 0.449 ' CZ2' ' NE1' ' A' ' 41' ' ' TRP . 1.8 m-90 -152.66 29.67 0.53 Allowed 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.982 -179.965 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 4.6 tttp -147.06 135.14 21.5 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.893 0.378 . . . . 0.0 111.165 -179.986 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 25.2 m -155.94 -174.97 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.914 179.811 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 31.9 tt0 -145.38 87.35 1.8 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.911 0.386 . . . . 0.0 110.902 179.942 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 20.1 t -80.11 -30.87 13.03 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.026 179.949 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 5.8 p30 -159.28 49.31 0.33 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.877 179.988 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 13.0 m-20 61.7 82.39 0.17 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.869 179.946 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -177.02 163.34 2.14 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.932 179.946 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 1.2 pt20 -69.93 86.12 0.52 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.814 179.919 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -58.34 152.81 28.89 Favored Glycine 0 C--N 1.332 0.351 0 C-N-CA 120.911 -0.661 . . . . 0.0 112.533 -179.967 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 3.8 m-85 -139.18 29.58 2.23 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.781 0.324 . . . . 0.0 110.911 179.896 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' VAL . . . . . 0.432 HG11 ' CE2' ' A' ' 15' ' ' TYR . 25.4 m -89.35 160.27 42.76 Favored Pre-proline 0 C--N 1.33 -0.278 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.965 -179.97 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_exo -54.78 -63.11 0.22 Allowed 'Trans proline' 0 C--N 1.346 0.413 0 C-N-CA 122.609 2.206 . . . . 0.0 112.124 179.934 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . 65.76 23.53 11.49 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.311 179.98 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . 0.447 ' O ' ' CG ' ' A' ' 57' ' ' TYR . . . -91.12 145.85 24.33 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.372 -0.376 . . . . 0.0 110.766 179.817 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' TYR . . . . . 0.447 ' CG ' ' O ' ' A' ' 56' ' ' ALA . 36.7 p90 44.35 39.79 3.32 Favored 'General case' 0 N--CA 1.463 0.216 0 CA-C-O 120.918 0.39 . . . . 0.0 111.208 -179.823 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . 0.426 ' HA ' ' CD1' ' A' ' 12' ' ' LEU . 73.1 t -74.27 -80.96 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 115.976 -0.556 . . . . 0.0 111.11 -179.944 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 60.0 mmtt -147.88 24.78 1.06 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.502 -0.317 . . . . 0.0 111.126 -179.837 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 42.61 35.17 0.64 Allowed 'General case' 0 N--CA 1.464 0.226 0 CA-C-N 116.322 -0.399 . . . . 0.0 111.535 179.939 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 1.5 tp -59.19 127.18 30.88 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.976 179.969 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 2.5 t0 . . . . . 0 C--O 1.248 1.0 0 CA-C-O 118.3 -0.857 . . . . 0.0 110.869 179.999 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--O 1.231 0.106 0 CA-C-O 120.796 0.332 . . . . 0.0 110.929 . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -176.27 167.33 2.86 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.831 -179.967 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 20.6 t -118.15 141.17 38.58 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.202 0 CA-C-N 116.277 -0.419 . . . . 0.0 111.253 -179.816 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 1.4 mt -99.17 -26.76 14.09 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.88 179.822 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . 65.27 51.71 1.57 Allowed 'General case' 0 C--N 1.333 -0.145 0 CA-C-N 116.209 -0.45 . . . . 0.0 111.124 -179.918 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 1.3 mp -56.96 124.89 20.23 Favored 'General case' 0 C--O 1.233 0.191 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.872 179.943 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 3.3 m-85 61.87 63.02 1.17 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.835 -179.89 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 13.5 m-20 -60.73 -80.83 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.012 179.98 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER 61.84 -165.27 0.23 Allowed 'General case' 0 C--N 1.332 -0.165 0 CA-C-N 116.412 -0.358 . . . . 0.0 110.908 179.987 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -69.91 -170.26 0.32 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.888 179.946 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -103.38 -178.49 3.68 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.901 179.906 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.5 -32.25 73.8 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.889 179.937 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' SER . . . . . 0.413 ' CB ' ' CD ' ' A' ' 20' ' ' PRO . 1.2 m -178.9 -61.61 0.0 OUTLIER Pre-proline 0 C--N 1.329 -0.292 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.952 179.892 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' PRO . . . . . 0.413 ' CD ' ' CB ' ' A' ' 19' ' ' SER . 58.7 Cg_endo -71.55 137.39 30.32 Favored 'Trans proline' 0 C--N 1.347 0.461 0 C-N-CA 122.588 2.192 . . . . 0.0 112.349 179.972 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 13.3 mmp_? 63.43 128.62 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.998 -179.993 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 5.5 pm0 -80.77 147.91 30.29 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.136 -0.483 . . . . 0.0 110.961 179.969 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 7.9 t -139.65 161.03 27.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.916 -179.938 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 12.4 t -149.2 -161.78 1.42 Allowed 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.907 -179.9 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER 75.73 174.37 0.24 Allowed 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.84 0.353 . . . . 0.0 111.079 179.974 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -176.8 -164.83 0.11 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.877 179.985 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 2.0 mtpm? 62.97 165.92 0.12 Allowed 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.944 -179.947 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -63.43 -121.8 0.01 OUTLIER Glycine 0 N--CA 1.451 -0.334 0 C-N-CA 120.724 -0.751 . . . . 0.0 112.54 -179.972 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER 62.95 144.99 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.792 0.33 . . . . 0.0 110.987 -179.896 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 10.6 mm -85.4 163.27 2.73 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.354 -0.385 . . . . 0.0 110.998 179.989 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . 0.417 HD12 ' N ' ' A' ' 32' ' ' THR . 0.2 OUTLIER -130.31 -106.07 0.28 Allowed 'General case' 0 CA--C 1.537 0.476 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.885 -179.891 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' THR . . . . . 0.417 ' N ' HD12 ' A' ' 31' ' ' LEU . 51.9 m -168.51 161.95 11.91 Favored 'General case' 0 N--CA 1.462 0.132 0 CA-C-O 120.83 0.348 . . . . 0.0 110.819 179.909 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -149.49 -170.08 3.54 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.916 179.914 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -150.12 102.84 3.13 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.909 179.868 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 77.9 m-20 62.58 -80.12 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.937 -179.895 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 1.2 m 62.72 150.27 0.03 OUTLIER 'General case' 0 C--N 1.333 -0.144 0 CA-C-O 120.917 0.389 . . . . 0.0 111.018 179.882 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 1.4 t -145.82 -47.93 0.21 Allowed 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.688 179.873 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 51.9 p-10 -100.47 -161.6 0.88 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.526 179.771 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . 0.409 ' O ' ' CD1' ' A' ' 41' ' ' TRP . 0.0 OUTLIER -47.72 97.77 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.916 0.389 . . . . 0.0 111.004 179.922 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 6.7 p-10 -69.14 122.9 19.73 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.213 -179.719 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' TRP . . . . . 0.424 ' CE3' ' HA ' ' A' ' 42' ' ' TRP . 49.2 p-90 -177.12 -35.03 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.291 179.905 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' TRP . . . . . 0.461 ' CE3' ' N ' ' A' ' 42' ' ' TRP . 0.0 OUTLIER -46.82 -96.84 0.0 OUTLIER 'General case' 0 CA--C 1.535 0.387 0 CA-C-N 116.399 -0.364 . . . . 0.0 111.935 -179.305 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 10.9 tttp -89.29 128.38 35.86 Favored 'General case' 0 C--N 1.334 -0.092 0 CA-C-O 120.849 0.357 . . . . 0.0 111.042 -179.836 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 40.3 t -114.15 -31.89 2.04 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.051 -179.995 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 5.2 tm-20 62.99 33.58 14.73 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.946 -179.991 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 10.2 p -84.28 151.92 3.81 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.041 179.93 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 2.1 t-20 -62.92 166.65 5.45 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.998 -179.973 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 9.3 m-20 61.08 24.56 14.65 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.125 -0.488 . . . . 0.0 111.11 179.932 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 177.46 -170.02 0.08 Allowed 'General case' 0 C--N 1.333 -0.129 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.748 179.896 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 1.7 tt0 -103.52 -57.34 2.05 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.856 179.972 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 145.93 90.2 0.1 OUTLIER Glycine 0 C--N 1.332 0.331 0 C-N-CA 120.917 -0.659 . . . . 0.0 112.555 -179.986 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 22.0 m-85 -164.23 31.28 0.07 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.735 0.302 . . . . 0.0 110.953 179.991 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 19.0 m -62.24 129.74 92.47 Favored Pre-proline 0 C--N 1.329 -0.295 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.999 179.92 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 52.2 Cg_exo -55.17 -47.42 26.38 Favored 'Trans proline' 0 C--N 1.349 0.567 0 C-N-CA 122.43 2.087 . . . . 0.0 112.266 179.983 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . 67.49 -70.97 0.11 Allowed 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.035 -179.992 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . 63.06 -80.29 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.211 -0.449 . . . . 0.0 111.189 -179.981 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 32.8 p90 -131.01 128.97 41.43 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.809 179.926 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 36.6 t -152.36 -70.99 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.165 -179.884 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 11.3 mtmt -144.59 -68.02 0.32 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.891 -179.875 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 7.3 pttt -121.68 89.25 3.09 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.993 -179.89 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 2.3 pt? -176.38 130.46 0.21 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.83 179.898 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 30.3 m-20 . . . . . 0 C--O 1.249 1.066 0 CA-C-O 118.285 -0.864 . . . . 0.0 110.978 179.982 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 5.9 pt-20 . . . . . 0 CA--C 1.528 0.125 0 CA-C-O 120.848 0.356 . . . . 0.0 111.462 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 9.7 mt -159.94 -175.29 5.03 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.901 -179.998 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 11.0 t -146.08 80.78 0.13 Allowed 'Isoleucine or valine' 0 C--O 1.232 0.176 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.116 -179.914 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -62.1 -177.23 0.12 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.391 -0.368 . . . . 0.0 110.903 179.95 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -87.37 -27.58 22.71 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.283 -179.798 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 4.6 tp 75.1 -62.97 0.43 Allowed 'General case' 0 N--CA 1.464 0.249 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.803 -179.983 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -136.45 34.26 2.74 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.82 179.909 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 2.4 p30 46.88 -174.43 0.01 OUTLIER 'General case' 0 N--CA 1.463 0.194 0 CA-C-N 115.978 -0.555 . . . . 0.0 111.629 179.938 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' TYR . . . . . 0.419 ' CE1' ' HD2' ' A' ' 54' ' ' PRO . 7.0 t80 -119.41 -26.87 5.71 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 116.094 -0.503 . . . . 0.0 111.245 -179.862 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 8.3 tt0 64.85 120.02 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 120.95 0.405 . . . . 0.0 110.75 -179.759 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 26.9 pt-20 -118.71 135.16 54.63 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.233 -0.439 . . . . 0.0 111.024 -179.992 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 8.7 tptm -82.79 134.21 35.12 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.624 179.743 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 62.63 165.56 0.11 Allowed Pre-proline 0 C--N 1.328 -0.356 0 CA-C-N 116.394 -0.366 . . . . 0.0 110.529 -179.824 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 11.6 Cg_endo -54.93 -22.17 29.29 Favored 'Trans proline' 0 C--N 1.347 0.454 0 C-N-CA 122.641 2.227 . . . . 0.0 112.381 179.959 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -78.28 -168.21 1.26 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.31 -0.405 . . . . 0.0 110.81 179.899 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 4.9 mm-40 62.46 -178.24 0.14 Allowed 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.974 179.95 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 17.7 t -124.62 150.68 29.56 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.156 -0.474 . . . . 0.0 111.187 -179.972 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 10.3 t -140.82 -169.04 2.72 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.884 179.909 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' MET . . . . . . . . . . . . . 7.2 ptp -167.34 62.32 0.08 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.936 179.971 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 13.1 mmtt -61.63 166.21 4.4 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.88 -179.994 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 3.3 ttpt 60.4 -169.66 0.15 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.837 179.913 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -95.78 35.79 4.15 Favored Glycine 0 N--CA 1.45 -0.403 0 C-N-CA 120.805 -0.712 . . . . 0.0 112.55 179.927 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 12.4 p30 -57.79 172.16 0.42 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.713 0.292 . . . . 0.0 110.891 -179.971 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -123.13 -172.33 0.73 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.012 -179.862 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . 0.447 ' N ' ' CD1' ' A' ' 31' ' ' LEU . 0.0 OUTLIER -149.55 -177.01 5.63 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.815 -179.833 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 15.4 t -104.26 -47.0 4.26 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.072 -179.928 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER 66.5 152.78 0.07 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.785 179.924 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 14.8 tp -57.95 -62.29 1.92 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.888 179.958 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 34.4 t30 -147.05 -76.95 0.18 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.83 179.861 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER 172.86 127.35 0.02 OUTLIER 'General case' 0 N--CA 1.462 0.125 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.942 179.932 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' THR . . . . . 0.424 ' CG2' ' CH2' ' A' ' 42' ' ' TRP . 3.2 t 179.34 127.11 0.07 Allowed 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.801 179.981 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 25.2 m-80 -59.4 -82.35 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.886 179.966 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 2.4 tttp 46.9 -166.71 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.797 0.332 . . . . 0.0 111.204 179.804 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . 0.408 ' O ' ' CE3' ' A' ' 41' ' ' TRP . 1.5 t0 -96.41 85.07 3.83 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.88 179.733 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' TRP . . . . . 0.457 ' CG ' ' N ' ' A' ' 42' ' ' TRP . 0.0 OUTLIER 85.39 170.95 0.07 Allowed 'General case' 0 N--CA 1.466 0.367 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.788 -179.806 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' TRP . . . . . 0.457 ' N ' ' CG ' ' A' ' 41' ' ' TRP . 6.3 t-105 -155.87 141.43 17.8 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.864 -179.93 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 23.3 mttp -58.4 111.6 1.28 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.949 -179.943 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 23.1 t -99.1 76.46 0.65 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.189 -0.46 . . . . 0.0 111.12 179.971 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 3.1 tm-20 -66.28 -58.3 5.66 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.847 179.957 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 2.5 t 68.33 30.1 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.029 179.915 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 8.8 m120 63.39 35.1 12.44 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.94 179.959 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 1.2 t70 -179.33 167.21 1.5 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.91 179.844 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 25.3 mmm180 55.42 -165.95 0.11 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.025 179.991 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 5.8 mm-40 -80.61 -74.67 0.3 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.95 -179.965 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 153.73 -22.95 0.72 Allowed Glycine 0 C--N 1.333 0.415 0 C-N-CA 120.846 -0.692 . . . . 0.0 112.592 -179.965 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 42.9 m-85 -55.89 96.35 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 120.817 0.341 . . . . 0.0 111.128 -179.975 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 12.2 t -150.82 92.88 3.8 Favored Pre-proline 0 C--N 1.328 -0.36 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.046 179.9 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 54' ' ' PRO . . . . . 0.419 ' HD2' ' CE1' ' A' ' 15' ' ' TYR . 51.3 Cg_exo -53.12 87.46 0.03 OUTLIER 'Trans proline' 0 C--N 1.345 0.365 0 C-N-CA 122.617 2.211 . . . . 0.0 112.386 -179.971 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -60.32 -25.39 65.75 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.047 179.928 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . 64.48 -78.09 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.19 -179.915 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 57' ' ' TYR . . . . . 0.401 ' O ' ' CD1' ' A' ' 57' ' ' TYR . 47.2 p90 -161.47 127.68 3.8 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.028 179.955 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 24.2 t -145.78 126.82 7.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.018 179.853 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 8.9 mmtt 60.56 -167.82 0.18 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.756 -179.868 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 20.4 mttt -58.03 -77.34 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.999 -179.972 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 14.6 tp 63.1 -78.31 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.024 -179.993 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 15.2 t0 . . . . . 0 C--O 1.249 1.049 0 CA-C-O 118.233 -0.889 . . . . 0.0 110.906 179.985 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.231 0.125 0 CA-C-O 120.81 0.338 . . . . 0.0 110.966 . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -132.49 79.25 1.84 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.879 179.953 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 15.1 m -150.82 44.34 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.218 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.046 179.942 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -51.08 113.94 1.06 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.12 -179.899 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -56.45 94.11 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.185 -0.462 . . . . 0.0 111.03 179.866 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . 0.425 HD11 ' CE1' ' A' ' 57' ' ' TYR . 0.6 OUTLIER -55.0 -24.93 26.62 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.184 -179.958 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -138.17 84.9 2.06 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.398 -0.364 . . . . 0.0 111.069 -179.959 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -81.35 -160.2 0.32 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.623 179.711 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' TYR . . . . . 0.416 ' CD1' ' HB ' ' A' ' 24' ' ' THR . 0.9 OUTLIER 76.77 -164.8 0.05 Allowed 'General case' 0 N--CA 1.464 0.266 0 CA-C-O 120.76 0.314 . . . . 0.0 111.032 179.745 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 5.3 mt-30 75.6 -67.48 0.24 Allowed 'General case' 0 C--N 1.333 -0.129 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.787 -179.769 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 6.6 tt0 63.1 -78.71 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.014 179.933 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER 58.71 48.1 12.02 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 120.876 0.369 . . . . 0.0 110.975 179.884 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 9.3 t -178.1 149.18 0.68 Allowed Pre-proline 0 C--N 1.329 -0.316 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.895 179.966 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 44.3 Cg_endo -68.28 -34.15 22.19 Favored 'Trans proline' 0 C--N 1.346 0.437 0 C-N-CA 122.646 2.231 . . . . 0.0 112.216 179.999 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 2.7 tpp180 -107.4 66.2 0.66 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.782 -179.978 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 2.1 mt-10 -149.67 -177.13 5.7 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.968 -179.905 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 7.4 t -132.48 154.94 40.83 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.02 179.904 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' THR . . . . . 0.416 ' HB ' ' CD1' ' A' ' 15' ' ' TYR . 0.7 OUTLIER -105.6 -77.7 0.58 Allowed 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.217 -179.883 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' MET . . . . . 0.407 ' HG2' ' O ' ' A' ' 24' ' ' THR . 0.0 OUTLIER 47.77 -174.34 0.01 OUTLIER 'General case' 0 CA--C 1.53 0.188 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.432 -179.815 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -178.23 104.72 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.299 -0.409 . . . . 0.0 110.894 -179.935 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 9.7 ptpp? 178.84 165.45 0.87 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.828 179.864 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -95.21 23.0 35.46 Favored Glycine 0 N--CA 1.45 -0.417 0 C-N-CA 120.773 -0.727 . . . . 0.0 112.519 179.941 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 10.7 m-20 -72.29 165.15 25.04 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.736 0.303 . . . . 0.0 110.788 179.945 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 5.4 mm -86.24 167.25 1.83 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.078 180.0 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . 0.496 ' N ' ' CD1' ' A' ' 31' ' ' LEU . 0.0 OUTLIER -153.11 166.44 32.46 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.78 -179.719 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 76.5 m -103.71 160.14 15.02 Favored 'General case' 0 N--CA 1.462 0.13 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.043 -179.97 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 5.0 mt -122.93 -169.83 1.99 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.938 -179.94 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 27.9 tp -161.51 86.33 0.66 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.831 179.976 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 3.3 m120 61.62 81.83 0.18 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.82 179.929 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 13.2 p -125.24 -79.24 0.61 Allowed 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.961 179.966 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 51.9 m 62.39 145.1 0.02 OUTLIER 'General case' 0 C--N 1.333 -0.152 0 CA-C-N 116.231 -0.441 . . . . 0.0 111.078 179.993 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER 56.69 168.77 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.054 179.894 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 5.1 mmtm 59.0 -111.78 0.57 Allowed 'General case' 0 CA--C 1.534 0.335 0 CA-C-N 116.086 -0.507 . . . . 0.0 110.898 179.994 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 59.9 t0 -178.46 -68.6 0.01 OUTLIER 'General case' 0 C--O 1.231 0.085 0 CA-C-O 120.829 0.347 . . . . 0.0 110.867 179.99 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' TRP . . . . . . . . . . . . . 43.0 p90 -73.99 125.41 28.2 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.867 -179.974 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' TRP . . . . . . . . . . . . . 4.8 m95 -167.59 81.18 0.19 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.911 -179.951 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 7.9 mtpp 58.29 91.01 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.027 179.968 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . 0.401 ' CG2' ' HB ' ' A' ' 53' ' ' VAL . 18.8 t -89.73 139.65 17.15 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.111 179.937 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 1.3 pt-20 -160.54 137.63 9.15 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.889 179.943 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 12.4 p -156.43 -45.61 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.32 -0.4 . . . . 0.0 111.156 -179.919 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 2.1 t-20 -178.09 37.91 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.91 -179.923 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 46.2 m-20 -136.12 -70.04 0.48 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.951 179.986 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 31.6 mtp85 -157.64 -177.63 6.73 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.838 179.931 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 10.5 mm-40 -112.38 140.32 47.2 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.931 179.997 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 136.82 153.69 6.52 Favored Glycine 0 C--N 1.332 0.338 0 C-N-CA 120.956 -0.64 . . . . 0.0 112.497 179.956 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 13.0 p90 -59.36 158.98 8.5 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.768 0.318 . . . . 0.0 110.998 -179.971 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 53' ' ' VAL . . . . . 0.401 ' HB ' ' CG2' ' A' ' 44' ' ' VAL . 22.0 t -147.97 139.31 13.66 Favored Pre-proline 0 C--N 1.328 -0.33 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.151 -179.844 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 50.8 Cg_exo -53.41 101.35 0.06 OUTLIER 'Trans proline' 0 C--N 1.347 0.481 0 C-N-CA 122.535 2.157 . . . . 0.0 112.191 179.944 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -55.84 -41.8 74.83 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.112 -0.494 . . . . 0.0 111.101 179.998 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . 0.413 ' O ' ' CD2' ' A' ' 57' ' ' TYR . . . 52.19 53.21 12.83 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.18 -0.463 . . . . 0.0 111.131 179.981 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 57' ' ' TYR . . . . . 0.427 ' O ' ' CG ' ' A' ' 57' ' ' TYR . 0.0 OUTLIER 63.16 119.65 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.611 -179.814 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . 0.408 ' CG1' ' N ' ' A' ' 59' ' ' LYS . 0.5 OUTLIER -131.07 -168.54 0.58 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.826 -179.758 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . 0.408 ' N ' ' CG1' ' A' ' 58' ' ' VAL . 0.0 OUTLIER -49.85 -77.14 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.791 0.329 . . . . 0.0 111.13 -179.93 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -177.72 -71.32 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.352 -0.385 . . . . 0.0 110.905 179.979 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 7.0 tp 61.58 99.77 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.803 179.987 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 8.1 p-10 . . . . . 0 C--O 1.25 1.08 0 CA-C-O 118.212 -0.899 . . . . 0.0 110.931 -179.988 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 18.2 tt0 . . . . . 0 C--O 1.231 0.096 0 CA-C-O 120.805 0.336 . . . . 0.0 110.833 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -133.14 -68.46 0.59 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.825 179.865 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 5.1 t 63.64 134.25 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.236 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.111 179.796 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . 0.405 ' CD2' ' N ' ' A' ' 10' ' ' LEU . 0.2 OUTLIER -130.04 144.88 51.58 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.737 179.853 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . 0.48 ' HA ' ' CZ ' ' A' ' 13' ' ' TYR . . . -62.92 80.74 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.422 -179.832 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 2.1 mt -103.25 32.05 3.97 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.789 179.942 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . 0.48 ' CZ ' ' HA ' ' A' ' 11' ' ' ALA . 0.0 OUTLIER -86.46 -60.04 2.11 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.384 -0.371 . . . . 0.0 110.43 179.522 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . 0.437 ' HA ' ' HA ' ' A' ' 26' ' ' LYS . 58.6 t0 50.21 89.3 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.177 179.798 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' TYR . . . . . 0.415 ' O ' ' CB ' ' A' ' 16' ' ' GLN . 0.5 OUTLIER -129.34 -78.62 0.56 Allowed 'General case' 0 C--N 1.332 -0.155 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.095 179.787 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . 0.415 ' CB ' ' O ' ' A' ' 15' ' ' TYR . 0.0 OUTLIER 164.09 177.58 0.02 OUTLIER 'General case' 0 N--CA 1.465 0.301 0 CA-C-O 120.817 0.342 . . . . 0.0 110.795 179.979 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 57.1 mt-10 -116.02 -29.68 6.25 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.111 179.907 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -72.05 -25.07 61.65 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.235 -179.755 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -54.38 142.68 49.18 Favored Pre-proline 0 C--N 1.33 -0.253 0 CA-C-N 116.453 -0.34 . . . . 0.0 111.13 -179.909 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 80.7 Cg_endo -77.62 57.52 6.02 Favored 'Trans proline' 0 C--N 1.347 0.472 0 C-N-CA 122.653 2.235 . . . . 0.0 112.327 -179.971 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -116.64 -64.78 1.26 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.781 -179.922 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -176.37 -68.03 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.953 179.953 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -150.21 -68.36 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.201 179.99 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER 56.79 178.95 0.04 OUTLIER 'General case' 0 C--O 1.232 0.151 0 CA-C-N 116.11 -0.495 . . . . 0.0 111.062 -179.852 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -178.87 -173.57 0.31 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.856 -179.803 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . 0.437 ' HA ' ' HA ' ' A' ' 14' ' ' ASP . 0.0 OUTLIER -138.25 -173.05 3.42 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.007 179.946 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 5.1 ttpm? 63.43 120.66 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.015 -0.539 . . . . 0.0 111.002 179.901 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -58.82 -86.13 0.03 OUTLIER Glycine 0 N--CA 1.452 -0.242 0 C-N-CA 120.701 -0.761 . . . . 0.0 112.437 179.816 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 2.1 t0 49.05 28.58 2.11 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.806 0.336 . . . . 0.0 111.129 179.935 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 4.6 mm 58.98 168.42 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.091 -179.975 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . 0.513 ' N ' ' CD1' ' A' ' 31' ' ' LEU . 0.0 OUTLIER -157.15 -175.75 5.59 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.755 -179.635 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 86.7 m -126.27 161.72 27.11 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.976 179.941 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 2.3 mt -129.28 -170.11 2.22 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.2 -0.454 . . . . 0.0 111.011 -179.911 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 9.3 tt -176.2 92.48 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.955 179.984 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 1.7 t30 61.27 89.8 0.07 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.891 -179.962 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 10.7 t -169.53 119.74 0.67 Allowed 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.861 179.965 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -122.94 170.36 10.2 Favored 'General case' 0 N--CA 1.462 0.129 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.827 -179.969 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 8.3 m-80 64.09 -79.09 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.979 179.984 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -73.71 170.33 15.47 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.856 179.938 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 11.2 p30 -132.47 39.02 3.41 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.905 -179.99 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' TRP . . . . . 0.411 ' CD1' ' HA ' ' A' ' 56' ' ' ALA . 41.9 p-90 -159.3 31.65 0.2 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.0 -0.546 . . . . 0.0 110.684 179.942 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' TRP . . . . . . . . . . . . . 21.8 m95 -71.36 -47.76 54.38 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.086 -0.506 . . . . 0.0 111.138 -179.806 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 1.7 ttpm? -167.05 90.4 0.37 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.458 -0.337 . . . . 0.0 111.275 -179.852 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 23.3 t -98.82 136.32 30.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.295 -0.412 . . . . 0.0 110.78 179.444 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -110.89 -67.53 0.99 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.092 -179.651 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 4.1 t 74.41 75.86 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 116.361 -0.381 . . . . 0.0 111.077 -179.817 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 36.6 m-20 68.6 -67.6 0.2 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.952 -179.99 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 1.2 t0 -121.9 -164.58 1.17 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.805 179.982 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER 67.47 140.11 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.35 -0.386 . . . . 0.0 110.837 -179.993 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -69.3 -169.25 0.19 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.947 -179.967 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -80.44 -158.45 17.89 Favored Glycine 0 C--N 1.334 0.429 0 C-N-CA 120.95 -0.643 . . . . 0.0 112.425 -179.942 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 2.2 m-85 59.74 108.88 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.83 0.348 . . . . 0.0 110.821 -179.978 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 62.8 t -143.12 100.84 5.31 Favored Pre-proline 0 C--N 1.328 -0.327 0 CA-C-N 116.266 -0.425 . . . . 0.0 111.196 -179.821 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 54' ' ' PRO . . . . . 0.422 ' O ' ' CB ' ' A' ' 55' ' ' ALA . 31.1 Cg_exo -59.47 -148.85 0.01 OUTLIER 'Trans proline' 0 C--N 1.347 0.467 0 C-N-CA 122.977 2.451 . . . . 0.0 111.966 179.931 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . 0.422 ' CB ' ' O ' ' A' ' 54' ' ' PRO . . . 81.06 -39.02 0.14 Allowed 'General case' 0 C--O 1.232 0.155 0 CA-C-O 120.818 0.342 . . . . 0.0 110.651 -179.299 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . 0.411 ' HA ' ' CD1' ' A' ' 41' ' ' TRP . . . 68.52 -75.31 0.07 Allowed 'General case' 0 N--CA 1.453 -0.28 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.152 179.674 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -54.08 160.89 1.4 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.893 179.91 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 6.6 p -179.89 -47.92 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.025 179.925 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -179.58 178.22 0.67 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.474 -0.33 . . . . 0.0 110.826 179.459 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 7.4 ttpp -125.67 91.93 3.5 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.868 179.953 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -61.12 97.1 0.06 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.848 179.984 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 30.0 t0 . . . . . 0 C--O 1.248 1.023 0 CA-C-O 118.215 -0.898 . . . . 0.0 110.932 179.947 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.232 0.176 0 CA-C-O 120.765 0.317 . . . . 0.0 110.903 . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . 0.516 ' O ' ' CG2' ' A' ' 9' ' ' VAL . 1.6 mt -149.34 -166.07 2.45 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.919 -179.859 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . 0.516 ' CG2' ' O ' ' A' ' 8' ' ' LEU . 1.0 OUTLIER 76.59 33.29 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.466 0.35 0 CA-C-N 115.982 -0.554 . . . . 0.0 111.441 -179.837 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -44.99 111.59 0.34 Allowed 'General case' 0 N--CA 1.463 0.181 0 CA-C-N 115.962 -0.563 . . . . 0.0 111.2 179.69 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . 0.401 ' CB ' ' CB ' ' A' ' 55' ' ' ALA . . . -53.11 98.94 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 116.037 -0.529 . . . . 0.0 111.191 -179.931 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . 0.447 ' CD1' ' CZ ' ' A' ' 57' ' ' TYR . 0.5 OUTLIER -52.04 157.54 1.28 Allowed 'General case' 0 C--O 1.231 0.129 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.854 -179.938 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 1.2 m-85 67.95 -70.71 0.12 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.778 -179.809 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER 56.8 104.42 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.915 -179.991 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 0.7 OUTLIER -96.08 -175.68 3.46 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.148 -179.698 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 16.6 pt20 -122.43 177.75 5.26 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.792 179.921 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . 0.504 ' HG2' ' HA ' ' A' ' 23' ' ' VAL . 0.3 OUTLIER 179.06 156.24 0.49 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.958 -179.898 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -85.79 -38.65 17.96 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.957 179.999 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' SER . . . . . 0.402 ' CB ' ' CD ' ' A' ' 20' ' ' PRO . 2.0 t -178.1 -61.78 0.0 OUTLIER Pre-proline 0 C--N 1.328 -0.328 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.918 179.981 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' PRO . . . . . 0.402 ' CD ' ' CB ' ' A' ' 19' ' ' SER . 42.8 Cg_endo -67.6 176.37 5.1 Favored 'Trans proline' 0 C--N 1.346 0.428 0 C-N-CA 122.545 2.163 . . . . 0.0 112.29 179.984 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 21.9 mmm180 60.22 34.63 21.0 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.899 -179.968 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . 0.405 ' OE1' ' CE1' ' A' ' 52' ' ' PHE . 27.9 mm-40 63.48 124.48 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.886 -179.994 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . 0.504 ' HA ' ' HG2' ' A' ' 17' ' ' GLU . 31.5 m -58.45 179.81 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.049 179.975 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -171.35 -165.93 0.43 Allowed 'General case' 0 N--CA 1.463 0.217 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.502 179.906 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -177.3 117.16 0.1 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.422 -0.354 . . . . 0.0 110.878 179.878 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.84 -166.12 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.989 -179.83 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 22.6 mmtt 64.44 151.25 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.842 179.934 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -94.13 40.77 2.69 Favored Glycine 0 N--CA 1.451 -0.354 0 C-N-CA 120.772 -0.728 . . . . 0.0 112.504 -179.925 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 2.9 t0 -58.27 -176.98 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.691 0.281 . . . . 0.0 110.725 179.843 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 0.6 OUTLIER -103.9 -179.45 0.64 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-O 120.774 0.321 . . . . 0.0 111.026 179.97 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . 0.501 ' N ' ' CD1' ' A' ' 31' ' ' LEU . 0.0 OUTLIER -150.68 -157.94 0.86 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.768 -179.376 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' THR . . . . . 0.419 ' CG2' ' N ' ' A' ' 33' ' ' LEU . 9.8 t -131.84 -53.99 0.99 Allowed 'General case' 0 N--CA 1.462 0.133 0 CA-C-O 120.765 0.317 . . . . 0.0 111.526 -179.696 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . 0.492 ' CD2' ' HB2' ' A' ' 31' ' ' LEU . 1.9 mm? 62.34 138.09 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.931 0.396 . . . . 0.0 111.179 -179.985 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 6.8 mp -68.35 -74.2 0.13 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.868 179.947 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 7.9 p30 -154.98 31.18 0.4 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.854 179.953 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 3.3 m -70.65 139.44 51.3 Favored 'General case' 0 C--N 1.333 -0.144 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.822 -179.979 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 35.0 m -161.88 69.24 0.29 Allowed 'General case' 0 C--N 1.332 -0.158 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.844 179.968 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 2.3 m120 -158.49 -175.23 5.2 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.93 -179.898 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 1.2 pttt -69.14 -171.18 0.3 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.904 -179.98 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 3.1 p30 46.68 -175.55 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.235 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.672 -179.922 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' TRP . . . . . 0.463 ' CG ' ' N ' ' A' ' 42' ' ' TRP . 0.0 OUTLIER -69.01 -171.67 0.33 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.082 -0.508 . . . . 0.0 111.068 -179.698 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' TRP . . . . . 0.463 ' N ' ' CG ' ' A' ' 41' ' ' TRP . 5.4 m95 -166.67 154.25 9.58 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.938 179.955 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 7.9 tttp -63.67 113.25 3.24 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.965 179.994 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 16.4 m -103.27 -174.7 0.42 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.088 179.789 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -175.79 93.26 0.06 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.914 0.388 . . . . 0.0 110.928 179.857 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 11.2 p -131.98 -44.9 0.65 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.12 179.931 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 10.9 p-10 -107.87 -172.15 2.01 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.784 179.985 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 59.7 m-20 -57.07 -75.73 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.899 179.976 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -80.28 108.52 13.96 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.775 179.93 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -158.49 -178.17 7.07 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.977 179.989 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 132.82 -7.06 5.19 Favored Glycine 0 CA--C 1.519 0.339 0 C-N-CA 120.935 -0.65 . . . . 0.0 112.754 -179.939 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 52' ' ' PHE . . . . . 0.405 ' CE1' ' OE1' ' A' ' 22' ' ' GLU . 58.9 m-85 -136.25 -80.85 0.4 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.662 0.267 . . . . 0.0 110.719 179.965 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 30.2 t 50.34 97.66 0.04 OUTLIER Pre-proline 0 C--N 1.332 -0.187 0 CA-C-N 116.414 -0.357 . . . . 0.0 111.497 179.725 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 84.8 Cg_exo -47.17 -59.93 1.07 Allowed 'Trans proline' 0 C--N 1.347 0.481 0 C-N-CA 122.615 2.21 . . . . 0.0 112.48 179.958 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . 0.401 ' CB ' ' CB ' ' A' ' 11' ' ' ALA . . . 63.12 17.03 9.85 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.543 -179.986 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . 54.26 -88.85 0.02 OUTLIER 'General case' 0 CA--C 1.531 0.222 0 CA-C-N 116.577 -0.283 . . . . 0.0 111.423 179.949 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 57' ' ' TYR . . . . . 0.497 ' O ' ' CG1' ' A' ' 58' ' ' VAL . 25.1 p90 -124.2 -23.5 4.52 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.651 -0.25 . . . . 0.0 111.504 -179.811 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . 0.497 ' CG1' ' O ' ' A' ' 57' ' ' TYR . 9.9 p 52.82 162.86 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.464 0.274 0 CA-C-O 121.04 0.448 . . . . 0.0 111.724 -179.912 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 6.4 mmmt -73.01 -48.62 34.78 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.835 -179.772 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 61.17 105.17 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.882 179.994 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -157.51 135.81 11.12 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.882 179.99 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 . . . . . 0 C--O 1.249 1.052 0 CA-C-O 118.309 -0.853 . . . . 0.0 110.883 179.957 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 2.3 pt-20 . . . . . 0 C--O 1.231 0.097 0 CA-C-O 120.854 0.359 . . . . 0.0 110.885 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 1.2 pp 175.25 61.62 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.152 -0.477 . . . . 0.0 110.731 179.899 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 11.6 t 70.89 161.07 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.015 -179.871 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -144.49 -164.52 1.93 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.145 179.418 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . 0.409 ' O ' ' CB ' ' A' ' 55' ' ' ALA . . . -137.44 15.37 2.97 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.181 179.643 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER 65.65 -67.02 0.14 Allowed 'General case' 0 C--O 1.231 0.117 0 CA-C-O 120.953 0.406 . . . . 0.0 110.535 -179.756 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . 0.402 ' N ' ' O ' ' A' ' 11' ' ' ALA . 6.6 p90 -156.02 170.24 22.6 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.967 -0.56 . . . . 0.0 110.398 179.609 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 4.9 p-10 -46.53 159.67 0.09 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.379 -0.373 . . . . 0.0 111.081 179.729 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' TYR . . . . . 0.407 ' CE2' ' HD2' ' A' ' 54' ' ' PRO . 10.7 t80 -115.24 -35.99 4.5 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.387 -0.37 . . . . 0.0 111.151 -179.906 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER 64.99 143.62 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.773 -179.925 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 7.4 pt-20 -59.39 112.09 1.62 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.857 -179.975 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 11.0 mtpp -140.87 -78.76 0.28 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.916 179.973 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' SER . . . . . 0.416 ' CB ' ' CD ' ' A' ' 20' ' ' PRO . 0.0 OUTLIER -75.12 -61.58 0.98 Allowed Pre-proline 0 C--N 1.33 -0.249 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.041 -179.866 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' PRO . . . . . 0.416 ' CD ' ' CB ' ' A' ' 19' ' ' SER . 55.3 Cg_endo -70.01 173.86 10.58 Favored 'Trans proline' 0 C--N 1.347 0.46 0 C-N-CA 122.552 2.168 . . . . 0.0 112.23 -179.941 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -60.48 -53.74 53.86 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.897 179.962 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 69.9 mm-40 -157.8 140.47 14.77 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.996 179.952 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 26.5 t -153.27 -48.51 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.002 179.911 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 99.1 m 63.27 -80.13 0.03 OUTLIER 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.007 -0.542 . . . . 0.0 111.072 179.91 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER 62.16 149.83 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.882 179.968 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -140.32 104.19 4.74 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.956 -179.943 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 4.0 mtpp 61.69 151.76 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.883 -179.945 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -62.76 -83.41 0.07 OUTLIER Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 120.597 -0.811 . . . . 0.0 112.359 179.851 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . 0.408 ' O ' ' CD1' ' A' ' 30' ' ' ILE . 30.1 m-20 52.19 -90.49 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.467 0.175 . . . . 0.0 111.1 -179.967 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . 0.408 ' CD1' ' O ' ' A' ' 29' ' ' ASP . 0.2 OUTLIER -147.1 -173.02 0.36 Allowed 'Isoleucine or valine' 0 C--O 1.232 0.143 0 CA-C-O 120.832 0.349 . . . . 0.0 110.892 179.896 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . 0.432 HD13 ' N ' ' A' ' 31' ' ' LEU . 0.1 OUTLIER -163.65 -98.13 0.02 OUTLIER 'General case' 0 CA--C 1.534 0.33 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.27 179.736 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' THR . . . . . 0.453 ' O ' ' CB ' ' A' ' 33' ' ' LEU . 20.8 m -168.53 -95.75 0.01 OUTLIER 'General case' 0 CA--C 1.53 0.185 0 N-CA-C 110.495 -0.187 . . . . 0.0 110.495 179.182 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . 0.453 ' CB ' ' O ' ' A' ' 32' ' ' THR . 0.4 OUTLIER 160.35 -66.1 0.0 OUTLIER 'General case' 0 N--CA 1.463 0.211 0 CA-C-O 120.872 0.368 . . . . 0.0 110.663 179.99 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 1.6 mp 63.91 -169.5 0.19 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.816 -179.836 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 4.1 m120 -57.06 125.96 25.05 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.005 -179.936 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 4.3 m -161.75 -44.55 0.04 OUTLIER 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.868 -179.909 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 10.2 p 55.98 31.4 17.88 Favored 'General case' 0 N--CA 1.463 0.2 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.962 -179.937 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 5.8 m-80 -177.65 -174.25 0.45 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.843 -179.954 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -114.23 86.04 2.34 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.853 179.951 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . 0.459 ' O ' ' N ' ' A' ' 42' ' ' TRP . 36.1 t70 -177.39 58.57 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.866 179.911 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' TRP . . . . . 0.427 ' CD1' ' N ' ' A' ' 41' ' ' TRP . 0.0 OUTLIER 43.85 -89.0 0.01 OUTLIER 'General case' 0 N--CA 1.467 0.386 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.521 179.894 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' TRP . . . . . 0.459 ' N ' ' O ' ' A' ' 40' ' ' ASP . 0.0 OUTLIER 67.76 -73.01 0.09 Allowed 'General case' 0 C--N 1.333 -0.151 0 CA-C-O 120.695 0.283 . . . . 0.0 110.919 179.952 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 4.1 ttpt -138.47 61.98 1.57 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.878 0.37 . . . . 0.0 111.02 -179.903 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . 0.435 ' CG1' ' CG2' ' A' ' 53' ' ' VAL . 1.5 p -100.41 139.22 22.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.703 179.768 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 7.7 pt-20 -119.06 166.39 12.95 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.916 179.953 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 16.1 t -129.18 84.78 0.84 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.292 -179.876 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER 58.9 107.57 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.975 179.885 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 6.3 p-10 43.38 73.47 0.14 Allowed 'General case' 0 N--CA 1.463 0.222 0 CA-C-N 116.065 -0.516 . . . . 0.0 111.514 179.891 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 12.9 mmm180 -146.42 -177.63 5.73 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.855 179.973 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 1.2 tp-100 -85.54 -69.23 0.67 Allowed 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.076 179.983 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 162.68 -175.79 39.04 Favored Glycine 0 C--N 1.333 0.412 0 C-N-CA 120.869 -0.681 . . . . 0.0 112.521 -179.975 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 52' ' ' PHE . . . . . 0.404 ' CD2' ' O ' ' A' ' 42' ' ' TRP . 0.7 OUTLIER 57.99 105.64 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.79 0.328 . . . . 0.0 110.943 179.997 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 53' ' ' VAL . . . . . 0.46 ' CG2' ' O ' ' A' ' 53' ' ' VAL . 17.0 m -135.4 65.8 63.68 Favored Pre-proline 0 CA--C 1.532 0.275 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.313 179.84 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 54' ' ' PRO . . . . . 0.407 ' HD2' ' CE2' ' A' ' 15' ' ' TYR . 3.2 Cg_exo -74.75 52.99 3.1 Favored 'Trans proline' 0 C--N 1.346 0.432 0 C-N-CA 122.887 2.392 . . . . 0.0 112.048 179.9 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . 0.409 ' CB ' ' O ' ' A' ' 11' ' ' ALA . . . -59.96 -30.24 68.96 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 121.017 0.437 . . . . 0.0 110.825 179.8 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -179.12 -163.04 0.05 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.9 -0.591 . . . . 0.0 111.018 179.999 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 57' ' ' TYR . . . . . 0.449 ' CD2' ' N ' ' A' ' 58' ' ' VAL . 48.3 p90 -59.12 -49.37 78.13 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.365 -179.737 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . 0.449 ' N ' ' CD2' ' A' ' 57' ' ' TYR . 8.5 t 72.24 155.63 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-O 120.894 0.378 . . . . 0.0 110.774 -179.673 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 7.7 ptmt -57.63 176.57 0.13 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.98 -179.902 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 13.2 mmtm -110.86 -34.97 6.09 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.829 179.926 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 58.6 tp 63.29 -78.3 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.085 179.958 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 34.7 m-20 . . . . . 0 C--O 1.249 1.062 0 CA-C-O 118.205 -0.902 . . . . 0.0 110.9 -179.973 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.528 0.119 0 CA-C-O 120.702 0.287 . . . . 0.0 110.827 . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 2.0 tp 179.95 -73.8 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.396 -0.365 . . . . 0.0 110.93 -179.927 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . 0.409 ' CG1' HG11 ' A' ' 58' ' ' VAL . 0.0 OUTLIER 179.44 123.63 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.463 0.209 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.104 -179.95 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -126.11 142.82 51.37 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.73 179.678 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -52.07 -25.76 9.41 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.308 -0.405 . . . . 0.0 111.065 179.886 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER 67.8 -69.64 0.14 Allowed 'General case' 0 N--CA 1.461 0.115 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.868 179.914 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . 0.402 ' CD1' ' OH ' ' A' ' 57' ' ' TYR . 0.2 OUTLIER -73.34 -72.06 0.28 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.846 179.84 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . 0.409 ' O ' ' HG2' ' A' ' 25' ' ' MET . 2.2 p30 167.11 -60.39 0.0 OUTLIER 'General case' 0 N--CA 1.463 0.211 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.976 179.949 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' TYR . . . . . 0.457 ' CG ' ' HA ' ' A' ' 24' ' ' THR . 38.7 p90 -176.67 -163.54 0.1 Allowed 'General case' 0 N--CA 1.463 0.195 0 CA-C-O 120.856 0.36 . . . . 0.0 110.806 -179.779 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . 0.414 ' N ' ' CD2' ' A' ' 15' ' ' TYR . 26.5 pt20 -138.21 -47.47 0.53 Allowed 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.926 179.768 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . 0.411 ' HB2' ' CE2' ' A' ' 15' ' ' TYR . 2.9 tm-20 51.53 29.12 5.11 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.038 -179.883 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 15.4 tptp -110.97 -48.28 3.13 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.943 179.963 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -57.89 164.72 3.01 Favored Pre-proline 0 C--N 1.329 -0.302 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.77 179.935 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' PRO . . . . . 0.418 ' HG2' ' CZ ' ' A' ' 52' ' ' PHE . 18.6 Cg_endo -60.09 -176.42 0.13 Allowed 'Trans proline' 0 C--N 1.345 0.354 0 C-N-CA 122.627 2.218 . . . . 0.0 112.332 179.942 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 5.2 mmm180 61.85 -91.68 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.818 -179.837 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 1.3 mt-10 166.34 175.01 0.03 OUTLIER 'General case' 0 N--CA 1.463 0.198 0 CA-C-O 120.941 0.401 . . . . 0.0 110.905 179.881 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . 0.433 ' CG2' ' N ' ' A' ' 24' ' ' THR . 1.1 p -178.28 -92.46 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.535 0.403 0 CA-C-N 116.013 -0.54 . . . . 0.0 110.666 179.61 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' THR . . . . . 0.457 ' HA ' ' CG ' ' A' ' 15' ' ' TYR . 2.1 t 39.59 81.83 0.02 OUTLIER 'General case' 0 N--CA 1.466 0.355 0 N-CA-C 111.929 0.344 . . . . 0.0 111.929 179.568 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' MET . . . . . 0.409 ' HG2' ' O ' ' A' ' 14' ' ' ASP . 0.0 OUTLIER -97.86 -25.98 14.84 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.413 -0.358 . . . . 0.0 111.377 -179.987 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 61.85 152.47 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.351 -0.386 . . . . 0.0 111.219 179.817 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 23.6 mtmt 63.83 157.32 0.07 Allowed 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.073 -0.512 . . . . 0.0 111.185 179.73 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -99.26 35.51 4.65 Favored Glycine 0 C--N 1.331 0.251 0 C-N-CA 120.845 -0.693 . . . . 0.0 112.376 179.923 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 63.4 m-20 -60.25 172.55 0.81 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.728 0.299 . . . . 0.0 110.771 179.951 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 12.8 mm -86.95 167.31 1.78 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.068 179.982 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . 0.532 ' N ' ' CD1' ' A' ' 31' ' ' LEU . 0.0 OUTLIER -158.13 -94.44 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.897 -179.458 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 3.4 t -179.65 -154.46 0.02 OUTLIER 'General case' 0 CA--C 1.53 0.201 0 N-CA-C 110.175 -0.305 . . . . 0.0 110.175 179.808 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -169.7 115.19 0.54 Allowed 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.911 0.386 . . . . 0.0 111.102 179.723 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -59.51 107.28 0.56 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.713 179.848 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 4.2 t-20 65.95 -167.47 0.21 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.64 -179.858 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 3.6 m -62.71 169.57 3.05 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-N 116.332 -0.395 . . . . 0.0 110.835 -179.997 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' THR . . . . . 0.406 ' O ' ' N ' ' A' ' 39' ' ' LYS . 9.2 t -107.95 -47.65 3.53 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.862 179.912 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 50.9 t30 64.9 -73.36 0.06 Allowed 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.148 179.927 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . 0.406 ' N ' ' O ' ' A' ' 37' ' ' THR . 0.0 OUTLIER -176.66 38.7 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.404 -0.362 . . . . 0.0 110.878 -179.967 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 7.3 m-20 -129.17 153.67 47.5 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.163 -0.472 . . . . 0.0 110.98 -179.978 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' TRP . . . . . 0.462 ' CG ' ' N ' ' A' ' 42' ' ' TRP . 18.3 p90 -58.39 -48.41 80.73 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.876 -179.982 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' TRP . . . . . 0.462 ' N ' ' CG ' ' A' ' 41' ' ' TRP . 77.7 m95 61.75 139.69 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.099 -0.501 . . . . 0.0 111.151 179.912 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . 0.415 ' O ' ' N ' ' A' ' 45' ' ' GLU . 0.1 OUTLIER -56.45 -22.12 29.99 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.361 -179.863 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 49.1 t 62.7 -77.89 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.228 0 CA-C-N 116.479 -0.328 . . . . 0.0 111.135 -179.908 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . 0.415 ' N ' ' O ' ' A' ' 43' ' ' LYS . 24.4 mt-10 71.93 161.46 0.24 Allowed 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.053 179.998 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 11.2 p -174.46 -47.74 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.175 179.908 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER 169.82 148.86 0.03 OUTLIER 'General case' 0 N--CA 1.463 0.212 0 CA-C-O 120.907 0.384 . . . . 0.0 111.042 179.885 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 44.6 m-20 55.43 25.64 7.95 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.035 -0.53 . . . . 0.0 111.356 179.72 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -165.53 -81.35 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.473 -0.33 . . . . 0.0 110.85 179.865 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . 0.409 ' HA ' ' CB ' ' A' ' 45' ' ' GLU . 2.1 tt0 52.24 94.18 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.457 179.79 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 133.86 128.03 2.81 Favored Glycine 0 C--N 1.333 0.38 0 C-N-CA 120.683 -0.77 . . . . 0.0 113.107 179.642 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 52' ' ' PHE . . . . . 0.418 ' CZ ' ' HG2' ' A' ' 20' ' ' PRO . 24.1 m-85 60.75 111.97 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.977 0.417 . . . . 0.0 111.746 179.393 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 76.9 t -157.73 90.93 2.3 Favored Pre-proline 0 C--N 1.329 -0.3 0 CA-C-N 115.861 -0.609 . . . . 0.0 110.285 179.499 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 31.6 Cg_exo -59.41 134.23 57.27 Favored 'Trans proline' 0 C--N 1.347 0.463 0 C-N-CA 122.797 2.331 . . . . 0.0 112.414 -179.544 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -99.96 63.3 1.18 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.782 179.625 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -47.08 -29.73 2.35 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.156 -0.474 . . . . 0.0 111.262 -179.83 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 57' ' ' TYR . . . . . 0.457 ' CD1' ' N ' ' A' ' 57' ' ' TYR . 0.0 OUTLIER -157.41 -74.84 0.09 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.375 179.922 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . 0.409 HG11 ' CG1' ' A' ' 9' ' ' VAL . 0.2 OUTLIER 52.48 -179.51 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.079 -0.51 . . . . 0.0 111.15 179.745 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -85.06 153.11 22.94 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.91 -179.959 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -62.43 -37.08 84.47 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.152 -0.477 . . . . 0.0 110.876 -179.993 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER 59.82 105.55 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.942 -179.988 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 2.8 p30 . . . . . 0 C--O 1.248 1.006 0 CA-C-O 118.219 -0.896 . . . . 0.0 110.94 179.976 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 2.1 tp10 . . . . . 0 C--O 1.232 0.152 0 CA-C-O 120.721 0.296 . . . . 0.0 110.816 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -97.65 -80.24 0.45 Allowed 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.959 -179.97 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . 0.405 ' CG2' ' CD1' ' A' ' 31' ' ' LEU . 23.4 m -151.93 -148.14 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.45 -0.454 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.595 -179.651 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . 0.43 ' CD2' ' CD ' ' A' ' 59' ' ' LYS . 0.9 OUTLIER -169.07 31.41 0.02 OUTLIER 'General case' 0 C--N 1.334 -0.082 0 CA-C-O 120.808 0.337 . . . . 0.0 111.173 -179.993 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . 61.07 -81.55 0.02 OUTLIER 'General case' 0 CA--C 1.529 0.15 0 CA-C-N 116.22 -0.446 . . . . 0.0 111.261 179.817 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . 0.404 ' CD1' ' HA ' ' A' ' 58' ' ' VAL . 1.0 OUTLIER 64.81 -77.29 0.04 OUTLIER 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 116.387 -0.37 . . . . 0.0 110.853 -179.786 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . 0.402 ' CD2' ' HB2' ' A' ' 56' ' ' ALA . 1.2 m-85 -103.72 62.88 0.77 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 121.083 0.468 . . . . 0.0 110.606 179.775 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 14.0 m-20 -126.38 70.23 1.24 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.042 -0.527 . . . . 0.0 111.075 -179.948 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' TYR . . . . . 0.415 ' O ' ' CD2' ' A' ' 15' ' ' TYR . 84.0 t80 -145.5 63.41 1.27 Allowed 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.893 -179.973 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER 179.15 170.86 0.92 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.924 179.926 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 27.8 tp10 -177.42 -73.57 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.727 179.967 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -125.03 -176.92 3.69 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.895 179.876 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' SER . . . . . 0.42 ' CB ' ' CD ' ' A' ' 20' ' ' PRO . 2.2 t -60.8 -62.49 5.87 Favored Pre-proline 0 C--N 1.33 -0.257 0 CA-C-N 116.332 -0.395 . . . . 0.0 110.952 179.994 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' PRO . . . . . 0.42 ' CD ' ' CB ' ' A' ' 19' ' ' SER . 20.4 Cg_endo -62.38 -75.36 0.02 OUTLIER 'Trans proline' 0 C--N 1.347 0.463 0 C-N-CA 122.388 2.059 . . . . 0.0 112.323 -179.917 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER 177.61 160.83 0.49 Allowed 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.515 -0.311 . . . . 0.0 110.782 179.993 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 49.0 tt0 -176.72 -71.51 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.956 179.923 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 21.5 t -106.74 147.17 12.34 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.262 -0.427 . . . . 0.0 111.114 -179.971 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' THR . . . . . 0.403 ' OG1' ' CD1' ' A' ' 15' ' ' TYR . 1.0 OUTLIER -178.76 107.54 0.04 OUTLIER 'General case' 0 C--N 1.333 -0.11 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.023 179.927 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' MET . . . . . 0.405 ' O ' ' HG2' ' A' ' 25' ' ' MET . 0.0 OUTLIER -160.98 125.91 3.65 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.873 179.875 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 1.8 mmmm -128.89 -160.73 1.05 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.956 -179.675 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 5.0 tttm 78.89 -179.67 0.11 Allowed 'General case' 0 N--CA 1.464 0.229 0 CA-C-O 120.864 0.364 . . . . 0.0 110.953 -179.883 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -57.03 -20.12 33.18 Favored Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.934 -0.65 . . . . 0.0 112.896 -179.768 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -47.91 134.66 13.21 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.762 0.315 . . . . 0.0 111.202 -179.85 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -104.92 -168.55 0.25 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.88 179.989 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . 0.405 ' CD1' ' CG2' ' A' ' 9' ' ' VAL . 0.0 OUTLIER -146.04 -82.26 0.14 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.917 -179.808 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER 165.97 -56.67 0.0 OUTLIER 'General case' 0 N--CA 1.466 0.33 0 CA-C-O 120.893 0.378 . . . . 0.0 110.692 -179.939 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER 58.91 98.89 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.965 179.91 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 1.2 pt? -57.47 -167.19 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.977 179.929 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 7.0 p-10 -59.08 88.58 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.897 179.988 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 11.0 t -59.68 159.97 7.93 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.956 179.908 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 1.4 t -140.29 117.68 11.4 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.832 -179.986 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 16.4 m-80 -60.76 89.91 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.877 179.987 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -177.41 -39.78 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.835 179.953 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 9.1 p-10 -130.79 -175.4 3.65 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.958 -179.918 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' TRP . . . . . 0.479 ' O ' ' CG ' ' A' ' 42' ' ' TRP . 0.1 OUTLIER -80.88 -0.9 41.13 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.381 -179.988 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' TRP . . . . . 0.479 ' CG ' ' O ' ' A' ' 41' ' ' TRP . 32.2 p90 45.79 -172.92 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.247 0 CA-C-O 120.853 0.358 . . . . 0.0 111.34 -179.971 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -126.36 162.92 24.42 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.003 -179.773 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 11.1 t -144.23 157.69 15.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.061 -0.518 . . . . 0.0 111.105 179.99 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . 0.409 ' O ' HG13 ' A' ' 46' ' ' VAL . 5.5 mm-40 -101.68 -165.29 1.18 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.827 -179.91 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' VAL . . . . . 0.409 HG13 ' O ' ' A' ' 45' ' ' GLU . 0.4 OUTLIER 80.07 7.81 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.532 0.265 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.43 179.983 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 3.0 t-20 -113.8 -36.22 4.9 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.852 0.358 . . . . 0.0 110.953 179.921 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER 73.55 7.03 5.09 Favored 'General case' 0 CA--C 1.532 0.285 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.328 -179.966 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -87.77 -70.24 0.64 Allowed 'General case' 0 C--O 1.231 0.122 0 CA-C-O 120.881 0.372 . . . . 0.0 110.826 179.851 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 2.4 tt0 -164.31 -68.89 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.9 -179.926 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 171.22 -153.25 20.08 Favored Glycine 0 C--N 1.332 0.341 0 C-N-CA 120.857 -0.687 . . . . 0.0 112.523 -179.982 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 10.8 m-85 60.62 113.41 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.773 0.32 . . . . 0.0 110.956 -179.976 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 21.4 t -141.64 136.96 15.85 Favored Pre-proline 0 C--N 1.329 -0.311 0 CA-C-N 116.382 -0.372 . . . . 0.0 111.282 -179.96 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 54' ' ' PRO . . . . . 0.42 ' HA ' ' CD1' ' A' ' 41' ' ' TRP . 47.5 Cg_exo -55.73 -55.08 3.28 Favored 'Trans proline' 0 C--N 1.347 0.498 0 C-N-CA 122.586 2.191 . . . . 0.0 112.294 179.93 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . 71.96 -62.3 0.47 Allowed 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.375 -179.982 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . 0.402 ' HB2' ' CD2' ' A' ' 13' ' ' TYR . . . 70.76 -70.89 0.14 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.132 -179.822 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 57' ' ' TYR . . . . . 0.456 ' CD1' ' N ' ' A' ' 57' ' ' TYR . 0.8 OUTLIER -149.25 -62.87 0.23 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.999 179.766 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . 0.429 HG23 ' HG ' ' A' ' 10' ' ' LEU . 7.7 p 39.8 49.56 0.31 Allowed 'Isoleucine or valine' 0 CA--C 1.53 0.206 0 CA-C-N 116.218 -0.446 . . . . 0.0 112.113 179.861 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . 0.43 ' CD ' ' CD2' ' A' ' 10' ' ' LEU . 15.5 mttm 74.8 30.64 0.96 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.76 -179.688 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 62.77 -79.97 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.895 -179.757 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 13.1 tp -178.62 78.99 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.834 179.857 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 39.8 m-20 . . . . . 0 C--O 1.249 1.077 0 CA-C-O 118.29 -0.862 . . . . 0.0 110.916 179.938 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 4.5 pm0 . . . . . 0 N--CA 1.462 0.156 0 CA-C-O 120.923 0.392 . . . . 0.0 111.481 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 1.8 mt 56.66 -160.65 0.21 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.992 -179.864 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 22.3 t -144.28 -38.63 0.14 Allowed 'Isoleucine or valine' 0 N--CA 1.454 -0.242 0 CA-C-N 115.91 -0.586 . . . . 0.0 111.381 179.849 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 3.2 mt 67.79 159.45 0.15 Allowed 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.365 -0.38 . . . . 0.0 110.546 -179.618 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -108.79 -24.59 11.22 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.931 179.702 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 27.4 mt 52.54 50.17 18.82 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-N 116.196 -0.457 . . . . 0.0 111.003 179.997 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . 0.409 ' CD2' ' HG2' ' A' ' 27' ' ' LYS . 3.6 t80 75.65 152.31 0.13 Allowed 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 115.907 -0.588 . . . . 0.0 111.09 -179.989 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . 0.413 ' OD1' ' N ' ' A' ' 14' ' ' ASP . 0.4 OUTLIER -45.81 155.32 0.18 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.921 -0.581 . . . . 0.0 111.374 179.837 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' TYR . . . . . 0.438 ' CZ ' ' HB2' ' A' ' 54' ' ' PRO . 42.5 t80 -71.17 -66.57 0.6 Allowed 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.787 -179.966 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . 0.405 ' O ' ' CB ' ' A' ' 17' ' ' GLU . 18.5 tt0 -177.46 -34.51 0.01 OUTLIER 'General case' 0 CA--C 1.53 0.201 0 CA-C-N 116.306 -0.406 . . . . 0.0 111.469 -179.75 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . 0.432 ' N ' ' CG2' ' A' ' 24' ' ' THR . 34.3 mt-10 82.27 161.82 0.14 Allowed 'General case' 0 N--CA 1.467 0.408 0 CA-C-N 116.277 -0.419 . . . . 0.0 110.753 -179.618 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -101.68 -68.84 0.8 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.028 -179.838 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' SER . . . . . 0.476 ' N ' ' HD2' ' A' ' 20' ' ' PRO . 3.6 t 174.98 -60.73 0.0 OUTLIER Pre-proline 0 C--N 1.332 -0.168 0 CA-C-N 116.423 -0.353 . . . . 0.0 111.308 -179.832 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' PRO . . . . . 0.476 ' HD2' ' N ' ' A' ' 19' ' ' SER . 9.7 Cg_endo -51.96 -76.31 0.02 OUTLIER 'Trans proline' 0 C--N 1.349 0.567 0 C-N-CA 122.655 2.237 . . . . 0.0 112.568 -179.593 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -95.3 -82.45 0.38 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.631 -0.259 . . . . 0.0 110.999 -179.72 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 13.9 tt0 -178.06 -75.96 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.667 0.27 . . . . 0.0 111.054 -179.981 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 35.4 t 59.7 78.92 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.243 0 CA-C-N 116.504 -0.317 . . . . 0.0 111.007 -179.883 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' THR . . . . . 0.432 ' CG2' ' N ' ' A' ' 17' ' ' GLU . 41.7 p -158.87 177.11 11.52 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-O 121.022 0.439 . . . . 0.0 111.496 -179.657 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -98.87 -161.45 0.88 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.684 -0.689 . . . . 0.0 110.329 179.541 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 3.2 mmtp -147.88 174.35 11.94 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.84 0.353 . . . . 0.0 111.124 179.516 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . 0.409 ' HG2' ' CD2' ' A' ' 13' ' ' TYR . 21.7 mtmm -57.37 102.14 0.08 Allowed 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.453 -179.854 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 45.5 37.05 6.33 Favored Glycine 0 C--N 1.332 0.32 0 C-N-CA 121.065 -0.588 . . . . 0.0 113.032 179.766 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 33.5 t0 -90.24 15.6 10.12 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.742 0.306 . . . . 0.0 111.396 179.817 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 2.4 mm 54.45 174.91 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.2 0 CA-C-O 120.943 0.401 . . . . 0.0 111.378 179.908 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . 0.603 ' N ' ' CD1' ' A' ' 31' ' ' LEU . 0.0 OUTLIER -177.84 -170.85 0.27 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.383 -179.313 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 86.8 m -122.94 163.06 21.09 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-O 121.12 0.486 . . . . 0.0 111.159 179.924 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . 0.5 ' CD2' ' N ' ' A' ' 33' ' ' LEU . 0.6 OUTLIER -120.93 -61.06 1.6 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.881 -0.599 . . . . 0.0 110.955 -179.762 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER 61.88 115.84 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.92 179.978 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 92.9 m-20 60.77 87.59 0.09 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.926 179.965 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 9.2 m -163.36 166.1 23.31 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.807 -179.988 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 4.2 m -145.87 -65.18 0.31 Allowed 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.015 179.975 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 18.9 p-10 -142.56 -49.14 0.35 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.907 -179.953 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -123.56 92.83 3.77 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.861 -179.915 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . 0.421 ' HB2' ' CE3' ' A' ' 42' ' ' TRP . 5.1 p30 -177.68 165.81 2.11 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.174 -0.467 . . . . 0.0 110.915 179.854 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' TRP . . . . . . . . . . . . . 10.2 p90 -134.54 -47.61 0.76 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.875 179.931 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' TRP . . . . . 0.421 ' CE3' ' HB2' ' A' ' 40' ' ' ASP . 1.0 OUTLIER 62.17 -81.24 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.99 179.987 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 5.2 pttt -178.32 103.1 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.811 179.915 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . 0.406 HG11 ' CG1' ' A' ' 46' ' ' VAL . 11.7 t -49.31 -41.89 15.31 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.899 179.816 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 3.8 tt0 58.28 41.35 23.5 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.112 -0.495 . . . . 0.0 111.238 179.689 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' VAL . . . . . 0.406 ' CG1' HG11 ' A' ' 44' ' ' VAL . 14.4 p -102.77 -24.09 4.16 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-O 120.92 0.39 . . . . 0.0 110.959 179.599 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 5.6 p30 -100.08 -171.23 2.0 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.617 179.664 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 23.2 t0 -109.91 63.26 0.6 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.811 0.339 . . . . 0.0 111.037 -179.879 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 54.6 ttt-85 -177.14 104.81 0.05 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.073 179.883 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 24.2 tp60 61.94 -81.57 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.121 -0.49 . . . . 0.0 111.043 179.763 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 127.75 -2.02 6.92 Favored Glycine 0 C--N 1.334 0.448 0 C-N-CA 120.795 -0.717 . . . . 0.0 112.962 -179.869 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 2.2 m-85 -44.66 -82.0 0.01 OUTLIER 'General case' 0 CA--C 1.53 0.178 0 CA-C-N 116.825 0.313 . . . . 0.0 111.395 -179.816 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 2.8 t 49.47 84.62 0.2 Allowed Pre-proline 0 C--N 1.332 -0.186 0 CA-C-N 116.467 -0.333 . . . . 0.0 111.308 179.912 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 54' ' ' PRO . . . . . 0.438 ' HB2' ' CZ ' ' A' ' 15' ' ' TYR . 56.1 Cg_exo -51.29 139.94 43.44 Favored 'Trans proline' 0 C--N 1.345 0.393 0 C-N-CA 122.54 2.16 . . . . 0.0 112.177 179.886 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -86.95 55.81 3.73 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.336 -179.757 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -94.62 36.91 1.14 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.433 179.209 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -175.79 -168.68 0.3 Allowed 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.655 -179.239 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 48.3 t 63.37 157.13 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.575 178.868 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 10.0 ptpt -55.92 120.5 7.51 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.945 179.952 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -71.7 96.73 1.63 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.866 -179.9 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 1.4 pp -177.07 173.5 1.81 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.913 179.941 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 14.7 t0 . . . . . 0 C--O 1.249 1.058 0 CA-C-O 118.243 -0.885 . . . . 0.0 110.863 179.957 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.231 0.129 0 CA-C-O 120.816 0.341 . . . . 0.0 110.923 . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . 0.437 ' N ' ' CD1' ' A' ' 8' ' ' LEU . 0.0 OUTLIER -156.34 150.85 25.68 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.869 -179.989 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 98.9 t -111.99 -95.32 0.1 OUTLIER 'Isoleucine or valine' 0 CA--C 1.534 0.362 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.167 -179.965 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . 0.408 ' HB2' ' CG1' ' A' ' 58' ' ' VAL . 2.0 mt 166.49 -54.56 0.0 OUTLIER 'General case' 0 N--CA 1.464 0.233 0 CA-C-O 120.882 0.372 . . . . 0.0 110.92 179.953 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . 64.66 43.79 4.12 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.942 -179.473 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . 0.451 ' N ' HD23 ' A' ' 12' ' ' LEU . 0.0 OUTLIER -56.99 155.98 7.44 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.086 -179.999 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . 0.4 ' CD2' ' OH ' ' A' ' 57' ' ' TYR . 0.1 OUTLIER 77.88 -5.16 2.14 Favored 'General case' 0 N--CA 1.463 0.218 0 CA-C-N 116.005 -0.543 . . . . 0.0 111.777 -179.907 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . 0.429 ' HA ' ' O ' ' A' ' 25' ' ' MET . 5.8 p-10 43.47 95.77 0.01 OUTLIER 'General case' 0 N--CA 1.462 0.146 0 CA-C-O 120.893 0.378 . . . . 0.0 111.657 179.799 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' TYR . . . . . 0.434 ' CZ ' ' HG2' ' A' ' 54' ' ' PRO . 10.3 t80 -74.44 116.11 14.75 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.069 -179.915 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 5.6 pt20 -88.04 -166.0 1.47 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.679 179.867 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 1.6 pt-20 -101.3 111.08 23.2 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.897 -179.94 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -154.19 23.8 0.49 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.345 -0.389 . . . . 0.0 111.253 -179.999 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' SER . . . . . 0.411 ' CB ' ' CD ' ' A' ' 20' ' ' PRO . 2.2 t 172.98 -62.73 0.0 OUTLIER Pre-proline 0 C--N 1.332 -0.19 0 CA-C-N 116.475 -0.33 . . . . 0.0 110.949 179.735 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' PRO . . . . . 0.411 ' CD ' ' CB ' ' A' ' 19' ' ' SER . 19.1 Cg_endo -61.53 -66.79 0.05 OUTLIER 'Trans proline' 0 C--N 1.348 0.5 0 C-N-CA 122.451 2.101 . . . . 0.0 112.376 -179.972 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 1.8 ttt180 -179.87 -166.63 0.08 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.889 179.998 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 2.2 mp0 -79.28 81.76 5.51 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.93 -179.98 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 27.2 m -134.93 134.82 53.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.399 179.951 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 18.0 m -130.83 154.29 48.2 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.76 179.928 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' MET . . . . . 0.429 ' O ' ' HA ' ' A' ' 14' ' ' ASP . 31.2 mtm -150.09 57.49 0.96 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.959 0.409 . . . . 0.0 110.959 -179.94 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 2.4 tppt? -40.44 120.77 1.29 Allowed 'General case' 0 N--CA 1.465 0.312 0 CA-C-N 115.899 -0.591 . . . . 0.0 111.908 -179.789 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 4.6 mptt 53.61 174.15 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.011 -0.54 . . . . 0.0 111.44 179.624 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -82.34 61.45 4.71 Favored Glycine 0 N--CA 1.452 -0.299 0 C-N-CA 120.904 -0.665 . . . . 0.0 112.241 179.786 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -96.87 29.86 2.89 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.909 0.385 . . . . 0.0 110.883 179.91 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . 0.41 HG23 ' HB2' ' A' ' 8' ' ' LEU . 0.4 OUTLIER 51.97 178.08 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.238 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.187 -179.939 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . 0.548 ' N ' ' CD1' ' A' ' 31' ' ' LEU . 0.0 OUTLIER -164.69 18.82 0.05 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.893 -179.057 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' THR . . . . . 0.446 ' O ' ' CD2' ' A' ' 31' ' ' LEU . 0.6 OUTLIER 52.02 178.2 0.02 OUTLIER 'General case' 0 N--CA 1.465 0.275 0 CA-C-O 120.858 0.361 . . . . 0.0 111.165 179.924 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -179.85 163.99 1.16 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.927 0.394 . . . . 0.0 111.102 -179.981 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 4.1 mp -102.16 35.38 2.41 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.938 -0.574 . . . . 0.0 110.798 179.935 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 1.7 m-20 64.68 134.76 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.919 -179.961 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 4.6 m -103.4 -172.73 2.16 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.905 179.918 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -177.22 67.89 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.984 179.971 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 35.7 t-20 -172.81 -94.01 0.01 OUTLIER 'General case' 0 CA--C 1.532 0.27 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.773 179.789 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER 173.58 38.4 0.0 OUTLIER 'General case' 0 C--O 1.232 0.179 0 CA-C-O 120.672 0.272 . . . . 0.0 111.071 179.904 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . 0.479 ' O ' ' CG ' ' A' ' 41' ' ' TRP . 2.4 p-10 176.26 87.22 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.571 -0.286 . . . . 0.0 111.088 179.881 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 41' ' ' TRP . . . . . 0.49 ' CH2' ' CD2' ' A' ' 52' ' ' PHE . 66.8 p-90 45.69 -174.89 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.285 0 CA-C-N 116.07 -0.514 . . . . 0.0 111.603 179.833 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 42' ' ' TRP . . . . . . . . . . . . . 1.3 m95 175.82 86.38 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.833 -179.989 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 9.7 mttp 59.16 61.61 2.04 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.878 179.842 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . 0.431 ' CG2' ' CG2' ' A' ' 53' ' ' VAL . 82.0 t -77.72 83.36 0.88 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.942 179.827 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 6.3 mp0 -101.75 101.72 12.25 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.939 -179.89 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 11.7 t -58.85 -30.47 42.82 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.047 179.858 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 63.4 m-20 -150.97 -57.36 0.16 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.773 179.888 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 8.9 p-10 -179.2 149.2 0.4 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.055 -0.521 . . . . 0.0 110.878 179.902 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . 0.471 ' HG2' ' O ' ' A' ' 49' ' ' ARG . 0.0 OUTLIER 76.21 -9.33 1.48 Allowed 'General case' 0 CA--C 1.536 0.405 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.629 179.901 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 24.0 mm-40 -94.37 -168.73 1.9 Allowed 'General case' 0 C--N 1.332 -0.17 0 CA-C-O 120.786 0.327 . . . . 0.0 110.835 179.636 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 134.65 166.76 11.26 Favored Glycine 0 C--N 1.334 0.442 0 C-N-CA 120.812 -0.708 . . . . 0.0 112.693 179.877 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 52' ' ' PHE . . . . . 0.49 ' CD2' ' CH2' ' A' ' 41' ' ' TRP . 5.2 m-85 62.86 107.9 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.839 0.352 . . . . 0.0 111.161 179.855 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 53' ' ' VAL . . . . . 0.431 ' CG2' ' CG2' ' A' ' 44' ' ' VAL . 30.2 m -155.88 105.0 2.12 Favored Pre-proline 0 CA--C 1.531 0.242 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.146 179.752 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 54' ' ' PRO . . . . . 0.434 ' HG2' ' CZ ' ' A' ' 15' ' ' TYR . 32.1 Cg_exo -59.02 93.97 0.08 OUTLIER 'Trans proline' 0 C--N 1.346 0.446 0 C-N-CA 122.539 2.16 . . . . 0.0 112.368 -179.775 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -61.47 89.94 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.912 179.826 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -53.04 -80.26 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.209 -0.451 . . . . 0.0 111.174 -179.793 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 57' ' ' TYR . . . . . 0.411 ' CD2' ' O ' ' A' ' 57' ' ' TYR . 20.2 p90 -133.57 98.09 4.11 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.39 -0.368 . . . . 0.0 110.729 179.802 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . 0.408 ' CG1' ' HB2' ' A' ' 10' ' ' LEU . 1.8 t -133.11 167.97 25.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.371 -179.709 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -79.74 148.21 31.59 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.862 179.817 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 64.41 -75.77 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.049 -179.971 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 1.1 tt 60.49 33.37 20.58 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.377 -0.374 . . . . 0.0 110.946 179.885 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 6.5 t0 . . . . . 0 C--O 1.249 1.058 0 CA-C-O 118.27 -0.871 . . . . 0.0 110.894 179.984 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 2.4 tt0 . . . . . 0 C--O 1.231 0.104 0 CA-C-O 120.832 0.348 . . . . 0.0 110.828 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -145.3 -46.09 0.22 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.977 -179.999 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 0.7 OUTLIER -164.36 172.64 0.22 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.195 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.074 -179.93 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -132.36 -37.94 1.07 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.51 -179.785 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . 73.52 67.39 0.1 Allowed 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 121.018 0.437 . . . . 0.0 110.123 -178.972 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 1.2 mp -80.55 12.15 3.27 Favored 'General case' 0 CA--C 1.531 0.213 0 CA-C-N 115.938 -0.574 . . . . 0.0 111.707 -179.639 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . 0.461 ' N ' ' CD1' ' A' ' 13' ' ' TYR . 0.0 OUTLIER -50.8 177.61 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.171 0 CA-C-O 120.903 0.382 . . . . 0.0 111.175 179.983 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 9.7 p30 -173.14 36.85 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.755 179.859 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' TYR . . . . . 0.4 ' CD1' ' N ' ' A' ' 16' ' ' GLN . 7.1 t80 -83.73 153.49 24.13 Favored 'General case' 0 C--N 1.333 -0.15 0 CA-C-N 116.086 -0.506 . . . . 0.0 111.1 -179.849 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . 0.4 ' N ' ' CD1' ' A' ' 15' ' ' TYR . 10.0 mp0 -145.87 90.16 1.96 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.865 179.908 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 4.4 tt0 -98.33 27.66 4.56 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.35 -0.387 . . . . 0.0 111.146 -179.76 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 55.61 -163.89 0.14 Allowed 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.395 -0.366 . . . . 0.0 110.897 179.828 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER 65.33 149.89 0.12 Allowed Pre-proline 0 C--N 1.331 -0.202 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.992 -179.936 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 52.4 Cg_endo -69.25 -46.41 1.44 Allowed 'Trans proline' 0 C--N 1.345 0.393 0 C-N-CA 122.647 2.231 . . . . 0.0 112.418 -179.965 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 4.8 ptt85 -130.41 108.31 9.89 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.921 -179.968 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -176.92 -79.56 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.868 179.946 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 38.8 t -148.02 110.64 0.68 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.078 -179.978 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 2.7 t -179.17 104.52 0.03 OUTLIER 'General case' 0 N--CA 1.462 0.16 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.954 179.941 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' MET . . . . . 0.423 ' HG2' ' CE2' ' A' ' 13' ' ' TYR . 2.2 mpp? -140.03 170.44 15.85 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.98 179.888 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -176.07 -179.37 1.12 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.876 179.979 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 13.1 mmmt 71.18 -169.75 0.15 Allowed 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.938 -179.994 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -116.06 25.04 9.64 Favored Glycine 0 C--N 1.332 0.337 0 C-N-CA 120.815 -0.707 . . . . 0.0 112.622 -179.842 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 56.4 t0 -65.3 120.97 13.75 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.841 0.353 . . . . 0.0 110.582 179.769 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 5.2 mt -59.71 166.49 0.62 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.114 -179.684 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . 0.441 ' CD1' ' N ' ' A' ' 31' ' ' LEU . 0.0 OUTLIER -148.22 -167.37 2.79 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.132 -178.928 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 14.8 t -102.36 -47.94 4.33 Favored 'General case' 0 C--N 1.333 -0.127 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.849 179.964 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER 64.99 170.86 0.2 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.844 179.81 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -93.05 -77.43 0.44 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.985 179.984 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 20.0 t-20 -138.03 -44.24 0.52 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.952 -179.936 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 3.1 t 69.02 112.25 0.05 OUTLIER 'General case' 0 N--CA 1.462 0.168 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.866 179.991 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 8.9 t -177.5 160.8 1.66 Allowed 'General case' 0 C--O 1.231 0.124 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.815 179.873 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 8.7 m120 60.41 172.82 0.09 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.888 -179.913 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -114.83 107.63 15.67 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.986 -180.0 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . 0.46 ' O ' ' N ' ' A' ' 42' ' ' TRP . 1.5 m-20 -178.63 81.44 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.081 -0.508 . . . . 0.0 110.893 179.944 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 41' ' ' TRP . . . . . 0.576 ' CG ' ' N ' ' A' ' 42' ' ' TRP . 0.0 OUTLIER 65.18 -65.05 0.16 Allowed 'General case' 0 CA--C 1.532 0.258 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.931 -179.906 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 42' ' ' TRP . . . . . 0.576 ' N ' ' CG ' ' A' ' 41' ' ' TRP . 3.8 t-105 57.89 115.93 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.189 -0.46 . . . . 0.0 111.402 -179.869 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 2.5 ptpp? -71.95 -177.21 1.94 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.373 179.417 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . 0.424 ' HB ' ' CG1' ' A' ' 53' ' ' VAL . 0.3 OUTLIER -118.53 -40.87 2.28 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-O 120.868 0.366 . . . . 0.0 111.131 179.975 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER 61.49 114.1 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.022 -179.964 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 21.4 t -141.04 -57.31 0.25 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.048 179.88 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 7.9 m-80 -129.81 -174.82 3.41 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.752 179.93 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 16.6 m-20 -68.44 73.22 0.22 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.886 179.984 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -156.01 26.94 0.37 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.959 -179.954 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER 56.94 -167.61 0.12 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.393 -0.367 . . . . 0.0 110.943 179.919 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -91.18 -108.58 1.5 Allowed Glycine 0 C--N 1.332 0.349 0 C-N-CA 120.958 -0.639 . . . . 0.0 112.538 179.993 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 19.6 m-85 55.41 79.53 0.15 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.86 0.362 . . . . 0.0 110.562 -179.941 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 53' ' ' VAL . . . . . 0.424 ' CG1' ' HB ' ' A' ' 44' ' ' VAL . 1.5 p 179.0 92.73 0.17 Allowed Pre-proline 0 C--N 1.327 -0.377 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.708 -179.498 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_exo -52.56 130.85 38.41 Favored 'Trans proline' 0 C--N 1.346 0.424 0 C-N-CA 122.535 2.156 . . . . 0.0 112.295 -179.878 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -64.15 -52.37 59.37 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.057 -0.519 . . . . 0.0 110.969 -179.979 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . 0.437 ' O ' ' HD1' ' A' ' 57' ' ' TYR . . . 58.61 47.12 13.67 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.058 179.987 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 57' ' ' TYR . . . . . 0.476 ' CD1' ' C ' ' A' ' 57' ' ' TYR . 0.0 OUTLIER 81.56 147.15 0.09 Allowed 'General case' 0 N--CA 1.464 0.271 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.688 -179.827 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 8.2 p -178.49 -47.69 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.365 -179.788 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER 178.79 -167.87 0.08 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.361 -0.382 . . . . 0.0 110.788 -179.91 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -130.57 88.25 2.6 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.815 179.925 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -59.89 -65.44 0.68 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.924 179.912 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 . . . . . 0 C--O 1.25 1.107 0 CA-C-O 118.251 -0.88 . . . . 0.0 110.896 179.989 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 8' ' ' LEU . . . . . 0.661 ' O ' HG13 ' A' ' 9' ' ' VAL . 2.1 tp . . . . . 0 CA--C 1.526 0.049 0 CA-C-O 120.836 0.35 . . . . 0.0 110.831 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 9' ' ' VAL . . . . . 0.661 HG13 ' O ' ' A' ' 8' ' ' LEU . 1.5 m -163.51 64.67 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.333 -0.146 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.092 179.908 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 10' ' ' LEU . . . . . 0.749 ' O ' HG13 ' A' ' 58' ' ' VAL . 0.8 OUTLIER -61.06 159.31 11.91 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.189 -0.459 . . . . 0.0 111.005 179.941 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 11' ' ' ALA . . . . . 0.631 ' HB2' ' HG2' ' A' ' 25' ' ' MET . . . -71.91 -20.89 61.71 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.099 -0.501 . . . . 0.0 111.384 179.933 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.805 HD11 ' HA ' ' A' ' 58' ' ' VAL . 0.5 OUTLIER 74.94 16.26 2.94 Favored 'General case' 0 N--CA 1.465 0.313 0 CA-C-N 116.33 -0.396 . . . . 0.0 111.277 179.96 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER 177.19 -77.72 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.181 0 CA-C-O 120.661 0.267 . . . . 0.0 110.97 179.851 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER 169.29 -34.17 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.442 -0.345 . . . . 0.0 110.905 -179.805 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 15' ' ' TYR . . . . . 0.896 ' CD2' HG12 ' A' ' 53' ' ' VAL . 19.4 t80 68.25 -62.58 0.36 Allowed 'General case' 0 N--CA 1.465 0.285 0 CA-C-N 116.145 -0.479 . . . . 0.0 111.265 -179.847 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 16' ' ' GLN . . . . . 0.403 ' HA ' ' HB ' ' A' ' 24' ' ' THR . 13.1 pt20 44.94 88.65 0.02 OUTLIER 'General case' 0 N--CA 1.463 0.201 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.391 -179.769 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 17' ' ' GLU . . . . . 0.738 ' N ' HG22 ' A' ' 24' ' ' THR . 6.3 tp10 . . . . . 0 C--N 1.329 -0.287 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.969 179.918 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.231 0.102 0 CA-C-O 120.732 0.301 . . . . 0.0 110.939 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 3.0 m -59.21 101.4 0.1 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.202 179.961 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 24' ' ' THR . . . . . 0.738 HG22 ' N ' ' A' ' 17' ' ' GLU . 75.0 p -135.44 105.68 6.34 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 116.108 -0.497 . . . . 0.0 111.004 -179.849 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 25' ' ' MET . . . . . 0.707 ' CE ' HG11 ' A' ' 53' ' ' VAL . 1.8 mpp? -87.54 170.06 11.64 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.673 179.877 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 8.3 tptm -156.1 127.47 7.15 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.165 -179.824 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 10.8 ttmt 62.85 -79.79 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.147 179.896 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 179.16 61.05 0.08 OUTLIER Glycine 0 N--CA 1.452 -0.284 0 C-N-CA 120.667 -0.778 . . . . 0.0 112.44 -179.973 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 38.0 m-20 -83.97 4.16 31.0 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.565 0.221 . . . . 0.0 111.249 179.872 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 30' ' ' ILE . . . . . 0.665 HG22 ' H ' ' A' ' 31' ' ' LEU . 3.4 mm 57.66 172.21 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-O 120.972 0.415 . . . . 0.0 111.199 179.943 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.665 ' H ' HG22 ' A' ' 30' ' ' ILE . 0.0 OUTLIER -173.78 151.12 1.78 Allowed 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.002 -0.544 . . . . 0.0 110.702 -179.184 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 32' ' ' THR . . . . . 0.507 HG22 ' H ' ' A' ' 33' ' ' LEU . 0.8 OUTLIER -79.59 175.72 10.36 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.207 179.607 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.507 ' H ' HG22 ' A' ' 32' ' ' THR . 0.6 OUTLIER -173.08 173.07 3.76 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.009 0.433 . . . . 0.0 111.418 -179.788 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 1.3 tt -134.95 97.67 3.81 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.899 -0.591 . . . . 0.0 110.799 -179.944 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 9.8 m-20 62.2 -164.01 0.25 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.784 -179.924 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 4.4 m 69.56 43.36 1.01 Allowed 'General case' 0 N--CA 1.462 0.153 0 CA-C-O 120.897 0.38 . . . . 0.0 110.833 -179.891 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 54.0 m -110.14 -32.42 7.0 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.108 -0.497 . . . . 0.0 110.829 179.9 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 21.5 t-20 -113.54 -52.62 2.75 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.838 -179.981 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 4.6 ttmt -78.0 -58.37 3.3 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.902 179.947 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 19.4 m-20 -105.65 -176.12 2.99 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.854 179.976 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 41' ' ' TRP . . . . . 0.449 ' NE1' ' CZ2' ' A' ' 42' ' ' TRP . 11.9 p-90 -177.1 57.36 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.832 -179.972 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 42' ' ' TRP . . . . . 0.449 ' CZ2' ' NE1' ' A' ' 41' ' ' TRP . 1.8 m-90 -152.66 29.67 0.53 Allowed 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.982 -179.965 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 4.6 tttp -147.06 135.14 21.5 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.893 0.378 . . . . 0.0 111.165 -179.986 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 44' ' ' VAL . . . . . 0.593 ' CG2' HG22 ' A' ' 53' ' ' VAL . 25.2 m -155.94 -174.97 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.914 179.811 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 31.9 tt0 -145.38 87.35 1.8 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.911 0.386 . . . . 0.0 110.902 179.942 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 46' ' ' VAL . . . . . 0.445 HG22 ' HB2' ' A' ' 31' ' ' LEU . 20.1 t -80.11 -30.87 13.03 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.026 179.949 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 5.8 p30 -159.28 49.31 0.33 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.877 179.988 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 13.0 m-20 61.7 82.39 0.17 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.869 179.946 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -177.02 163.34 2.14 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.932 179.946 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 1.2 pt20 -69.93 86.12 0.52 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.814 179.919 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -58.34 152.81 28.89 Favored Glycine 0 C--N 1.332 0.351 0 C-N-CA 120.911 -0.661 . . . . 0.0 112.533 -179.967 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 3.8 m-85 -139.18 29.58 2.23 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.781 0.324 . . . . 0.0 110.911 179.896 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 53' ' ' VAL . . . . . 0.896 HG12 ' CD2' ' A' ' 15' ' ' TYR . 25.4 m -89.35 160.27 42.76 Favored Pre-proline 0 C--N 1.33 -0.278 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.965 -179.97 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 54' ' ' PRO . . . . . 0.445 ' HD3' ' CD1' ' A' ' 15' ' ' TYR . 53.1 Cg_exo -54.78 -63.11 0.22 Allowed 'Trans proline' 0 C--N 1.346 0.413 0 C-N-CA 122.609 2.206 . . . . 0.0 112.124 179.934 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 55' ' ' ALA . . . . . 0.453 ' C ' HG23 ' A' ' 58' ' ' VAL . . . 65.76 23.53 11.49 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.311 179.98 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 56' ' ' ALA . . . . . 0.447 ' O ' ' CG ' ' A' ' 57' ' ' TYR . . . -91.12 145.85 24.33 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.372 -0.376 . . . . 0.0 110.766 179.817 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 57' ' ' TYR . . . . . 0.691 ' CD2' HD13 ' A' ' 12' ' ' LEU . 36.7 p90 44.35 39.79 3.32 Favored 'General case' 0 N--CA 1.463 0.216 0 CA-C-O 120.918 0.39 . . . . 0.0 111.208 -179.823 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 58' ' ' VAL . . . . . 0.805 ' HA ' HD11 ' A' ' 12' ' ' LEU . 73.1 t -74.27 -80.96 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 115.976 -0.556 . . . . 0.0 111.11 -179.944 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 59' ' ' LYS . . . . . 0.465 ' CE ' HD21 ' A' ' 10' ' ' LEU . 60.0 mmtt -147.88 24.78 1.06 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.502 -0.317 . . . . 0.0 111.126 -179.837 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.464 0.226 0 CA-C-N 116.322 -0.399 . . . . 0.0 111.535 179.939 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 8' ' ' LEU . . . . . 0.583 HD22 HG13 ' A' ' 30' ' ' ILE . 0.4 OUTLIER . . . . . 0 C--O 1.232 0.134 0 CA-C-O 120.775 0.321 . . . . 0.0 110.831 . . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 9' ' ' VAL . . . . . 0.575 HG23 HD21 ' A' ' 33' ' ' LEU . 20.6 t -118.15 141.17 38.58 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.202 0 CA-C-N 116.277 -0.419 . . . . 0.0 111.253 -179.816 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 10' ' ' LEU . . . . . 0.736 HD23 HD13 ' A' ' 30' ' ' ILE . 1.4 mt -99.17 -26.76 14.09 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.88 179.822 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 11' ' ' ALA . . . . . 0.737 ' HB1' ' OD1' ' A' ' 14' ' ' ASP . . . 65.27 51.71 1.57 Allowed 'General case' 0 C--N 1.333 -0.145 0 CA-C-N 116.209 -0.45 . . . . 0.0 111.124 -179.918 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.699 ' CD1' HG13 ' A' ' 58' ' ' VAL . 1.3 mp -56.96 124.89 20.23 Favored 'General case' 0 C--O 1.233 0.191 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.872 179.943 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 3.3 m-85 61.87 63.02 1.17 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.835 -179.89 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 14' ' ' ASP . . . . . 0.737 ' OD1' ' HB1' ' A' ' 11' ' ' ALA . 13.5 m-20 -60.73 -80.83 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.012 179.98 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 15' ' ' TYR . . . . . 0.446 ' CD2' ' HE3' ' A' ' 26' ' ' LYS . 0.1 OUTLIER 61.84 -165.27 0.23 Allowed 'General case' 0 C--N 1.332 -0.165 0 CA-C-N 116.412 -0.358 . . . . 0.0 110.908 179.987 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -69.91 -170.26 0.32 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.888 179.946 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 17' ' ' GLU . . . . . 0.519 ' HB2' HG23 ' A' ' 23' ' ' VAL . 0.0 OUTLIER . . . . . 0 C--N 1.329 -0.29 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.901 179.906 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 5.5 pm0 . . . . . 0 C--O 1.232 0.14 0 CA-C-O 120.737 0.303 . . . . 0.0 110.961 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 23' ' ' VAL . . . . . 0.535 HG11 ' HA ' ' A' ' 53' ' ' VAL . 7.9 t -139.65 161.03 27.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.916 -179.938 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 24' ' ' THR . . . . . 0.779 HG23 ' HG3' ' A' ' 25' ' ' MET . 12.4 t -149.2 -161.78 1.42 Allowed 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.907 -179.9 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 25' ' ' MET . . . . . 0.779 ' HG3' HG23 ' A' ' 24' ' ' THR . 0.0 OUTLIER 75.73 174.37 0.24 Allowed 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.84 0.353 . . . . 0.0 111.079 179.974 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 26' ' ' LYS . . . . . 0.446 ' HE3' ' CD2' ' A' ' 15' ' ' TYR . 0.0 OUTLIER -176.8 -164.83 0.11 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.877 179.985 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 2.0 mtpm? 62.97 165.92 0.12 Allowed 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.944 -179.947 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -63.43 -121.8 0.01 OUTLIER Glycine 0 N--CA 1.451 -0.334 0 C-N-CA 120.724 -0.751 . . . . 0.0 112.54 -179.972 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER 62.95 144.99 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.792 0.33 . . . . 0.0 110.987 -179.896 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 30' ' ' ILE . . . . . 0.736 HD13 HD23 ' A' ' 10' ' ' LEU . 10.6 mm -85.4 163.27 2.73 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.354 -0.385 . . . . 0.0 110.998 179.989 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 1.061 HD22 HG11 ' A' ' 44' ' ' VAL . 0.2 OUTLIER -130.31 -106.07 0.28 Allowed 'General case' 0 CA--C 1.537 0.476 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.885 -179.891 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 32' ' ' THR . . . . . 0.455 HG22 ' N ' ' A' ' 33' ' ' LEU . 51.9 m -168.51 161.95 11.91 Favored 'General case' 0 N--CA 1.462 0.132 0 CA-C-O 120.83 0.348 . . . . 0.0 110.819 179.909 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.575 HD21 HG23 ' A' ' 9' ' ' VAL . 0.1 OUTLIER -149.49 -170.08 3.54 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.916 179.914 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.736 HD12 ' O ' ' A' ' 34' ' ' LEU . 1.0 OUTLIER -150.12 102.84 3.13 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.909 179.868 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 77.9 m-20 62.58 -80.12 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.937 -179.895 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 1.2 m 62.72 150.27 0.03 OUTLIER 'General case' 0 C--N 1.333 -0.144 0 CA-C-O 120.917 0.389 . . . . 0.0 111.018 179.882 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 1.4 t -145.82 -47.93 0.21 Allowed 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.688 179.873 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 51.9 p-10 -100.47 -161.6 0.88 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.526 179.771 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 39' ' ' LYS . . . . . 0.409 ' O ' ' CD1' ' A' ' 41' ' ' TRP . 0.0 OUTLIER -47.72 97.77 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.916 0.389 . . . . 0.0 111.004 179.922 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 6.7 p-10 -69.14 122.9 19.73 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.213 -179.719 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 41' ' ' TRP . . . . . 0.429 ' CE3' ' HA ' ' A' ' 42' ' ' TRP . 49.2 p-90 -177.12 -35.03 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.291 179.905 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 42' ' ' TRP . . . . . 0.461 ' CE3' ' N ' ' A' ' 42' ' ' TRP . 0.0 OUTLIER -46.82 -96.84 0.0 OUTLIER 'General case' 0 CA--C 1.535 0.387 0 CA-C-N 116.399 -0.364 . . . . 0.0 111.935 -179.305 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 10.9 tttp -89.29 128.38 35.86 Favored 'General case' 0 C--N 1.334 -0.092 0 CA-C-O 120.849 0.357 . . . . 0.0 111.042 -179.836 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 44' ' ' VAL . . . . . 1.061 HG11 HD22 ' A' ' 31' ' ' LEU . 40.3 t -114.15 -31.89 2.04 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.051 -179.995 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 5.2 tm-20 62.99 33.58 14.73 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.946 -179.991 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 46' ' ' VAL . . . . . 0.643 HG11 ' HE1' ' A' ' 25' ' ' MET . 10.2 p -84.28 151.92 3.81 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.041 179.93 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 2.1 t-20 -62.92 166.65 5.45 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.998 -179.973 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 9.3 m-20 61.08 24.56 14.65 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.125 -0.488 . . . . 0.0 111.11 179.932 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 49' ' ' ARG . . . . . 0.671 ' CG ' HG22 ' A' ' 24' ' ' THR . 0.0 OUTLIER 177.46 -170.02 0.08 Allowed 'General case' 0 C--N 1.333 -0.129 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.748 179.896 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 1.7 tt0 -103.52 -57.34 2.05 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.856 179.972 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 145.93 90.2 0.1 OUTLIER Glycine 0 C--N 1.332 0.331 0 C-N-CA 120.917 -0.659 . . . . 0.0 112.555 -179.986 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 52' ' ' PHE . . . . . 0.495 ' O ' HG21 ' A' ' 23' ' ' VAL . 22.0 m-85 -164.23 31.28 0.07 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.735 0.302 . . . . 0.0 110.953 179.991 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 53' ' ' VAL . . . . . 1.013 HG22 HG21 ' A' ' 44' ' ' VAL . 19.0 m -62.24 129.74 92.47 Favored Pre-proline 0 C--N 1.329 -0.295 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.999 179.92 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 54' ' ' PRO . . . . . 0.411 ' O ' ' HB3' ' A' ' 55' ' ' ALA . 52.2 Cg_exo -55.17 -47.42 26.38 Favored 'Trans proline' 0 C--N 1.349 0.567 0 C-N-CA 122.43 2.087 . . . . 0.0 112.266 179.983 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 55' ' ' ALA . . . . . 0.411 ' HB3' ' O ' ' A' ' 54' ' ' PRO . . . 67.49 -70.97 0.11 Allowed 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.035 -179.992 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . 63.06 -80.29 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.211 -0.449 . . . . 0.0 111.189 -179.981 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 32.8 p90 -131.01 128.97 41.43 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.809 179.926 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 58' ' ' VAL . . . . . 0.699 HG13 ' CD1' ' A' ' 12' ' ' LEU . 36.6 t -152.36 -70.99 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.165 -179.884 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 59' ' ' LYS . . . . . 0.588 ' HG3' HG12 ' A' ' 58' ' ' VAL . 11.3 mtmt -144.59 -68.02 0.32 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.891 -179.875 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 7.3 pttt . . . . . 0 C--N 1.328 -0.33 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.993 -179.89 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 8' ' ' LEU . . . . . 0.826 HD22 HG21 ' A' ' 30' ' ' ILE . 9.7 mt . . . . . 0 C--O 1.231 0.122 0 CA-C-O 120.861 0.362 . . . . 0.0 110.901 . . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 9' ' ' VAL . . . . . 0.622 ' HB ' HD21 ' A' ' 31' ' ' LEU . 11.0 t -146.08 80.78 0.13 Allowed 'Isoleucine or valine' 0 C--O 1.232 0.176 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.116 -179.914 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 10' ' ' LEU . . . . . 0.829 ' O ' HG11 ' A' ' 58' ' ' VAL . 0.7 OUTLIER -62.1 -177.23 0.12 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.391 -0.368 . . . . 0.0 110.903 179.95 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -87.37 -27.58 22.71 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.283 -179.798 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.655 ' CD1' HD11 ' A' ' 10' ' ' LEU . 4.6 tp 75.1 -62.97 0.43 Allowed 'General case' 0 N--CA 1.464 0.249 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.803 -179.983 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 13' ' ' TYR . . . . . 0.54 ' OH ' ' HB3' ' A' ' 56' ' ' ALA . 0.1 OUTLIER -136.45 34.26 2.74 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.82 179.909 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 2.4 p30 46.88 -174.43 0.01 OUTLIER 'General case' 0 N--CA 1.463 0.194 0 CA-C-N 115.978 -0.555 . . . . 0.0 111.629 179.938 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 15' ' ' TYR . . . . . 0.431 ' CE1' ' HD2' ' A' ' 54' ' ' PRO . 7.0 t80 -119.41 -26.87 5.71 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 116.094 -0.503 . . . . 0.0 111.245 -179.862 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 8.3 tt0 64.85 120.02 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 120.95 0.405 . . . . 0.0 110.75 -179.759 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 26.9 pt-20 . . . . . 0 C--N 1.33 -0.273 0 CA-C-N 116.233 -0.439 . . . . 0.0 111.024 -179.992 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 4.9 mm-40 . . . . . 0 C--O 1.231 0.121 0 CA-C-O 120.837 0.351 . . . . 0.0 110.974 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 17.7 t -124.62 150.68 29.56 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.156 -0.474 . . . . 0.0 111.187 -179.972 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 10.3 t -140.82 -169.04 2.72 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.884 179.909 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 25' ' ' MET . . . . . 0.642 ' CE ' HG11 ' A' ' 53' ' ' VAL . 7.2 ptp -167.34 62.32 0.08 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.936 179.971 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 13.1 mmtt -61.63 166.21 4.4 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.88 -179.994 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 3.3 ttpt 60.4 -169.66 0.15 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.837 179.913 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -95.78 35.79 4.15 Favored Glycine 0 N--CA 1.45 -0.403 0 C-N-CA 120.805 -0.712 . . . . 0.0 112.55 179.927 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 29' ' ' ASP . . . . . 0.639 ' C ' HD13 ' A' ' 30' ' ' ILE . 12.4 p30 -57.79 172.16 0.42 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.713 0.292 . . . . 0.0 110.891 -179.971 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 30' ' ' ILE . . . . . 0.826 HG21 HD22 ' A' ' 8' ' ' LEU . 0.2 OUTLIER -123.13 -172.33 0.73 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.012 -179.862 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.825 ' HB3' HG22 ' A' ' 46' ' ' VAL . 0.0 OUTLIER -149.55 -177.01 5.63 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.815 -179.833 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 32' ' ' THR . . . . . 0.759 ' O ' HD12 ' A' ' 33' ' ' LEU . 15.4 t -104.26 -47.0 4.26 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.072 -179.928 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.759 HD12 ' O ' ' A' ' 32' ' ' THR . 0.2 OUTLIER 66.5 152.78 0.07 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.785 179.924 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 14.8 tp -57.95 -62.29 1.92 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.888 179.958 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 23.5 t-20 -147.05 -76.95 0.18 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.83 179.861 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER 172.86 127.35 0.02 OUTLIER 'General case' 0 N--CA 1.462 0.125 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.942 179.932 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 37' ' ' THR . . . . . 0.553 HG21 ' CH2' ' A' ' 42' ' ' TRP . 3.2 t 179.34 127.11 0.07 Allowed 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.801 179.981 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 25.2 m-80 -59.4 -82.35 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.886 179.966 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 2.4 tttp 46.9 -166.71 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.797 0.332 . . . . 0.0 111.204 179.804 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 40' ' ' ASP . . . . . 0.528 ' O ' ' HB3' ' A' ' 41' ' ' TRP . 1.5 t0 -96.41 85.07 3.83 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.88 179.733 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 41' ' ' TRP . . . . . 0.528 ' HB3' ' O ' ' A' ' 40' ' ' ASP . 0.0 OUTLIER 85.39 170.95 0.07 Allowed 'General case' 0 N--CA 1.466 0.367 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.788 -179.806 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 42' ' ' TRP . . . . . 0.553 ' CH2' HG21 ' A' ' 37' ' ' THR . 6.3 t-105 -155.87 141.43 17.8 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.864 -179.93 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 23.3 mttp -58.4 111.6 1.28 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.949 -179.943 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 44' ' ' VAL . . . . . 0.591 HG12 ' CG2' ' A' ' 46' ' ' VAL . 23.1 t -99.1 76.46 0.65 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.189 -0.46 . . . . 0.0 111.12 179.971 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 45' ' ' GLU . . . . . 0.428 ' C ' HG23 ' A' ' 46' ' ' VAL . 3.1 tm-20 -66.28 -58.3 5.66 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.847 179.957 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 46' ' ' VAL . . . . . 0.825 HG22 ' HB3' ' A' ' 31' ' ' LEU . 2.5 t 68.33 30.1 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.029 179.915 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 8.8 m120 63.39 35.1 12.44 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.94 179.959 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 1.2 t70 -179.33 167.21 1.5 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.91 179.844 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 25.3 mmm180 55.42 -165.95 0.11 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.025 179.991 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 5.8 mm-40 -80.61 -74.67 0.3 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.95 -179.965 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 153.73 -22.95 0.72 Allowed Glycine 0 C--N 1.333 0.415 0 C-N-CA 120.846 -0.692 . . . . 0.0 112.592 -179.965 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 42.9 m-85 -55.89 96.35 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 120.817 0.341 . . . . 0.0 111.128 -179.975 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 53' ' ' VAL . . . . . 0.642 HG11 ' CE ' ' A' ' 25' ' ' MET . 12.2 t -150.82 92.88 3.8 Favored Pre-proline 0 C--N 1.328 -0.36 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.046 179.9 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 54' ' ' PRO . . . . . 0.431 ' HD2' ' CE1' ' A' ' 15' ' ' TYR . 51.3 Cg_exo -53.12 87.46 0.03 OUTLIER 'Trans proline' 0 C--N 1.345 0.365 0 C-N-CA 122.617 2.211 . . . . 0.0 112.386 -179.971 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -60.32 -25.39 65.75 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.047 179.928 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 56' ' ' ALA . . . . . 0.54 ' HB3' ' OH ' ' A' ' 13' ' ' TYR . . . 64.48 -78.09 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.19 -179.915 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 57' ' ' TYR . . . . . 0.463 ' O ' HD22 ' A' ' 12' ' ' LEU . 47.2 p90 -161.47 127.68 3.8 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.028 179.955 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 58' ' ' VAL . . . . . 0.829 HG11 ' O ' ' A' ' 10' ' ' LEU . 24.2 t -145.78 126.82 7.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.018 179.853 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 59' ' ' LYS . . . . . 0.729 ' HE2' HD23 ' A' ' 10' ' ' LEU . 8.9 mmtt 60.56 -167.82 0.18 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.756 -179.868 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 20.4 mttt . . . . . 0 C--N 1.329 -0.299 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.999 -179.972 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.232 0.143 0 CA-C-O 120.879 0.371 . . . . 0.0 110.879 . . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 9' ' ' VAL . . . . . 0.956 HG23 HD11 ' A' ' 31' ' ' LEU . 15.1 m -150.82 44.34 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.218 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.046 179.942 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 10' ' ' LEU . . . . . 0.529 HD13 ' O ' ' A' ' 28' ' ' GLY . 0.8 OUTLIER -51.08 113.94 1.06 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.12 -179.899 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 11' ' ' ALA . . . . . 0.763 ' HB3' ' OD2' ' A' ' 14' ' ' ASP . . . -56.45 94.11 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.185 -0.462 . . . . 0.0 111.03 179.866 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.756 HD13 ' CE1' ' A' ' 57' ' ' TYR . 0.6 OUTLIER -55.0 -24.93 26.62 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.184 -179.958 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -138.17 84.9 2.06 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.398 -0.364 . . . . 0.0 111.069 -179.959 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 14' ' ' ASP . . . . . 0.763 ' OD2' ' HB3' ' A' ' 11' ' ' ALA . 2.1 m-20 -81.35 -160.2 0.32 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.623 179.711 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 15' ' ' TYR . . . . . 0.437 ' CD1' ' HB ' ' A' ' 24' ' ' THR . 0.9 OUTLIER 76.77 -164.8 0.05 Allowed 'General case' 0 N--CA 1.464 0.266 0 CA-C-O 120.76 0.314 . . . . 0.0 111.032 179.745 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 5.3 mt-30 75.6 -67.48 0.24 Allowed 'General case' 0 C--N 1.333 -0.129 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.787 -179.769 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 6.6 tt0 . . . . . 0 C--N 1.33 -0.248 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.014 179.933 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 2.1 mt-10 . . . . . 0 C--O 1.231 0.104 0 CA-C-O 120.83 0.348 . . . . 0.0 110.968 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 23' ' ' VAL . . . . . 0.545 HG22 ' HB2' ' A' ' 49' ' ' ARG . 7.4 t -132.48 154.94 40.83 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.02 179.904 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 24' ' ' THR . . . . . 0.437 ' HB ' ' CD1' ' A' ' 15' ' ' TYR . 0.7 OUTLIER -105.6 -77.7 0.58 Allowed 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.217 -179.883 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 25' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER 47.77 -174.34 0.01 OUTLIER 'General case' 0 CA--C 1.53 0.188 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.432 -179.815 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -178.23 104.72 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.299 -0.409 . . . . 0.0 110.894 -179.935 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 9.7 ptpp? 178.84 165.45 0.87 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.828 179.864 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 28' ' ' GLY . . . . . 0.529 ' O ' HD13 ' A' ' 10' ' ' LEU . . . -95.21 23.0 35.46 Favored Glycine 0 N--CA 1.45 -0.417 0 C-N-CA 120.773 -0.727 . . . . 0.0 112.519 179.941 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 10.7 m-20 -72.29 165.15 25.04 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.736 0.303 . . . . 0.0 110.788 179.945 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 30' ' ' ILE . . . . . 0.536 HG22 ' H ' ' A' ' 31' ' ' LEU . 5.4 mm -86.24 167.25 1.83 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.078 180.0 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.956 HD11 HG23 ' A' ' 9' ' ' VAL . 0.0 OUTLIER -153.11 166.44 32.46 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.78 -179.719 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 32' ' ' THR . . . . . 0.43 HG22 ' N ' ' A' ' 33' ' ' LEU . 76.5 m -103.71 160.14 15.02 Favored 'General case' 0 N--CA 1.462 0.13 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.043 -179.97 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.574 HD21 HG21 ' A' ' 9' ' ' VAL . 5.0 mt -122.93 -169.83 1.99 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.938 -179.94 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 27.9 tp -161.51 86.33 0.66 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.831 179.976 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 3.3 m120 61.62 81.83 0.18 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.82 179.929 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 13.2 p -125.24 -79.24 0.61 Allowed 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.961 179.966 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 51.9 m 62.39 145.1 0.02 OUTLIER 'General case' 0 C--N 1.333 -0.152 0 CA-C-N 116.231 -0.441 . . . . 0.0 111.078 179.993 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 38' ' ' ASN . . . . . 0.403 ' ND2' ' C ' ' A' ' 38' ' ' ASN . 0.0 OUTLIER 56.69 168.77 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.054 179.894 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 5.1 mmtm 59.0 -111.78 0.57 Allowed 'General case' 0 CA--C 1.534 0.335 0 CA-C-N 116.086 -0.507 . . . . 0.0 110.898 179.994 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 59.9 t0 -178.46 -68.6 0.01 OUTLIER 'General case' 0 C--O 1.231 0.085 0 CA-C-O 120.829 0.347 . . . . 0.0 110.867 179.99 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 41' ' ' TRP . . . . . . . . . . . . . 43.0 p90 -73.99 125.41 28.2 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.867 -179.974 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 42' ' ' TRP . . . . . 0.404 ' CE3' ' HA ' ' A' ' 42' ' ' TRP . 4.8 m95 -167.59 81.18 0.19 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.911 -179.951 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 7.9 mtpp 58.29 91.01 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.027 179.968 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 44' ' ' VAL . . . . . 0.807 HG13 HD23 ' A' ' 31' ' ' LEU . 18.8 t -89.73 139.65 17.15 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.111 179.937 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 1.3 pt-20 -160.54 137.63 9.15 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.889 179.943 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 46' ' ' VAL . . . . . 0.489 HG13 ' N ' ' A' ' 47' ' ' ASN . 12.4 p -156.43 -45.61 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.32 -0.4 . . . . 0.0 111.156 -179.919 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 47' ' ' ASN . . . . . 0.489 ' N ' HG13 ' A' ' 46' ' ' VAL . 2.1 t-20 -178.09 37.91 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.91 -179.923 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 46.2 m-20 -136.12 -70.04 0.48 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.951 179.986 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 49' ' ' ARG . . . . . 0.545 ' HB2' HG22 ' A' ' 23' ' ' VAL . 31.6 mtp85 -157.64 -177.63 6.73 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.838 179.931 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 10.5 mm-40 -112.38 140.32 47.2 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.931 179.997 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 136.82 153.69 6.52 Favored Glycine 0 C--N 1.332 0.338 0 C-N-CA 120.956 -0.64 . . . . 0.0 112.497 179.956 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 13.0 p90 -59.36 158.98 8.5 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.768 0.318 . . . . 0.0 110.998 -179.971 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 53' ' ' VAL . . . . . 0.658 ' HB ' HG21 ' A' ' 44' ' ' VAL . 22.0 t -147.97 139.31 13.66 Favored Pre-proline 0 C--N 1.328 -0.33 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.151 -179.844 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 50.8 Cg_exo -53.41 101.35 0.06 OUTLIER 'Trans proline' 0 C--N 1.347 0.481 0 C-N-CA 122.535 2.157 . . . . 0.0 112.191 179.944 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -55.84 -41.8 74.83 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.112 -0.494 . . . . 0.0 111.101 179.998 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 56' ' ' ALA . . . . . 0.413 ' O ' ' CD2' ' A' ' 57' ' ' TYR . . . 52.19 53.21 12.83 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.18 -0.463 . . . . 0.0 111.131 179.981 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 57' ' ' TYR . . . . . 0.756 ' CE1' HD13 ' A' ' 12' ' ' LEU . 0.0 OUTLIER 63.16 119.65 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.611 -179.814 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 58' ' ' VAL . . . . . 0.708 ' HA ' HD12 ' A' ' 12' ' ' LEU . 0.5 OUTLIER -131.07 -168.54 0.58 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.826 -179.758 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 59' ' ' LYS . . . . . 0.638 ' N ' HG13 ' A' ' 58' ' ' VAL . 0.0 OUTLIER -49.85 -77.14 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.791 0.329 . . . . 0.0 111.13 -179.93 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.33 -0.241 0 CA-C-N 116.352 -0.385 . . . . 0.0 110.905 179.979 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.232 0.152 0 CA-C-O 120.712 0.291 . . . . 0.0 110.825 . . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 9' ' ' VAL . . . . . 0.713 HG22 ' HE3' ' A' ' 59' ' ' LYS . 5.1 t 63.64 134.25 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.236 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.111 179.796 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 10' ' ' LEU . . . . . 0.641 ' N ' HD23 ' A' ' 10' ' ' LEU . 0.2 OUTLIER -130.04 144.88 51.58 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.737 179.853 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 11' ' ' ALA . . . . . 0.736 ' HB1' ' CE1' ' A' ' 13' ' ' TYR . . . -62.92 80.74 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.422 -179.832 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.721 ' H ' HG23 ' A' ' 58' ' ' VAL . 2.1 mt -103.25 32.05 3.97 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.789 179.942 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 13' ' ' TYR . . . . . 0.736 ' CE1' ' HB1' ' A' ' 11' ' ' ALA . 0.0 OUTLIER -86.46 -60.04 2.11 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.384 -0.371 . . . . 0.0 110.43 179.522 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 14' ' ' ASP . . . . . 0.445 ' HA ' ' HA ' ' A' ' 26' ' ' LYS . 58.6 t0 50.21 89.3 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.177 179.798 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 15' ' ' TYR . . . . . 0.662 ' CB ' HG21 ' A' ' 24' ' ' THR . 0.5 OUTLIER -129.34 -78.62 0.56 Allowed 'General case' 0 C--N 1.332 -0.155 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.095 179.787 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 16' ' ' GLN . . . . . 0.415 ' CB ' ' O ' ' A' ' 15' ' ' TYR . 0.0 OUTLIER 164.09 177.58 0.02 OUTLIER 'General case' 0 N--CA 1.465 0.301 0 CA-C-O 120.817 0.342 . . . . 0.0 110.795 179.979 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 57.1 mt-10 . . . . . 0 C--N 1.328 -0.351 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.111 179.907 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.231 0.114 0 CA-C-O 120.784 0.326 . . . . 0.0 110.953 . . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 23' ' ' VAL . . . . . 0.75 HG11 ' HB3' ' A' ' 49' ' ' ARG . 0.9 OUTLIER -150.21 -68.36 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.201 179.99 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 24' ' ' THR . . . . . 0.662 HG21 ' CB ' ' A' ' 15' ' ' TYR . 0.3 OUTLIER 56.79 178.95 0.04 OUTLIER 'General case' 0 C--O 1.232 0.151 0 CA-C-N 116.11 -0.495 . . . . 0.0 111.062 -179.852 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 25' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -178.87 -173.57 0.31 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.856 -179.803 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 26' ' ' LYS . . . . . 0.445 ' HA ' ' HA ' ' A' ' 14' ' ' ASP . 0.0 OUTLIER -138.25 -173.05 3.42 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.007 179.946 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 5.1 ttpm? 63.43 120.66 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.015 -0.539 . . . . 0.0 111.002 179.901 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -58.82 -86.13 0.03 OUTLIER Glycine 0 N--CA 1.452 -0.242 0 C-N-CA 120.701 -0.761 . . . . 0.0 112.437 179.816 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 2.1 t0 49.05 28.58 2.11 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.806 0.336 . . . . 0.0 111.129 179.935 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 30' ' ' ILE . . . . . 0.577 HG22 ' H ' ' A' ' 31' ' ' LEU . 4.6 mm 58.98 168.42 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.091 -179.975 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.899 ' HB2' HG22 ' A' ' 46' ' ' VAL . 0.0 OUTLIER -157.15 -175.75 5.59 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.755 -179.635 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 32' ' ' THR . . . . . 0.67 ' N ' HD22 ' A' ' 31' ' ' LEU . 86.7 m -126.27 161.72 27.11 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.976 179.941 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.508 ' CD2' HD21 ' A' ' 31' ' ' LEU . 2.3 mt -129.28 -170.11 2.22 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.2 -0.454 . . . . 0.0 111.011 -179.911 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.55 ' O ' HD23 ' A' ' 34' ' ' LEU . 9.3 tt -176.2 92.48 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.955 179.984 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 1.7 t30 61.27 89.8 0.07 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.891 -179.962 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 10.7 t -169.53 119.74 0.67 Allowed 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.861 179.965 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -122.94 170.36 10.2 Favored 'General case' 0 N--CA 1.462 0.129 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.827 -179.969 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 8.3 m-80 64.09 -79.09 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.979 179.984 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -73.71 170.33 15.47 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.856 179.938 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 40' ' ' ASP . . . . . 0.458 ' HB2' HG11 ' A' ' 58' ' ' VAL . 11.2 p30 -132.47 39.02 3.41 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.905 -179.99 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 41' ' ' TRP . . . . . 0.42 ' CD1' ' HA ' ' A' ' 56' ' ' ALA . 41.9 p-90 -159.3 31.65 0.2 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.0 -0.546 . . . . 0.0 110.684 179.942 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 42' ' ' TRP . . . . . . . . . . . . . 21.8 m95 -71.36 -47.76 54.38 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.086 -0.506 . . . . 0.0 111.138 -179.806 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 1.7 ttpm? -167.05 90.4 0.37 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.458 -0.337 . . . . 0.0 111.275 -179.852 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 44' ' ' VAL . . . . . 0.792 HG13 HD23 ' A' ' 31' ' ' LEU . 23.3 t -98.82 136.32 30.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.295 -0.412 . . . . 0.0 110.78 179.444 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 45' ' ' GLU . . . . . 0.425 ' C ' HG23 ' A' ' 46' ' ' VAL . 0.3 OUTLIER -110.89 -67.53 0.99 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.092 -179.651 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 46' ' ' VAL . . . . . 0.899 HG22 ' HB2' ' A' ' 31' ' ' LEU . 4.1 t 74.41 75.86 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 116.361 -0.381 . . . . 0.0 111.077 -179.817 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 36.6 m-20 68.6 -67.6 0.2 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.952 -179.99 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 1.2 t0 -121.9 -164.58 1.17 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.805 179.982 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 49' ' ' ARG . . . . . 0.75 ' HB3' HG11 ' A' ' 23' ' ' VAL . 0.2 OUTLIER 67.47 140.11 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.35 -0.386 . . . . 0.0 110.837 -179.993 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -69.3 -169.25 0.19 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.947 -179.967 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -80.44 -158.45 17.89 Favored Glycine 0 C--N 1.334 0.429 0 C-N-CA 120.95 -0.643 . . . . 0.0 112.425 -179.942 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 2.2 m-85 59.74 108.88 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.83 0.348 . . . . 0.0 110.821 -179.978 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 53' ' ' VAL . . . . . 0.774 HG21 ' HB ' ' A' ' 44' ' ' VAL . 62.8 t -143.12 100.84 5.31 Favored Pre-proline 0 C--N 1.328 -0.327 0 CA-C-N 116.266 -0.425 . . . . 0.0 111.196 -179.821 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 54' ' ' PRO . . . . . 0.595 ' O ' ' HB3' ' A' ' 55' ' ' ALA . 31.1 Cg_exo -59.47 -148.85 0.01 OUTLIER 'Trans proline' 0 C--N 1.347 0.467 0 C-N-CA 122.977 2.451 . . . . 0.0 111.966 179.931 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 55' ' ' ALA . . . . . 0.595 ' HB3' ' O ' ' A' ' 54' ' ' PRO . . . 81.06 -39.02 0.14 Allowed 'General case' 0 C--O 1.232 0.155 0 CA-C-O 120.818 0.342 . . . . 0.0 110.651 -179.299 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 56' ' ' ALA . . . . . 0.437 ' HB3' ' O ' ' A' ' 55' ' ' ALA . . . 68.52 -75.31 0.07 Allowed 'General case' 0 N--CA 1.453 -0.28 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.152 179.674 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 57' ' ' TYR . . . . . 0.437 ' HE1' ' HB1' ' A' ' 55' ' ' ALA . 0.1 OUTLIER -54.08 160.89 1.4 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.893 179.91 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 58' ' ' VAL . . . . . 0.721 HG23 ' H ' ' A' ' 12' ' ' LEU . 6.6 p -179.89 -47.92 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.025 179.925 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 59' ' ' LYS . . . . . 0.713 ' HE3' HG22 ' A' ' 9' ' ' VAL . 0.0 OUTLIER -179.58 178.22 0.67 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.474 -0.33 . . . . 0.0 110.826 179.459 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 7.4 ttpp . . . . . 0 C--N 1.329 -0.293 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.868 179.953 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 8' ' ' LEU . . . . . 0.886 ' O ' HG22 ' A' ' 9' ' ' VAL . 1.6 mt . . . . . 0 CA--C 1.527 0.079 0 CA-C-O 120.468 0.175 . . . . 0.0 110.919 . . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 9' ' ' VAL . . . . . 0.886 HG22 ' O ' ' A' ' 8' ' ' LEU . 1.0 OUTLIER 76.59 33.29 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.466 0.35 0 CA-C-N 115.982 -0.554 . . . . 0.0 111.441 -179.837 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 10' ' ' LEU . . . . . 0.587 ' H ' HD23 ' A' ' 10' ' ' LEU . 0.4 OUTLIER -44.99 111.59 0.34 Allowed 'General case' 0 N--CA 1.463 0.181 0 CA-C-N 115.962 -0.563 . . . . 0.0 111.2 179.69 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 11' ' ' ALA . . . . . 0.852 ' HB1' ' HB2' ' A' ' 55' ' ' ALA . . . -53.11 98.94 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 116.037 -0.529 . . . . 0.0 111.191 -179.931 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.775 HD13 ' CZ ' ' A' ' 57' ' ' TYR . 0.5 OUTLIER -52.04 157.54 1.28 Allowed 'General case' 0 C--O 1.231 0.129 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.854 -179.938 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 1.2 m-85 67.95 -70.71 0.12 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.778 -179.809 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 14' ' ' ASP . . . . . 0.446 ' HB3' ' HA ' ' A' ' 26' ' ' LYS . 0.8 OUTLIER 56.8 104.42 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.915 -179.991 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 0.7 OUTLIER -96.08 -175.68 3.46 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.148 -179.698 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 16.6 pt20 -122.43 177.75 5.26 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.792 179.921 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 17' ' ' GLU . . . . . 0.509 ' HG2' ' HA ' ' A' ' 23' ' ' VAL . 0.3 OUTLIER . . . . . 0 C--N 1.33 -0.263 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.958 -179.898 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 22' ' ' GLU . . . . . 0.405 ' OE1' ' CE1' ' A' ' 52' ' ' PHE . 27.9 mm-40 . . . . . 0 C--O 1.232 0.139 0 CA-C-O 120.832 0.348 . . . . 0.0 110.886 . . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 23' ' ' VAL . . . . . 0.719 HG11 ' HB3' ' A' ' 49' ' ' ARG . 31.5 m -58.45 179.81 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.049 179.975 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 24' ' ' THR . . . . . 0.518 HG23 ' HD2' ' A' ' 54' ' ' PRO . 0.2 OUTLIER -171.35 -165.93 0.43 Allowed 'General case' 0 N--CA 1.463 0.217 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.502 179.906 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 25' ' ' MET . . . . . 0.426 ' H ' HG22 ' A' ' 24' ' ' THR . 0.1 OUTLIER -177.3 117.16 0.1 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.422 -0.354 . . . . 0.0 110.878 179.878 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 26' ' ' LYS . . . . . 0.446 ' HA ' ' HB3' ' A' ' 14' ' ' ASP . 0.0 OUTLIER -58.84 -166.12 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.989 -179.83 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 22.6 mmtt 64.44 151.25 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.842 179.934 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -94.13 40.77 2.69 Favored Glycine 0 N--CA 1.451 -0.354 0 C-N-CA 120.772 -0.728 . . . . 0.0 112.504 -179.925 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 2.9 t0 -58.27 -176.98 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.691 0.281 . . . . 0.0 110.725 179.843 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 30' ' ' ILE . . . . . 0.579 HG22 ' H ' ' A' ' 31' ' ' LEU . 0.6 OUTLIER -103.9 -179.45 0.64 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-O 120.774 0.321 . . . . 0.0 111.026 179.97 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.75 HD12 ' N ' ' A' ' 31' ' ' LEU . 0.0 OUTLIER -150.68 -157.94 0.86 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.768 -179.376 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 32' ' ' THR . . . . . 0.573 HG23 ' N ' ' A' ' 33' ' ' LEU . 9.8 t -131.84 -53.99 0.99 Allowed 'General case' 0 N--CA 1.462 0.133 0 CA-C-O 120.765 0.317 . . . . 0.0 111.526 -179.696 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 1.018 HD11 HG12 ' A' ' 44' ' ' VAL . 1.9 mm? 62.34 138.09 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.931 0.396 . . . . 0.0 111.179 -179.985 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.567 HD12 ' OE2' ' A' ' 45' ' ' GLU . 6.8 mp -68.35 -74.2 0.13 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.868 179.947 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 7.9 p30 -154.98 31.18 0.4 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.854 179.953 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 3.3 m -70.65 139.44 51.3 Favored 'General case' 0 C--N 1.333 -0.144 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.822 -179.979 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 35.0 m -161.88 69.24 0.29 Allowed 'General case' 0 C--N 1.332 -0.158 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.844 179.968 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 2.3 m120 -158.49 -175.23 5.2 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.93 -179.898 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 1.2 pttt -69.14 -171.18 0.3 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.904 -179.98 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 3.1 p30 46.68 -175.55 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.235 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.672 -179.922 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 41' ' ' TRP . . . . . 0.463 ' CG ' ' N ' ' A' ' 42' ' ' TRP . 0.0 OUTLIER -69.01 -171.67 0.33 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.082 -0.508 . . . . 0.0 111.068 -179.698 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 42' ' ' TRP . . . . . 0.463 ' N ' ' CG ' ' A' ' 41' ' ' TRP . 5.4 m95 -166.67 154.25 9.58 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.938 179.955 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 7.9 tttp -63.67 113.25 3.24 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.965 179.994 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 44' ' ' VAL . . . . . 1.018 HG12 HD11 ' A' ' 33' ' ' LEU . 16.4 m -103.27 -174.7 0.42 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.088 179.789 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 45' ' ' GLU . . . . . 0.567 ' OE2' HD12 ' A' ' 34' ' ' LEU . 12.5 pt-20 -175.79 93.26 0.06 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.914 0.388 . . . . 0.0 110.928 179.857 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 46' ' ' VAL . . . . . 0.483 HG13 ' N ' ' A' ' 47' ' ' ASN . 11.2 p -131.98 -44.9 0.65 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.12 179.931 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 47' ' ' ASN . . . . . 0.483 ' N ' HG13 ' A' ' 46' ' ' VAL . 10.9 p-10 -107.87 -172.15 2.01 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.784 179.985 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 59.7 m-20 -57.07 -75.73 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.899 179.976 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 49' ' ' ARG . . . . . 0.719 ' HB3' HG11 ' A' ' 23' ' ' VAL . 0.7 OUTLIER -80.28 108.52 13.96 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.775 179.93 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 1.5 pp0? -158.49 -178.17 7.07 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.977 179.989 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 132.82 -7.06 5.19 Favored Glycine 0 CA--C 1.519 0.339 0 C-N-CA 120.935 -0.65 . . . . 0.0 112.754 -179.939 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 52' ' ' PHE . . . . . 0.405 ' CE1' ' OE1' ' A' ' 22' ' ' GLU . 58.9 m-85 -136.25 -80.85 0.4 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.662 0.267 . . . . 0.0 110.719 179.965 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 53' ' ' VAL . . . . . 0.607 HG21 HG21 ' A' ' 44' ' ' VAL . 30.2 t 50.34 97.66 0.04 OUTLIER Pre-proline 0 C--N 1.332 -0.187 0 CA-C-N 116.414 -0.357 . . . . 0.0 111.497 179.725 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 54' ' ' PRO . . . . . 0.518 ' HD2' HG23 ' A' ' 24' ' ' THR . 84.8 Cg_exo -47.17 -59.93 1.07 Allowed 'Trans proline' 0 C--N 1.347 0.481 0 C-N-CA 122.615 2.21 . . . . 0.0 112.48 179.958 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 55' ' ' ALA . . . . . 0.852 ' HB2' ' HB1' ' A' ' 11' ' ' ALA . . . 63.12 17.03 9.85 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.543 -179.986 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . 54.26 -88.85 0.02 OUTLIER 'General case' 0 CA--C 1.531 0.222 0 CA-C-N 116.577 -0.283 . . . . 0.0 111.423 179.949 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 57' ' ' TYR . . . . . 0.775 ' CZ ' HD13 ' A' ' 12' ' ' LEU . 25.1 p90 -124.2 -23.5 4.52 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.651 -0.25 . . . . 0.0 111.504 -179.811 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 58' ' ' VAL . . . . . 0.714 HG12 ' O ' ' A' ' 57' ' ' TYR . 9.9 p 52.82 162.86 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.464 0.274 0 CA-C-O 121.04 0.448 . . . . 0.0 111.724 -179.912 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 59' ' ' LYS . . . . . 0.616 ' HD2' HD11 ' A' ' 12' ' ' LEU . 6.4 mmmt -73.01 -48.62 34.78 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.835 -179.772 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--N 1.33 -0.26 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.882 179.994 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 8' ' ' LEU . . . . . 0.672 ' O ' HD12 ' A' ' 8' ' ' LEU . 1.2 pp . . . . . 0 C--O 1.232 0.162 0 CA-C-O 120.963 0.411 . . . . 0.0 110.731 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 9' ' ' VAL . . . . . 0.486 HG12 ' N ' ' A' ' 10' ' ' LEU . 11.6 t 70.89 161.07 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.015 -179.871 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 10' ' ' LEU . . . . . 0.529 HD11 ' CD ' ' A' ' 59' ' ' LYS . 0.0 OUTLIER -144.49 -164.52 1.93 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.145 179.418 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 11' ' ' ALA . . . . . 0.639 ' C ' HD22 ' A' ' 12' ' ' LEU . . . -137.44 15.37 2.97 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.181 179.643 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.995 HD23 ' HB3' ' A' ' 56' ' ' ALA . 1.0 OUTLIER 65.65 -67.02 0.14 Allowed 'General case' 0 C--O 1.231 0.117 0 CA-C-O 120.953 0.406 . . . . 0.0 110.535 -179.756 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 13' ' ' TYR . . . . . 0.547 ' O ' ' HB1' ' A' ' 55' ' ' ALA . 6.6 p90 -156.02 170.24 22.6 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.967 -0.56 . . . . 0.0 110.398 179.609 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 14' ' ' ASP . . . . . 0.438 ' HB3' ' HA ' ' A' ' 26' ' ' LYS . 4.9 p-10 -46.53 159.67 0.09 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.379 -0.373 . . . . 0.0 111.081 179.729 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 15' ' ' TYR . . . . . 0.414 ' CE2' ' HD2' ' A' ' 54' ' ' PRO . 10.7 t80 -115.24 -35.99 4.5 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.387 -0.37 . . . . 0.0 111.151 -179.906 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER 64.99 143.62 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.773 -179.925 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 7.4 pt-20 . . . . . 0 C--N 1.33 -0.277 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.857 -179.975 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 69.9 mm-40 . . . . . 0 C--O 1.231 0.118 0 CA-C-O 120.814 0.34 . . . . 0.0 110.996 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 23' ' ' VAL . . . . . 0.456 HG12 ' HG3' ' A' ' 25' ' ' MET . 26.5 t -153.27 -48.51 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.002 179.911 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 99.1 m 63.27 -80.13 0.03 OUTLIER 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.007 -0.542 . . . . 0.0 111.072 179.91 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 25' ' ' MET . . . . . 0.751 ' SD ' HG21 ' A' ' 46' ' ' VAL . 0.2 OUTLIER 62.16 149.83 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.882 179.968 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 26' ' ' LYS . . . . . 0.438 ' HA ' ' HB3' ' A' ' 14' ' ' ASP . 0.0 OUTLIER -140.32 104.19 4.74 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.956 -179.943 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 4.0 mtpp 61.69 151.76 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.883 -179.945 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -62.76 -83.41 0.07 OUTLIER Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 120.597 -0.811 . . . . 0.0 112.359 179.851 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 29' ' ' ASP . . . . . 0.935 ' O ' HD13 ' A' ' 30' ' ' ILE . 30.1 m-20 52.19 -90.49 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.467 0.175 . . . . 0.0 111.1 -179.967 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 30' ' ' ILE . . . . . 0.935 HD13 ' O ' ' A' ' 29' ' ' ASP . 0.2 OUTLIER -147.1 -173.02 0.36 Allowed 'Isoleucine or valine' 0 C--O 1.232 0.143 0 CA-C-O 120.832 0.349 . . . . 0.0 110.892 179.896 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.918 HD22 HG21 ' A' ' 44' ' ' VAL . 0.1 OUTLIER -163.65 -98.13 0.02 OUTLIER 'General case' 0 CA--C 1.534 0.33 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.27 179.736 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 32' ' ' THR . . . . . 0.63 HG22 ' N ' ' A' ' 33' ' ' LEU . 20.8 m -168.53 -95.75 0.01 OUTLIER 'General case' 0 CA--C 1.53 0.185 0 N-CA-C 110.495 -0.187 . . . . 0.0 110.495 179.182 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.63 ' N ' HG22 ' A' ' 32' ' ' THR . 0.4 OUTLIER 160.35 -66.1 0.0 OUTLIER 'General case' 0 N--CA 1.463 0.211 0 CA-C-O 120.872 0.368 . . . . 0.0 110.663 179.99 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.667 HD13 ' HG2' ' A' ' 45' ' ' GLU . 1.6 mp 63.91 -169.5 0.19 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.816 -179.836 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 4.1 m120 -57.06 125.96 25.05 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.005 -179.936 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 4.3 m -161.75 -44.55 0.04 OUTLIER 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.868 -179.909 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 10.2 p 55.98 31.4 17.88 Favored 'General case' 0 N--CA 1.463 0.2 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.962 -179.937 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 5.8 m-80 -177.65 -174.25 0.45 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.843 -179.954 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -114.23 86.04 2.34 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.853 179.951 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 40' ' ' ASP . . . . . 0.459 ' O ' ' N ' ' A' ' 42' ' ' TRP . 36.1 t70 -177.39 58.57 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.866 179.911 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 41' ' ' TRP . . . . . 0.427 ' CD1' ' N ' ' A' ' 41' ' ' TRP . 0.0 OUTLIER 43.85 -89.0 0.01 OUTLIER 'General case' 0 N--CA 1.467 0.386 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.521 179.894 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 42' ' ' TRP . . . . . 0.459 ' N ' ' O ' ' A' ' 40' ' ' ASP . 0.0 OUTLIER 67.76 -73.01 0.09 Allowed 'General case' 0 C--N 1.333 -0.151 0 CA-C-O 120.695 0.283 . . . . 0.0 110.919 179.952 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 4.1 ttpt -138.47 61.98 1.57 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.878 0.37 . . . . 0.0 111.02 -179.903 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 44' ' ' VAL . . . . . 0.983 HG13 HG22 ' A' ' 53' ' ' VAL . 1.5 p -100.41 139.22 22.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.703 179.768 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 45' ' ' GLU . . . . . 0.667 ' HG2' HD13 ' A' ' 34' ' ' LEU . 7.7 pt-20 -119.06 166.39 12.95 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.916 179.953 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 46' ' ' VAL . . . . . 0.904 HG22 ' HB3' ' A' ' 31' ' ' LEU . 16.1 t -129.18 84.78 0.84 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.292 -179.876 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER 58.9 107.57 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.975 179.885 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 6.3 p-10 43.38 73.47 0.14 Allowed 'General case' 0 N--CA 1.463 0.222 0 CA-C-N 116.065 -0.516 . . . . 0.0 111.514 179.891 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 12.9 mmm180 -146.42 -177.63 5.73 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.855 179.973 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 1.2 tp-100 -85.54 -69.23 0.67 Allowed 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.076 179.983 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 162.68 -175.79 39.04 Favored Glycine 0 C--N 1.333 0.412 0 C-N-CA 120.869 -0.681 . . . . 0.0 112.521 -179.975 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 52' ' ' PHE . . . . . 0.404 ' CD2' ' O ' ' A' ' 42' ' ' TRP . 0.7 OUTLIER 57.99 105.64 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.79 0.328 . . . . 0.0 110.943 179.997 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 53' ' ' VAL . . . . . 0.983 HG22 HG13 ' A' ' 44' ' ' VAL . 17.0 m -135.4 65.8 63.68 Favored Pre-proline 0 CA--C 1.532 0.275 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.313 179.84 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 54' ' ' PRO . . . . . 0.414 ' HD2' ' CE2' ' A' ' 15' ' ' TYR . 3.2 Cg_exo -74.75 52.99 3.1 Favored 'Trans proline' 0 C--N 1.346 0.432 0 C-N-CA 122.887 2.392 . . . . 0.0 112.048 179.9 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 55' ' ' ALA . . . . . 0.592 ' HB3' ' O ' ' A' ' 11' ' ' ALA . . . -59.96 -30.24 68.96 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 121.017 0.437 . . . . 0.0 110.825 179.8 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 56' ' ' ALA . . . . . 0.995 ' HB3' HD23 ' A' ' 12' ' ' LEU . . . -179.12 -163.04 0.05 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.9 -0.591 . . . . 0.0 111.018 179.999 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 57' ' ' TYR . . . . . 0.449 ' CD2' ' N ' ' A' ' 58' ' ' VAL . 48.3 p90 -59.12 -49.37 78.13 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.365 -179.737 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 58' ' ' VAL . . . . . 0.676 ' N ' HD21 ' A' ' 12' ' ' LEU . 8.5 t 72.24 155.63 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-O 120.894 0.378 . . . . 0.0 110.774 -179.673 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 59' ' ' LYS . . . . . 0.529 ' CD ' HD11 ' A' ' 10' ' ' LEU . 7.7 ptmt -57.63 176.57 0.13 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.98 -179.902 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 13.2 mmtm . . . . . 0 C--N 1.329 -0.305 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.829 179.926 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 8' ' ' LEU . . . . . 0.759 ' O ' HG13 ' A' ' 9' ' ' VAL . 2.0 tp . . . . . 0 C--O 1.231 0.132 0 CA-C-O 120.644 0.259 . . . . 0.0 110.93 . . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 9' ' ' VAL . . . . . 0.759 HG13 ' O ' ' A' ' 8' ' ' LEU . 0.0 OUTLIER 179.44 123.63 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.463 0.209 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.104 -179.95 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 10' ' ' LEU . . . . . 0.571 ' N ' HD23 ' A' ' 10' ' ' LEU . 0.1 OUTLIER -126.11 142.82 51.37 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.73 179.678 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 11' ' ' ALA . . . . . 0.677 ' HB3' ' HA2' ' A' ' 28' ' ' GLY . . . -52.07 -25.76 9.41 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.308 -0.405 . . . . 0.0 111.065 179.886 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.629 HD23 ' HA ' ' A' ' 58' ' ' VAL . 0.7 OUTLIER 67.8 -69.64 0.14 Allowed 'General case' 0 N--CA 1.461 0.115 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.868 179.914 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 13' ' ' TYR . . . . . 0.4 ' CD1' ' OH ' ' A' ' 57' ' ' TYR . 0.2 OUTLIER -73.34 -72.06 0.28 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.846 179.84 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 14' ' ' ASP . . . . . 0.434 ' O ' ' HG2' ' A' ' 25' ' ' MET . 2.2 p30 167.11 -60.39 0.0 OUTLIER 'General case' 0 N--CA 1.463 0.211 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.976 179.949 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 15' ' ' TYR . . . . . 0.469 ' CG ' ' HA ' ' A' ' 24' ' ' THR . 38.7 p90 -176.67 -163.54 0.1 Allowed 'General case' 0 N--CA 1.463 0.195 0 CA-C-O 120.856 0.36 . . . . 0.0 110.806 -179.779 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 16' ' ' GLN . . . . . 0.426 ' HG3' ' N ' ' A' ' 17' ' ' GLU . 26.5 pt20 -138.21 -47.47 0.53 Allowed 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.926 179.768 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 17' ' ' GLU . . . . . 0.433 ' HB2' ' CE2' ' A' ' 15' ' ' TYR . 2.9 tm-20 . . . . . 0 C--N 1.331 -0.237 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.038 -179.883 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 1.3 mt-10 . . . . . 0 N--CA 1.463 0.198 0 CA-C-O 120.941 0.401 . . . . 0.0 110.905 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 23' ' ' VAL . . . . . 0.692 HG22 ' N ' ' A' ' 24' ' ' THR . 1.1 p -178.28 -92.46 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.535 0.403 0 CA-C-N 116.013 -0.54 . . . . 0.0 110.666 179.61 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 24' ' ' THR . . . . . 0.692 ' N ' HG22 ' A' ' 23' ' ' VAL . 2.1 t 39.59 81.83 0.02 OUTLIER 'General case' 0 N--CA 1.466 0.355 0 N-CA-C 111.929 0.344 . . . . 0.0 111.929 179.568 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 25' ' ' MET . . . . . 0.434 ' HG2' ' O ' ' A' ' 14' ' ' ASP . 0.0 OUTLIER -97.86 -25.98 14.84 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.413 -0.358 . . . . 0.0 111.377 -179.987 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 26' ' ' LYS . . . . . 0.417 ' H ' ' HB3' ' A' ' 15' ' ' TYR . 0.1 OUTLIER 61.85 152.47 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.351 -0.386 . . . . 0.0 111.219 179.817 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 23.6 mtmt 63.83 157.32 0.07 Allowed 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.073 -0.512 . . . . 0.0 111.185 179.73 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 28' ' ' GLY . . . . . 0.677 ' HA2' ' HB3' ' A' ' 11' ' ' ALA . . . -99.26 35.51 4.65 Favored Glycine 0 C--N 1.331 0.251 0 C-N-CA 120.845 -0.693 . . . . 0.0 112.376 179.923 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 63.4 m-20 -60.25 172.55 0.81 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.728 0.299 . . . . 0.0 110.771 179.951 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 30' ' ' ILE . . . . . 0.568 HG22 ' H ' ' A' ' 31' ' ' LEU . 12.8 mm -86.95 167.31 1.78 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.068 179.982 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.907 HD22 HG11 ' A' ' 44' ' ' VAL . 0.0 OUTLIER -158.13 -94.44 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.897 -179.458 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 32' ' ' THR . . . . . 0.653 ' O ' HG13 ' A' ' 44' ' ' VAL . 3.4 t -179.65 -154.46 0.02 OUTLIER 'General case' 0 CA--C 1.53 0.201 0 N-CA-C 110.175 -0.305 . . . . 0.0 110.175 179.808 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.604 ' N ' HG23 ' A' ' 32' ' ' THR . 0.3 OUTLIER -169.7 115.19 0.54 Allowed 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.911 0.386 . . . . 0.0 111.102 179.723 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -59.51 107.28 0.56 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.713 179.848 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 4.2 t-20 65.95 -167.47 0.21 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.64 -179.858 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 3.6 m -62.71 169.57 3.05 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-N 116.332 -0.395 . . . . 0.0 110.835 -179.997 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 37' ' ' THR . . . . . 0.456 HG23 ' N ' ' A' ' 38' ' ' ASN . 9.2 t -107.95 -47.65 3.53 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.862 179.912 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 38' ' ' ASN . . . . . 0.456 ' N ' HG23 ' A' ' 37' ' ' THR . 50.9 t30 64.9 -73.36 0.06 Allowed 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.148 179.927 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 39' ' ' LYS . . . . . 0.406 ' N ' ' O ' ' A' ' 37' ' ' THR . 0.0 OUTLIER -176.66 38.7 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.404 -0.362 . . . . 0.0 110.878 -179.967 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 7.3 m-20 -129.17 153.67 47.5 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.163 -0.472 . . . . 0.0 110.98 -179.978 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 41' ' ' TRP . . . . . 0.462 ' CG ' ' N ' ' A' ' 42' ' ' TRP . 18.3 p90 -58.39 -48.41 80.73 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.876 -179.982 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 42' ' ' TRP . . . . . 0.462 ' N ' ' CG ' ' A' ' 41' ' ' TRP . 77.7 m95 61.75 139.69 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.099 -0.501 . . . . 0.0 111.151 179.912 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 43' ' ' LYS . . . . . 0.415 ' O ' ' N ' ' A' ' 45' ' ' GLU . 0.1 OUTLIER -56.45 -22.12 29.99 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.361 -179.863 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 44' ' ' VAL . . . . . 0.907 HG11 HD22 ' A' ' 31' ' ' LEU . 49.1 t 62.7 -77.89 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.228 0 CA-C-N 116.479 -0.328 . . . . 0.0 111.135 -179.908 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 45' ' ' GLU . . . . . 0.618 ' O ' HG22 ' A' ' 32' ' ' THR . 24.4 mt-10 71.93 161.46 0.24 Allowed 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.053 179.998 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 46' ' ' VAL . . . . . 0.767 HG22 ' OD1' ' A' ' 47' ' ' ASN . 11.2 p -174.46 -47.74 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.175 179.908 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 47' ' ' ASN . . . . . 0.767 ' OD1' HG22 ' A' ' 46' ' ' VAL . 0.6 OUTLIER 169.82 148.86 0.03 OUTLIER 'General case' 0 N--CA 1.463 0.212 0 CA-C-O 120.907 0.384 . . . . 0.0 111.042 179.885 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 44.6 m-20 55.43 25.64 7.95 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.035 -0.53 . . . . 0.0 111.356 179.72 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -165.53 -81.35 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.473 -0.33 . . . . 0.0 110.85 179.865 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 50' ' ' GLN . . . . . 0.415 ' HA ' ' CB ' ' A' ' 45' ' ' GLU . 2.1 tt0 52.24 94.18 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.457 179.79 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 133.86 128.03 2.81 Favored Glycine 0 C--N 1.333 0.38 0 C-N-CA 120.683 -0.77 . . . . 0.0 113.107 179.642 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 52' ' ' PHE . . . . . 0.406 ' O ' HG23 ' A' ' 53' ' ' VAL . 24.1 m-85 60.75 111.97 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.977 0.417 . . . . 0.0 111.746 179.393 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 53' ' ' VAL . . . . . 0.406 HG23 ' O ' ' A' ' 52' ' ' PHE . 76.9 t -157.73 90.93 2.3 Favored Pre-proline 0 C--N 1.329 -0.3 0 CA-C-N 115.861 -0.609 . . . . 0.0 110.285 179.499 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 31.6 Cg_exo -59.41 134.23 57.27 Favored 'Trans proline' 0 C--N 1.347 0.463 0 C-N-CA 122.797 2.331 . . . . 0.0 112.414 -179.544 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -99.96 63.3 1.18 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.782 179.625 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 56' ' ' ALA . . . . . 0.658 ' HB3' ' CE1' ' A' ' 57' ' ' TYR . . . -47.08 -29.73 2.35 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.156 -0.474 . . . . 0.0 111.262 -179.83 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 57' ' ' TYR . . . . . 0.658 ' CE1' ' HB3' ' A' ' 56' ' ' ALA . 0.0 OUTLIER -157.41 -74.84 0.09 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.375 179.922 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 58' ' ' VAL . . . . . 0.629 ' HA ' HD23 ' A' ' 12' ' ' LEU . 0.2 OUTLIER 52.48 -179.51 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.079 -0.51 . . . . 0.0 111.15 179.745 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 59' ' ' LYS . . . . . 0.528 ' H ' HG12 ' A' ' 58' ' ' VAL . 0.0 OUTLIER -85.06 153.11 22.94 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.91 -179.959 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 C--N 1.329 -0.319 0 CA-C-N 116.152 -0.477 . . . . 0.0 110.876 -179.993 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 8' ' ' LEU . . . . . 0.555 ' N ' HD22 ' A' ' 8' ' ' LEU . 3.1 mm? . . . . . 0 CA--C 1.521 -0.143 0 CA-C-O 121.017 0.437 . . . . 0.0 110.959 . . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 9' ' ' VAL . . . . . 0.783 HG21 HD11 ' A' ' 33' ' ' LEU . 23.4 m -151.93 -148.14 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.45 -0.454 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.595 -179.651 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 10' ' ' LEU . . . . . 0.692 HD22 ' CE ' ' A' ' 59' ' ' LYS . 0.9 OUTLIER -169.07 31.41 0.02 OUTLIER 'General case' 0 C--N 1.334 -0.082 0 CA-C-O 120.808 0.337 . . . . 0.0 111.173 -179.993 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . 61.07 -81.55 0.02 OUTLIER 'General case' 0 CA--C 1.529 0.15 0 CA-C-N 116.22 -0.446 . . . . 0.0 111.261 179.817 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.746 HD12 ' HA ' ' A' ' 58' ' ' VAL . 1.0 OUTLIER 64.81 -77.29 0.04 OUTLIER 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 116.387 -0.37 . . . . 0.0 110.853 -179.786 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 13' ' ' TYR . . . . . 0.465 ' HB2' ' HB3' ' A' ' 56' ' ' ALA . 1.2 m-85 -103.72 62.88 0.77 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 121.083 0.468 . . . . 0.0 110.606 179.775 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 14' ' ' ASP . . . . . 0.612 ' OD2' HD21 ' A' ' 31' ' ' LEU . 14.0 m-20 -126.38 70.23 1.24 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.042 -0.527 . . . . 0.0 111.075 -179.948 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 15' ' ' TYR . . . . . 0.415 ' O ' ' CD2' ' A' ' 15' ' ' TYR . 84.0 t80 -145.5 63.41 1.27 Allowed 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.893 -179.973 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER 179.15 170.86 0.92 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.924 179.926 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 27.8 tp10 . . . . . 0 C--N 1.331 -0.23 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.727 179.967 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 49.0 tt0 . . . . . 0 CA--C 1.526 0.047 0 CA-C-O 120.752 0.31 . . . . 0.0 110.956 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 23' ' ' VAL . . . . . 0.415 HG13 ' CG ' ' A' ' 47' ' ' ASN . 21.5 t -106.74 147.17 12.34 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.262 -0.427 . . . . 0.0 111.114 -179.971 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -178.76 107.54 0.04 OUTLIER 'General case' 0 C--N 1.333 -0.11 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.023 179.927 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 25' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -160.98 125.91 3.65 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.873 179.875 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 1.8 mmmm -128.89 -160.73 1.05 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.956 -179.675 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 5.0 tttm 78.89 -179.67 0.11 Allowed 'General case' 0 N--CA 1.464 0.229 0 CA-C-O 120.864 0.364 . . . . 0.0 110.953 -179.883 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -57.03 -20.12 33.18 Favored Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.934 -0.65 . . . . 0.0 112.896 -179.768 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -47.91 134.66 13.21 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.762 0.315 . . . . 0.0 111.202 -179.85 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 30' ' ' ILE . . . . . 0.608 HG23 ' C ' ' A' ' 9' ' ' VAL . 0.3 OUTLIER -104.92 -168.55 0.25 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.88 179.989 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 1.027 HD22 HG11 ' A' ' 44' ' ' VAL . 0.0 OUTLIER -146.04 -82.26 0.14 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.917 -179.808 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 32' ' ' THR . . . . . 0.509 HG23 ' H ' ' A' ' 33' ' ' LEU . 0.7 OUTLIER 165.97 -56.67 0.0 OUTLIER 'General case' 0 N--CA 1.466 0.33 0 CA-C-O 120.893 0.378 . . . . 0.0 110.692 -179.939 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.783 HD11 HG21 ' A' ' 9' ' ' VAL . 0.3 OUTLIER 58.91 98.89 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.965 179.91 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.457 HD22 ' HD2' ' A' ' 43' ' ' LYS . 1.2 pt? -57.47 -167.19 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.977 179.929 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 7.0 p-10 -59.08 88.58 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.897 179.988 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 11.0 t -59.68 159.97 7.93 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.956 179.908 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 1.4 t -140.29 117.68 11.4 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.832 -179.986 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 10.3 m120 -60.76 89.91 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.877 179.987 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -177.41 -39.78 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.835 179.953 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 9.1 p-10 -130.79 -175.4 3.65 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.958 -179.918 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 41' ' ' TRP . . . . . 0.479 ' O ' ' CG ' ' A' ' 42' ' ' TRP . 0.1 OUTLIER -80.88 -0.9 41.13 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.381 -179.988 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 42' ' ' TRP . . . . . 0.479 ' CG ' ' O ' ' A' ' 41' ' ' TRP . 32.2 p90 45.79 -172.92 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.247 0 CA-C-O 120.853 0.358 . . . . 0.0 111.34 -179.971 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 43' ' ' LYS . . . . . 0.457 ' HD2' HD22 ' A' ' 34' ' ' LEU . 0.0 OUTLIER -126.36 162.92 24.42 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.003 -179.773 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 44' ' ' VAL . . . . . 1.027 HG11 HD22 ' A' ' 31' ' ' LEU . 11.1 t -144.23 157.69 15.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.061 -0.518 . . . . 0.0 111.105 179.99 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 45' ' ' GLU . . . . . 0.569 ' O ' HG12 ' A' ' 46' ' ' VAL . 5.5 mm-40 -101.68 -165.29 1.18 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.827 -179.91 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 46' ' ' VAL . . . . . 0.586 HG13 ' O ' ' A' ' 46' ' ' VAL . 0.4 OUTLIER 80.07 7.81 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.532 0.265 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.43 179.983 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 47' ' ' ASN . . . . . 0.415 ' CG ' HG13 ' A' ' 23' ' ' VAL . 3.0 t-20 -113.8 -36.22 4.9 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.852 0.358 . . . . 0.0 110.953 179.921 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER 73.55 7.03 5.09 Favored 'General case' 0 CA--C 1.532 0.285 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.328 -179.966 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -87.77 -70.24 0.64 Allowed 'General case' 0 C--O 1.231 0.122 0 CA-C-O 120.881 0.372 . . . . 0.0 110.826 179.851 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 2.4 tt0 -164.31 -68.89 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.9 -179.926 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 171.22 -153.25 20.08 Favored Glycine 0 C--N 1.332 0.341 0 C-N-CA 120.857 -0.687 . . . . 0.0 112.523 -179.982 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 10.8 m-85 60.62 113.41 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.773 0.32 . . . . 0.0 110.956 -179.976 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 53' ' ' VAL . . . . . 0.806 HG21 ' HB ' ' A' ' 44' ' ' VAL . 21.4 t -141.64 136.96 15.85 Favored Pre-proline 0 C--N 1.329 -0.311 0 CA-C-N 116.382 -0.372 . . . . 0.0 111.282 -179.96 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 54' ' ' PRO . . . . . 0.474 ' O ' ' HB3' ' A' ' 55' ' ' ALA . 47.5 Cg_exo -55.73 -55.08 3.28 Favored 'Trans proline' 0 C--N 1.347 0.498 0 C-N-CA 122.586 2.191 . . . . 0.0 112.294 179.93 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 55' ' ' ALA . . . . . 0.474 ' HB3' ' O ' ' A' ' 54' ' ' PRO . . . 71.96 -62.3 0.47 Allowed 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.375 -179.982 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 56' ' ' ALA . . . . . 0.468 ' HB3' ' O ' ' A' ' 55' ' ' ALA . . . 70.76 -70.89 0.14 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.132 -179.822 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 57' ' ' TYR . . . . . 0.456 ' CD1' ' N ' ' A' ' 57' ' ' TYR . 0.8 OUTLIER -149.25 -62.87 0.23 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.999 179.766 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 58' ' ' VAL . . . . . 0.746 ' HA ' HD12 ' A' ' 12' ' ' LEU . 7.7 p 39.8 49.56 0.31 Allowed 'Isoleucine or valine' 0 CA--C 1.53 0.206 0 CA-C-N 116.218 -0.446 . . . . 0.0 112.113 179.861 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 59' ' ' LYS . . . . . 0.692 ' CE ' HD22 ' A' ' 10' ' ' LEU . 15.5 mttm 74.8 30.64 0.96 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.76 -179.688 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--N 1.33 -0.258 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.895 -179.757 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 1.8 mt . . . . . 0 CA--C 1.521 -0.146 0 CA-C-O 120.907 0.384 . . . . 0.0 110.992 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 9' ' ' VAL . . . . . 0.591 HG21 HD21 ' A' ' 33' ' ' LEU . 22.3 t -144.28 -38.63 0.14 Allowed 'Isoleucine or valine' 0 N--CA 1.454 -0.242 0 CA-C-N 115.91 -0.586 . . . . 0.0 111.381 179.849 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 10' ' ' LEU . . . . . 0.436 ' HA ' HD13 ' A' ' 30' ' ' ILE . 3.2 mt 67.79 159.45 0.15 Allowed 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.365 -0.38 . . . . 0.0 110.546 -179.618 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 11' ' ' ALA . . . . . 0.737 ' HB3' ' O ' ' A' ' 26' ' ' LYS . . . -108.79 -24.59 11.22 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.931 179.702 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.819 HD12 ' HA ' ' A' ' 58' ' ' VAL . 27.4 mt 52.54 50.17 18.82 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-N 116.196 -0.457 . . . . 0.0 111.003 179.997 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 13' ' ' TYR . . . . . 0.407 ' CD2' ' HG2' ' A' ' 27' ' ' LYS . 3.6 t80 75.65 152.31 0.13 Allowed 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 115.907 -0.588 . . . . 0.0 111.09 -179.989 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 14' ' ' ASP . . . . . 0.413 ' OD1' ' N ' ' A' ' 14' ' ' ASP . 0.4 OUTLIER -45.81 155.32 0.18 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.921 -0.581 . . . . 0.0 111.374 179.837 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 15' ' ' TYR . . . . . 0.605 ' HE1' ' HB3' ' A' ' 56' ' ' ALA . 42.5 t80 -71.17 -66.57 0.6 Allowed 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.787 -179.966 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 16' ' ' GLN . . . . . 0.405 ' O ' ' CB ' ' A' ' 17' ' ' GLU . 18.5 tt0 -177.46 -34.51 0.01 OUTLIER 'General case' 0 CA--C 1.53 0.201 0 CA-C-N 116.306 -0.406 . . . . 0.0 111.469 -179.75 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 17' ' ' GLU . . . . . 0.652 ' CG ' HG21 ' A' ' 24' ' ' THR . 34.3 mt-10 . . . . . 0 N--CA 1.467 0.408 0 CA-C-N 116.277 -0.419 . . . . 0.0 110.753 -179.618 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 13.9 tt0 . . . . . 0 C--O 1.232 0.179 0 CA-C-O 120.667 0.27 . . . . 0.0 111.054 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 23' ' ' VAL . . . . . 0.765 HG22 ' HB3' ' A' ' 49' ' ' ARG . 35.4 t 59.7 78.92 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.243 0 CA-C-N 116.504 -0.317 . . . . 0.0 111.007 -179.883 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 24' ' ' THR . . . . . 0.652 HG21 ' CG ' ' A' ' 17' ' ' GLU . 41.7 p -158.87 177.11 11.52 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-O 121.022 0.439 . . . . 0.0 111.496 -179.657 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 25' ' ' MET . . . . . 0.719 ' CE ' HG21 ' A' ' 44' ' ' VAL . 0.1 OUTLIER -98.87 -161.45 0.88 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.684 -0.689 . . . . 0.0 110.329 179.541 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 26' ' ' LYS . . . . . 0.737 ' O ' ' HB3' ' A' ' 11' ' ' ALA . 3.2 mmtp -147.88 174.35 11.94 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.84 0.353 . . . . 0.0 111.124 179.516 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 27' ' ' LYS . . . . . 0.407 ' HG2' ' CD2' ' A' ' 13' ' ' TYR . 21.7 mtmm -57.37 102.14 0.08 Allowed 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.453 -179.854 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 45.5 37.05 6.33 Favored Glycine 0 C--N 1.332 0.32 0 C-N-CA 121.065 -0.588 . . . . 0.0 113.032 179.766 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 33.5 t0 -90.24 15.6 10.12 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.742 0.306 . . . . 0.0 111.396 179.817 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 30' ' ' ILE . . . . . 0.707 HG22 ' H ' ' A' ' 31' ' ' LEU . 2.4 mm 54.45 174.91 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.2 0 CA-C-O 120.943 0.401 . . . . 0.0 111.378 179.908 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.707 ' H ' HG22 ' A' ' 30' ' ' ILE . 0.0 OUTLIER -177.84 -170.85 0.27 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.383 -179.313 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 32' ' ' THR . . . . . 0.595 ' N ' HD22 ' A' ' 31' ' ' LEU . 86.8 m -122.94 163.06 21.09 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-O 121.12 0.486 . . . . 0.0 111.159 179.924 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.73 HD22 ' N ' ' A' ' 33' ' ' LEU . 0.6 OUTLIER -120.93 -61.06 1.6 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.881 -0.599 . . . . 0.0 110.955 -179.762 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER 61.88 115.84 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.92 179.978 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 92.9 m-20 60.77 87.59 0.09 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.926 179.965 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 9.2 m -163.36 166.1 23.31 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.807 -179.988 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 4.2 m -145.87 -65.18 0.31 Allowed 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.015 179.975 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 18.9 p-10 -142.56 -49.14 0.35 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.907 -179.953 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -123.56 92.83 3.77 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.861 -179.915 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 40' ' ' ASP . . . . . 0.44 ' HB2' ' CE3' ' A' ' 42' ' ' TRP . 5.1 p30 -177.68 165.81 2.11 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.174 -0.467 . . . . 0.0 110.915 179.854 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 41' ' ' TRP . . . . . . . . . . . . . 10.2 p90 -134.54 -47.61 0.76 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.875 179.931 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 42' ' ' TRP . . . . . 0.44 ' CE3' ' HB2' ' A' ' 40' ' ' ASP . 1.0 OUTLIER 62.17 -81.24 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.99 179.987 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 5.2 pttt -178.32 103.1 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.811 179.915 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 44' ' ' VAL . . . . . 0.719 HG21 ' CE ' ' A' ' 25' ' ' MET . 11.7 t -49.31 -41.89 15.31 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.899 179.816 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 3.8 tt0 58.28 41.35 23.5 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.112 -0.495 . . . . 0.0 111.238 179.689 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 46' ' ' VAL . . . . . 0.4 HG12 ' CG1' ' A' ' 44' ' ' VAL . 14.4 p -102.77 -24.09 4.16 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-O 120.92 0.39 . . . . 0.0 110.959 179.599 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 6.0 p-10 -100.08 -171.23 2.0 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.617 179.664 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 23.2 t0 -109.91 63.26 0.6 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.811 0.339 . . . . 0.0 111.037 -179.879 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 49' ' ' ARG . . . . . 0.765 ' HB3' HG22 ' A' ' 23' ' ' VAL . 54.6 ttt-85 -177.14 104.81 0.05 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.073 179.883 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 24.2 tp60 61.94 -81.57 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.121 -0.49 . . . . 0.0 111.043 179.763 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 127.75 -2.02 6.92 Favored Glycine 0 C--N 1.334 0.448 0 C-N-CA 120.795 -0.717 . . . . 0.0 112.962 -179.869 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 2.2 m-85 -44.66 -82.0 0.01 OUTLIER 'General case' 0 CA--C 1.53 0.178 0 CA-C-N 116.825 0.313 . . . . 0.0 111.395 -179.816 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 53' ' ' VAL . . . . . 0.663 HG11 ' SD ' ' A' ' 25' ' ' MET . 2.8 t 49.47 84.62 0.2 Allowed Pre-proline 0 C--N 1.332 -0.186 0 CA-C-N 116.467 -0.333 . . . . 0.0 111.308 179.912 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 54' ' ' PRO . . . . . 0.449 ' HB2' ' CZ ' ' A' ' 15' ' ' TYR . 56.1 Cg_exo -51.29 139.94 43.44 Favored 'Trans proline' 0 C--N 1.345 0.393 0 C-N-CA 122.54 2.16 . . . . 0.0 112.177 179.886 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -86.95 55.81 3.73 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.336 -179.757 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 56' ' ' ALA . . . . . 0.605 ' HB3' ' HE1' ' A' ' 15' ' ' TYR . . . -94.62 36.91 1.14 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.433 179.209 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -175.79 -168.68 0.3 Allowed 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.655 -179.239 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 58' ' ' VAL . . . . . 0.819 ' HA ' HD12 ' A' ' 12' ' ' LEU . 48.3 t 63.37 157.13 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.575 178.868 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 59' ' ' LYS . . . . . 0.442 ' N ' HG12 ' A' ' 58' ' ' VAL . 10.0 ptpt -55.92 120.5 7.51 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.945 179.952 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.329 -0.309 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.866 -179.9 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 8' ' ' LEU . . . . . 0.687 ' N ' HD13 ' A' ' 8' ' ' LEU . 0.0 OUTLIER . . . . . 0 C--O 1.231 0.103 0 CA-C-O 120.82 0.343 . . . . 0.0 110.869 . . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 9' ' ' VAL . . . . . 0.822 HG12 HG11 ' A' ' 58' ' ' VAL . 98.9 t -111.99 -95.32 0.1 OUTLIER 'Isoleucine or valine' 0 CA--C 1.534 0.362 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.167 -179.965 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 10' ' ' LEU . . . . . 0.681 HD12 ' HD3' ' A' ' 59' ' ' LYS . 2.0 mt 166.49 -54.56 0.0 OUTLIER 'General case' 0 N--CA 1.464 0.233 0 CA-C-O 120.882 0.372 . . . . 0.0 110.92 179.953 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 11' ' ' ALA . . . . . 0.576 ' HB1' ' CE ' ' A' ' 25' ' ' MET . . . 64.66 43.79 4.12 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.942 -179.473 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.676 HD13 ' H ' ' A' ' 12' ' ' LEU . 0.0 OUTLIER -56.99 155.98 7.44 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.086 -179.999 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 13' ' ' TYR . . . . . 0.4 ' CD2' ' OH ' ' A' ' 57' ' ' TYR . 0.1 OUTLIER 77.88 -5.16 2.14 Favored 'General case' 0 N--CA 1.463 0.218 0 CA-C-N 116.005 -0.543 . . . . 0.0 111.777 -179.907 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 14' ' ' ASP . . . . . 0.44 ' HB3' ' HA ' ' A' ' 26' ' ' LYS . 5.8 p-10 43.47 95.77 0.01 OUTLIER 'General case' 0 N--CA 1.462 0.146 0 CA-C-O 120.893 0.378 . . . . 0.0 111.657 179.799 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 15' ' ' TYR . . . . . 0.425 ' CZ ' ' HG2' ' A' ' 54' ' ' PRO . 10.3 t80 -74.44 116.11 14.75 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.069 -179.915 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 5.6 pt20 -88.04 -166.0 1.47 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.679 179.867 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 17' ' ' GLU . . . . . 0.441 ' HB3' ' HA ' ' A' ' 22' ' ' GLU . 1.6 pt-20 . . . . . 0 C--N 1.328 -0.348 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.897 -179.94 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 22' ' ' GLU . . . . . 0.441 ' HA ' ' HB3' ' A' ' 17' ' ' GLU . 2.2 mp0 . . . . . 0 N--CA 1.457 -0.083 0 CA-C-O 120.749 0.309 . . . . 0.0 110.93 . . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 23' ' ' VAL . . . . . 0.516 HG11 ' O ' ' A' ' 51' ' ' GLY . 27.2 m -134.93 134.82 53.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.399 179.951 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 18.0 m -130.83 154.29 48.2 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.76 179.928 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 25' ' ' MET . . . . . 0.576 ' CE ' ' HB1' ' A' ' 11' ' ' ALA . 31.2 mtm -150.09 57.49 0.96 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.959 0.409 . . . . 0.0 110.959 -179.94 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 26' ' ' LYS . . . . . 0.44 ' HA ' ' HB3' ' A' ' 14' ' ' ASP . 2.4 tppt? -40.44 120.77 1.29 Allowed 'General case' 0 N--CA 1.465 0.312 0 CA-C-N 115.899 -0.591 . . . . 0.0 111.908 -179.789 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 4.6 mptt 53.61 174.15 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.011 -0.54 . . . . 0.0 111.44 179.624 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 28' ' ' GLY . . . . . 0.646 ' HA3' HD22 ' A' ' 10' ' ' LEU . . . -82.34 61.45 4.71 Favored Glycine 0 N--CA 1.452 -0.299 0 C-N-CA 120.904 -0.665 . . . . 0.0 112.241 179.786 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -96.87 29.86 2.89 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.909 0.385 . . . . 0.0 110.883 179.91 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 30' ' ' ILE . . . . . 0.58 ' N ' HD13 ' A' ' 30' ' ' ILE . 0.4 OUTLIER 51.97 178.08 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.238 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.187 -179.939 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.897 ' HB2' HG22 ' A' ' 46' ' ' VAL . 0.0 OUTLIER -164.69 18.82 0.05 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.893 -179.057 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 32' ' ' THR . . . . . 0.566 HG22 ' H ' ' A' ' 33' ' ' LEU . 0.6 OUTLIER 52.02 178.2 0.02 OUTLIER 'General case' 0 N--CA 1.465 0.275 0 CA-C-O 120.858 0.361 . . . . 0.0 111.165 179.924 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.615 HD21 HG23 ' A' ' 9' ' ' VAL . 1.0 OUTLIER -179.85 163.99 1.16 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.927 0.394 . . . . 0.0 111.102 -179.981 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.519 HD12 ' N ' ' A' ' 34' ' ' LEU . 4.1 mp -102.16 35.38 2.41 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.938 -0.574 . . . . 0.0 110.798 179.935 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 1.7 m-20 64.68 134.76 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.919 -179.961 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 36' ' ' SER . . . . . 0.697 ' O ' HG23 ' A' ' 37' ' ' THR . 4.6 m -103.4 -172.73 2.16 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.905 179.918 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 37' ' ' THR . . . . . 0.697 HG23 ' O ' ' A' ' 36' ' ' SER . 0.3 OUTLIER -177.22 67.89 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.984 179.971 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 35.7 t-20 -172.81 -94.01 0.01 OUTLIER 'General case' 0 CA--C 1.532 0.27 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.773 179.789 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER 173.58 38.4 0.0 OUTLIER 'General case' 0 C--O 1.232 0.179 0 CA-C-O 120.672 0.272 . . . . 0.0 111.071 179.904 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 40' ' ' ASP . . . . . 0.479 ' O ' ' CG ' ' A' ' 41' ' ' TRP . 2.4 p-10 176.26 87.22 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.571 -0.286 . . . . 0.0 111.088 179.881 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 41' ' ' TRP . . . . . 0.49 ' CH2' ' CD2' ' A' ' 52' ' ' PHE . 66.8 p-90 45.69 -174.89 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.285 0 CA-C-N 116.07 -0.514 . . . . 0.0 111.603 179.833 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 42' ' ' TRP . . . . . . . . . . . . . 1.3 m95 175.82 86.38 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.833 -179.989 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 9.7 mttp 59.16 61.61 2.04 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.878 179.842 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 44' ' ' VAL . . . . . 0.856 HG13 HD23 ' A' ' 31' ' ' LEU . 82.0 t -77.72 83.36 0.88 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.942 179.827 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 6.3 mp0 -101.75 101.72 12.25 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.939 -179.89 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 46' ' ' VAL . . . . . 0.897 HG22 ' HB2' ' A' ' 31' ' ' LEU . 11.7 t -58.85 -30.47 42.82 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.047 179.858 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 63.4 m-20 -150.97 -57.36 0.16 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.773 179.888 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 48' ' ' ASP . . . . . 0.402 ' O ' ' HD2' ' A' ' 49' ' ' ARG . 8.9 p-10 -179.2 149.2 0.4 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.055 -0.521 . . . . 0.0 110.878 179.902 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 49' ' ' ARG . . . . . 0.466 ' HG2' ' O ' ' A' ' 49' ' ' ARG . 0.0 OUTLIER 76.21 -9.33 1.48 Allowed 'General case' 0 CA--C 1.536 0.405 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.629 179.901 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 24.0 mm-40 -94.37 -168.73 1.9 Allowed 'General case' 0 C--N 1.332 -0.17 0 CA-C-O 120.786 0.327 . . . . 0.0 110.835 179.636 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 51' ' ' GLY . . . . . 0.516 ' O ' HG11 ' A' ' 23' ' ' VAL . . . 134.65 166.76 11.26 Favored Glycine 0 C--N 1.334 0.442 0 C-N-CA 120.812 -0.708 . . . . 0.0 112.693 179.877 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 52' ' ' PHE . . . . . 0.49 ' CD2' ' CH2' ' A' ' 41' ' ' TRP . 5.2 m-85 62.86 107.9 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.839 0.352 . . . . 0.0 111.161 179.855 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 53' ' ' VAL . . . . . 0.819 ' CG2' HG21 ' A' ' 44' ' ' VAL . 30.2 m -155.88 105.0 2.12 Favored Pre-proline 0 CA--C 1.531 0.242 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.146 179.752 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 54' ' ' PRO . . . . . 0.425 ' HG2' ' CZ ' ' A' ' 15' ' ' TYR . 32.1 Cg_exo -59.02 93.97 0.08 OUTLIER 'Trans proline' 0 C--N 1.346 0.446 0 C-N-CA 122.539 2.16 . . . . 0.0 112.368 -179.775 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -61.47 89.94 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.912 179.826 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -53.04 -80.26 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.209 -0.451 . . . . 0.0 111.174 -179.793 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 57' ' ' TYR . . . . . 0.553 ' O ' HD11 ' A' ' 12' ' ' LEU . 20.2 p90 -133.57 98.09 4.11 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.39 -0.368 . . . . 0.0 110.729 179.802 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 58' ' ' VAL . . . . . 0.822 HG11 HG12 ' A' ' 9' ' ' VAL . 1.8 t -133.11 167.97 25.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.371 -179.709 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 59' ' ' LYS . . . . . 0.681 ' HD3' HD12 ' A' ' 10' ' ' LEU . 0.0 OUTLIER -79.74 148.21 31.59 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.862 179.817 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.329 -0.285 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.049 -179.971 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 8' ' ' LEU . . . . . 0.677 ' O ' HG13 ' A' ' 9' ' ' VAL . 0.1 OUTLIER . . . . . 0 C--O 1.231 0.122 0 CA-C-O 120.763 0.316 . . . . 0.0 110.977 . . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 9' ' ' VAL . . . . . 0.925 HG21 HD11 ' A' ' 33' ' ' LEU . 0.7 OUTLIER -164.36 172.64 0.22 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.195 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.074 -179.93 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 10' ' ' LEU . . . . . 0.571 HD11 ' CD ' ' A' ' 59' ' ' LYS . 0.4 OUTLIER -132.36 -37.94 1.07 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.51 -179.785 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 11' ' ' ALA . . . . . 0.794 ' HB1' ' CZ ' ' A' ' 13' ' ' TYR . . . 73.52 67.39 0.1 Allowed 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 121.018 0.437 . . . . 0.0 110.123 -178.972 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.496 ' H ' HG23 ' A' ' 58' ' ' VAL . 1.2 mp -80.55 12.15 3.27 Favored 'General case' 0 CA--C 1.531 0.213 0 CA-C-N 115.938 -0.574 . . . . 0.0 111.707 -179.639 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 13' ' ' TYR . . . . . 0.805 ' CD2' HG21 ' A' ' 44' ' ' VAL . 0.0 OUTLIER -50.8 177.61 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.171 0 CA-C-O 120.903 0.382 . . . . 0.0 111.175 179.983 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 9.7 p30 -173.14 36.85 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.755 179.859 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 15' ' ' TYR . . . . . 0.4 ' CD1' ' N ' ' A' ' 16' ' ' GLN . 7.1 t80 -83.73 153.49 24.13 Favored 'General case' 0 C--N 1.333 -0.15 0 CA-C-N 116.086 -0.506 . . . . 0.0 111.1 -179.849 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 16' ' ' GLN . . . . . 0.4 ' N ' ' CD1' ' A' ' 15' ' ' TYR . 10.0 mp0 -145.87 90.16 1.96 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.865 179.908 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 4.4 tt0 . . . . . 0 C--N 1.329 -0.32 0 CA-C-N 116.35 -0.387 . . . . 0.0 111.146 -179.76 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 C--O 1.23 0.074 0 CA-C-O 120.795 0.331 . . . . 0.0 110.868 . . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 23' ' ' VAL . . . . . 0.63 HG13 ' O ' ' A' ' 52' ' ' PHE . 38.8 t -148.02 110.64 0.68 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.078 -179.978 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 2.7 t -179.17 104.52 0.03 OUTLIER 'General case' 0 N--CA 1.462 0.16 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.954 179.941 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 25' ' ' MET . . . . . 0.425 ' HG2' ' CE2' ' A' ' 13' ' ' TYR . 2.2 mpp? -140.03 170.44 15.85 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.98 179.888 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -176.07 -179.37 1.12 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.876 179.979 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 13.1 mmmt 71.18 -169.75 0.15 Allowed 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.938 -179.994 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -116.06 25.04 9.64 Favored Glycine 0 C--N 1.332 0.337 0 C-N-CA 120.815 -0.707 . . . . 0.0 112.622 -179.842 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 29' ' ' ASP . . . . . 0.471 ' O ' ' HB3' ' A' ' 11' ' ' ALA . 56.4 t0 -65.3 120.97 13.75 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.841 0.353 . . . . 0.0 110.582 179.769 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 30' ' ' ILE . . . . . 0.643 HG23 ' O ' ' A' ' 9' ' ' VAL . 5.2 mt -59.71 166.49 0.62 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.114 -179.684 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.781 HD13 HD21 ' A' ' 33' ' ' LEU . 0.0 OUTLIER -148.22 -167.37 2.79 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.132 -178.928 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 32' ' ' THR . . . . . 0.493 HG23 ' N ' ' A' ' 33' ' ' LEU . 14.8 t -102.36 -47.94 4.33 Favored 'General case' 0 C--N 1.333 -0.127 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.849 179.964 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.925 HD11 HG21 ' A' ' 9' ' ' VAL . 0.2 OUTLIER 64.99 170.86 0.2 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.844 179.81 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.419 HD23 ' N ' ' A' ' 35' ' ' ASN . 0.8 OUTLIER -93.05 -77.43 0.44 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.985 179.984 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 35' ' ' ASN . . . . . 0.419 ' N ' HD23 ' A' ' 34' ' ' LEU . 20.0 t-20 -138.03 -44.24 0.52 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.952 -179.936 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 3.1 t 69.02 112.25 0.05 OUTLIER 'General case' 0 N--CA 1.462 0.168 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.866 179.991 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 8.9 t -177.5 160.8 1.66 Allowed 'General case' 0 C--O 1.231 0.124 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.815 179.873 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 8.7 m120 60.41 172.82 0.09 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.888 -179.913 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -114.83 107.63 15.67 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.986 -180.0 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 40' ' ' ASP . . . . . 0.46 ' O ' ' N ' ' A' ' 42' ' ' TRP . 1.5 m-20 -178.63 81.44 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.081 -0.508 . . . . 0.0 110.893 179.944 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 41' ' ' TRP . . . . . 0.576 ' CG ' ' N ' ' A' ' 42' ' ' TRP . 0.0 OUTLIER 65.18 -65.05 0.16 Allowed 'General case' 0 CA--C 1.532 0.258 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.931 -179.906 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 42' ' ' TRP . . . . . 0.576 ' N ' ' CG ' ' A' ' 41' ' ' TRP . 3.8 t-105 57.89 115.93 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.189 -0.46 . . . . 0.0 111.402 -179.869 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 43' ' ' LYS . . . . . 0.445 ' HG3' ' CZ3' ' A' ' 42' ' ' TRP . 2.5 ptpp? -71.95 -177.21 1.94 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.373 179.417 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 44' ' ' VAL . . . . . 0.805 HG21 ' CD2' ' A' ' 13' ' ' TYR . 0.3 OUTLIER -118.53 -40.87 2.28 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-O 120.868 0.366 . . . . 0.0 111.131 179.975 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER 61.49 114.1 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.022 -179.964 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 46' ' ' VAL . . . . . 0.638 HG22 HD23 ' A' ' 31' ' ' LEU . 21.4 t -141.04 -57.31 0.25 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.048 179.88 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 7.9 m-80 -129.81 -174.82 3.41 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.752 179.93 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 16.6 m-20 -68.44 73.22 0.22 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.886 179.984 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -156.01 26.94 0.37 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.959 -179.954 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER 56.94 -167.61 0.12 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.393 -0.367 . . . . 0.0 110.943 179.919 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -91.18 -108.58 1.5 Allowed Glycine 0 C--N 1.332 0.349 0 C-N-CA 120.958 -0.639 . . . . 0.0 112.538 179.993 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 52' ' ' PHE . . . . . 0.63 ' O ' HG13 ' A' ' 23' ' ' VAL . 19.6 m-85 55.41 79.53 0.15 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.86 0.362 . . . . 0.0 110.562 -179.941 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 53' ' ' VAL . . . . . 0.492 HG13 ' HB ' ' A' ' 44' ' ' VAL . 1.5 p 179.0 92.73 0.17 Allowed Pre-proline 0 C--N 1.327 -0.377 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.708 -179.498 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_exo -52.56 130.85 38.41 Favored 'Trans proline' 0 C--N 1.346 0.424 0 C-N-CA 122.535 2.156 . . . . 0.0 112.295 -179.878 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -64.15 -52.37 59.37 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.057 -0.519 . . . . 0.0 110.969 -179.979 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 56' ' ' ALA . . . . . 0.439 ' O ' ' HD1' ' A' ' 57' ' ' TYR . . . 58.61 47.12 13.67 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.058 179.987 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 57' ' ' TYR . . . . . 0.476 ' CD1' ' C ' ' A' ' 57' ' ' TYR . 0.0 OUTLIER 81.56 147.15 0.09 Allowed 'General case' 0 N--CA 1.464 0.271 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.688 -179.827 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 58' ' ' VAL . . . . . 0.515 HG13 ' N ' ' A' ' 59' ' ' LYS . 8.2 p -178.49 -47.69 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.365 -179.788 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 59' ' ' LYS . . . . . 0.571 ' CD ' HD11 ' A' ' 10' ' ' LEU . 0.4 OUTLIER 178.79 -167.87 0.08 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.361 -0.382 . . . . 0.0 110.788 -179.91 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--N 1.33 -0.281 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.815 179.925 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 69.3 tt0 . . . . . 0 C--O 1.232 0.132 0 CA-C-O 120.732 0.301 . . . . 0.0 110.914 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.661 ' O ' HG13 ' A' ' 9' ' ' VAL . 2.1 tp -178.5 -71.71 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.831 179.876 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 9' ' ' VAL . . . . . 0.661 HG13 ' O ' ' A' ' 8' ' ' LEU . 1.5 m -163.51 64.67 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.333 -0.146 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.092 179.908 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 10' ' ' LEU . . . . . 0.749 ' O ' HG13 ' A' ' 58' ' ' VAL . 0.8 OUTLIER -61.06 159.31 11.91 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.189 -0.459 . . . . 0.0 111.005 179.941 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 11' ' ' ALA . . . . . 0.631 ' HB2' ' HG2' ' A' ' 25' ' ' MET . . . -71.91 -20.89 61.71 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.099 -0.501 . . . . 0.0 111.384 179.933 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.805 HD11 ' HA ' ' A' ' 58' ' ' VAL . 0.5 OUTLIER 74.94 16.26 2.94 Favored 'General case' 0 N--CA 1.465 0.313 0 CA-C-N 116.33 -0.396 . . . . 0.0 111.277 179.96 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER 177.19 -77.72 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.181 0 CA-C-O 120.661 0.267 . . . . 0.0 110.97 179.851 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER 169.29 -34.17 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.442 -0.345 . . . . 0.0 110.905 -179.805 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 15' ' ' TYR . . . . . 0.896 ' CD2' HG12 ' A' ' 53' ' ' VAL . 19.4 t80 68.25 -62.58 0.36 Allowed 'General case' 0 N--CA 1.465 0.285 0 CA-C-N 116.145 -0.479 . . . . 0.0 111.265 -179.847 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 16' ' ' GLN . . . . . 0.403 ' HA ' ' HB ' ' A' ' 24' ' ' THR . 13.1 pt20 44.94 88.65 0.02 OUTLIER 'General case' 0 N--CA 1.463 0.201 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.391 -179.769 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 17' ' ' GLU . . . . . 0.738 ' N ' HG22 ' A' ' 24' ' ' THR . 6.3 tp10 -58.11 -63.72 1.16 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.969 179.918 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -176.69 106.85 0.07 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.917 -179.953 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER 59.61 161.54 0.1 OUTLIER Pre-proline 0 C--N 1.33 -0.261 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.889 179.975 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.55 63.16 1.67 Allowed 'Trans proline' 0 C--N 1.345 0.387 0 C-N-CA 122.607 2.204 . . . . 0.0 112.306 -179.986 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -134.68 -61.6 0.76 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.871 179.987 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -88.17 -169.58 2.63 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.939 179.946 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 3.0 m -59.21 101.4 0.1 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.202 179.961 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 24' ' ' THR . . . . . 0.738 HG22 ' N ' ' A' ' 17' ' ' GLU . 75.0 p -135.44 105.68 6.34 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 116.108 -0.497 . . . . 0.0 111.004 -179.849 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 25' ' ' MET . . . . . 0.707 ' CE ' HG11 ' A' ' 53' ' ' VAL . 1.8 mpp? -87.54 170.06 11.64 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.673 179.877 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 8.3 tptm -156.1 127.47 7.15 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.165 -179.824 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 10.8 ttmt 62.85 -79.79 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.147 179.896 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 179.16 61.05 0.08 OUTLIER Glycine 0 N--CA 1.452 -0.284 0 C-N-CA 120.667 -0.778 . . . . 0.0 112.44 -179.973 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 38.0 m-20 -83.97 4.16 31.0 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.565 0.221 . . . . 0.0 111.249 179.872 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 30' ' ' ILE . . . . . 0.665 HG22 ' H ' ' A' ' 31' ' ' LEU . 3.4 mm 57.66 172.21 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-O 120.972 0.415 . . . . 0.0 111.199 179.943 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.665 ' H ' HG22 ' A' ' 30' ' ' ILE . 0.0 OUTLIER -173.78 151.12 1.78 Allowed 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.002 -0.544 . . . . 0.0 110.702 -179.184 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 32' ' ' THR . . . . . 0.507 HG22 ' H ' ' A' ' 33' ' ' LEU . 0.8 OUTLIER -79.59 175.72 10.36 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.207 179.607 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.507 ' H ' HG22 ' A' ' 32' ' ' THR . 0.6 OUTLIER -173.08 173.07 3.76 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.009 0.433 . . . . 0.0 111.418 -179.788 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 1.3 tt -134.95 97.67 3.81 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.899 -0.591 . . . . 0.0 110.799 -179.944 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 9.8 m-20 62.2 -164.01 0.25 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.784 -179.924 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 4.4 m 69.56 43.36 1.01 Allowed 'General case' 0 N--CA 1.462 0.153 0 CA-C-O 120.897 0.38 . . . . 0.0 110.833 -179.891 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 54.0 m -110.14 -32.42 7.0 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.108 -0.497 . . . . 0.0 110.829 179.9 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 21.5 t-20 -113.54 -52.62 2.75 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.838 -179.981 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 4.6 ttmt -78.0 -58.37 3.3 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.902 179.947 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 19.4 m-20 -105.65 -176.12 2.99 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.854 179.976 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 41' ' ' TRP . . . . . 0.449 ' NE1' ' CZ2' ' A' ' 42' ' ' TRP . 11.9 p-90 -177.1 57.36 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.832 -179.972 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 42' ' ' TRP . . . . . 0.449 ' CZ2' ' NE1' ' A' ' 41' ' ' TRP . 1.8 m-90 -152.66 29.67 0.53 Allowed 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.982 -179.965 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 4.6 tttp -147.06 135.14 21.5 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.893 0.378 . . . . 0.0 111.165 -179.986 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 44' ' ' VAL . . . . . 0.593 ' CG2' HG22 ' A' ' 53' ' ' VAL . 25.2 m -155.94 -174.97 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.914 179.811 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 31.9 tt0 -145.38 87.35 1.8 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.911 0.386 . . . . 0.0 110.902 179.942 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 46' ' ' VAL . . . . . 0.445 HG22 ' HB2' ' A' ' 31' ' ' LEU . 20.1 t -80.11 -30.87 13.03 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.026 179.949 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 5.8 p30 -159.28 49.31 0.33 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.877 179.988 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 13.0 m-20 61.7 82.39 0.17 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.869 179.946 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -177.02 163.34 2.14 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.932 179.946 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 1.2 pt20 -69.93 86.12 0.52 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.814 179.919 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -58.34 152.81 28.89 Favored Glycine 0 C--N 1.332 0.351 0 C-N-CA 120.911 -0.661 . . . . 0.0 112.533 -179.967 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 3.8 m-85 -139.18 29.58 2.23 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.781 0.324 . . . . 0.0 110.911 179.896 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 53' ' ' VAL . . . . . 0.896 HG12 ' CD2' ' A' ' 15' ' ' TYR . 25.4 m -89.35 160.27 42.76 Favored Pre-proline 0 C--N 1.33 -0.278 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.965 -179.97 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 54' ' ' PRO . . . . . 0.445 ' HD3' ' CD1' ' A' ' 15' ' ' TYR . 53.1 Cg_exo -54.78 -63.11 0.22 Allowed 'Trans proline' 0 C--N 1.346 0.413 0 C-N-CA 122.609 2.206 . . . . 0.0 112.124 179.934 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 55' ' ' ALA . . . . . 0.453 ' C ' HG23 ' A' ' 58' ' ' VAL . . . 65.76 23.53 11.49 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.311 179.98 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 56' ' ' ALA . . . . . 0.447 ' O ' ' CG ' ' A' ' 57' ' ' TYR . . . -91.12 145.85 24.33 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.372 -0.376 . . . . 0.0 110.766 179.817 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 57' ' ' TYR . . . . . 0.691 ' CD2' HD13 ' A' ' 12' ' ' LEU . 36.7 p90 44.35 39.79 3.32 Favored 'General case' 0 N--CA 1.463 0.216 0 CA-C-O 120.918 0.39 . . . . 0.0 111.208 -179.823 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 58' ' ' VAL . . . . . 0.805 ' HA ' HD11 ' A' ' 12' ' ' LEU . 73.1 t -74.27 -80.96 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 115.976 -0.556 . . . . 0.0 111.11 -179.944 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 59' ' ' LYS . . . . . 0.465 ' CE ' HD21 ' A' ' 10' ' ' LEU . 60.0 mmtt -147.88 24.78 1.06 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.502 -0.317 . . . . 0.0 111.126 -179.837 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 42.61 35.17 0.64 Allowed 'General case' 0 N--CA 1.464 0.226 0 CA-C-N 116.322 -0.399 . . . . 0.0 111.535 179.939 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 61' ' ' LEU . . . . . 0.65 HD13 HG13 ' A' ' 9' ' ' VAL . 1.5 tp -59.19 127.18 30.88 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.976 179.969 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 2.5 t0 . . . . . 0 C--O 1.248 1.0 0 CA-C-O 118.3 -0.857 . . . . 0.0 110.869 179.999 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--O 1.231 0.106 0 CA-C-O 120.796 0.332 . . . . 0.0 110.929 . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.583 HD22 HG13 ' A' ' 30' ' ' ILE . 0.4 OUTLIER -176.27 167.33 2.86 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.831 -179.967 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 9' ' ' VAL . . . . . 0.575 HG23 HD21 ' A' ' 33' ' ' LEU . 20.6 t -118.15 141.17 38.58 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.202 0 CA-C-N 116.277 -0.419 . . . . 0.0 111.253 -179.816 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 10' ' ' LEU . . . . . 0.736 HD23 HD13 ' A' ' 30' ' ' ILE . 1.4 mt -99.17 -26.76 14.09 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.88 179.822 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 11' ' ' ALA . . . . . 0.737 ' HB1' ' OD1' ' A' ' 14' ' ' ASP . . . 65.27 51.71 1.57 Allowed 'General case' 0 C--N 1.333 -0.145 0 CA-C-N 116.209 -0.45 . . . . 0.0 111.124 -179.918 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.699 ' CD1' HG13 ' A' ' 58' ' ' VAL . 1.3 mp -56.96 124.89 20.23 Favored 'General case' 0 C--O 1.233 0.191 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.872 179.943 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 3.3 m-85 61.87 63.02 1.17 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.835 -179.89 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 14' ' ' ASP . . . . . 0.737 ' OD1' ' HB1' ' A' ' 11' ' ' ALA . 13.5 m-20 -60.73 -80.83 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.012 179.98 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 15' ' ' TYR . . . . . 0.446 ' CD2' ' HE3' ' A' ' 26' ' ' LYS . 0.1 OUTLIER 61.84 -165.27 0.23 Allowed 'General case' 0 C--N 1.332 -0.165 0 CA-C-N 116.412 -0.358 . . . . 0.0 110.908 179.987 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -69.91 -170.26 0.32 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.888 179.946 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 17' ' ' GLU . . . . . 0.519 ' HB2' HG23 ' A' ' 23' ' ' VAL . 0.0 OUTLIER -103.38 -178.49 3.68 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.901 179.906 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.5 -32.25 73.8 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.889 179.937 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 19' ' ' SER . . . . . 0.413 ' CB ' ' CD ' ' A' ' 20' ' ' PRO . 1.2 m -178.9 -61.61 0.0 OUTLIER Pre-proline 0 C--N 1.329 -0.292 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.952 179.892 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 20' ' ' PRO . . . . . 0.413 ' CD ' ' CB ' ' A' ' 19' ' ' SER . 58.7 Cg_endo -71.55 137.39 30.32 Favored 'Trans proline' 0 C--N 1.347 0.461 0 C-N-CA 122.588 2.192 . . . . 0.0 112.349 179.972 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 13.3 mmp_? 63.43 128.62 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.998 -179.993 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 5.5 pm0 -80.77 147.91 30.29 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.136 -0.483 . . . . 0.0 110.961 179.969 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 23' ' ' VAL . . . . . 0.535 HG11 ' HA ' ' A' ' 53' ' ' VAL . 7.9 t -139.65 161.03 27.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.916 -179.938 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 24' ' ' THR . . . . . 0.779 HG23 ' HG3' ' A' ' 25' ' ' MET . 12.4 t -149.2 -161.78 1.42 Allowed 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.907 -179.9 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 25' ' ' MET . . . . . 0.779 ' HG3' HG23 ' A' ' 24' ' ' THR . 0.0 OUTLIER 75.73 174.37 0.24 Allowed 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.84 0.353 . . . . 0.0 111.079 179.974 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 26' ' ' LYS . . . . . 0.446 ' HE3' ' CD2' ' A' ' 15' ' ' TYR . 0.0 OUTLIER -176.8 -164.83 0.11 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.877 179.985 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 2.0 mtpm? 62.97 165.92 0.12 Allowed 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.944 -179.947 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -63.43 -121.8 0.01 OUTLIER Glycine 0 N--CA 1.451 -0.334 0 C-N-CA 120.724 -0.751 . . . . 0.0 112.54 -179.972 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER 62.95 144.99 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.792 0.33 . . . . 0.0 110.987 -179.896 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 30' ' ' ILE . . . . . 0.736 HD13 HD23 ' A' ' 10' ' ' LEU . 10.6 mm -85.4 163.27 2.73 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.354 -0.385 . . . . 0.0 110.998 179.989 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 1.061 HD22 HG11 ' A' ' 44' ' ' VAL . 0.2 OUTLIER -130.31 -106.07 0.28 Allowed 'General case' 0 CA--C 1.537 0.476 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.885 -179.891 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 32' ' ' THR . . . . . 0.455 HG22 ' N ' ' A' ' 33' ' ' LEU . 51.9 m -168.51 161.95 11.91 Favored 'General case' 0 N--CA 1.462 0.132 0 CA-C-O 120.83 0.348 . . . . 0.0 110.819 179.909 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.575 HD21 HG23 ' A' ' 9' ' ' VAL . 0.1 OUTLIER -149.49 -170.08 3.54 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.916 179.914 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.736 HD12 ' O ' ' A' ' 34' ' ' LEU . 1.0 OUTLIER -150.12 102.84 3.13 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.909 179.868 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 77.9 m-20 62.58 -80.12 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.937 -179.895 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 1.2 m 62.72 150.27 0.03 OUTLIER 'General case' 0 C--N 1.333 -0.144 0 CA-C-O 120.917 0.389 . . . . 0.0 111.018 179.882 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 1.4 t -145.82 -47.93 0.21 Allowed 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.688 179.873 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 51.9 p-10 -100.47 -161.6 0.88 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.526 179.771 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 39' ' ' LYS . . . . . 0.409 ' O ' ' CD1' ' A' ' 41' ' ' TRP . 0.0 OUTLIER -47.72 97.77 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.916 0.389 . . . . 0.0 111.004 179.922 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 6.7 p-10 -69.14 122.9 19.73 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.213 -179.719 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 41' ' ' TRP . . . . . 0.429 ' CE3' ' HA ' ' A' ' 42' ' ' TRP . 49.2 p-90 -177.12 -35.03 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.291 179.905 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 42' ' ' TRP . . . . . 0.461 ' CE3' ' N ' ' A' ' 42' ' ' TRP . 0.0 OUTLIER -46.82 -96.84 0.0 OUTLIER 'General case' 0 CA--C 1.535 0.387 0 CA-C-N 116.399 -0.364 . . . . 0.0 111.935 -179.305 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 10.9 tttp -89.29 128.38 35.86 Favored 'General case' 0 C--N 1.334 -0.092 0 CA-C-O 120.849 0.357 . . . . 0.0 111.042 -179.836 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 44' ' ' VAL . . . . . 1.061 HG11 HD22 ' A' ' 31' ' ' LEU . 40.3 t -114.15 -31.89 2.04 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.051 -179.995 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 5.2 tm-20 62.99 33.58 14.73 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.946 -179.991 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 46' ' ' VAL . . . . . 0.643 HG11 ' HE1' ' A' ' 25' ' ' MET . 10.2 p -84.28 151.92 3.81 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.041 179.93 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 2.1 t-20 -62.92 166.65 5.45 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.998 -179.973 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 9.3 m-20 61.08 24.56 14.65 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.125 -0.488 . . . . 0.0 111.11 179.932 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 49' ' ' ARG . . . . . 0.671 ' CG ' HG22 ' A' ' 24' ' ' THR . 0.0 OUTLIER 177.46 -170.02 0.08 Allowed 'General case' 0 C--N 1.333 -0.129 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.748 179.896 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 1.7 tt0 -103.52 -57.34 2.05 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.856 179.972 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 145.93 90.2 0.1 OUTLIER Glycine 0 C--N 1.332 0.331 0 C-N-CA 120.917 -0.659 . . . . 0.0 112.555 -179.986 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 52' ' ' PHE . . . . . 0.495 ' O ' HG21 ' A' ' 23' ' ' VAL . 22.0 m-85 -164.23 31.28 0.07 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.735 0.302 . . . . 0.0 110.953 179.991 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 53' ' ' VAL . . . . . 1.013 HG22 HG21 ' A' ' 44' ' ' VAL . 19.0 m -62.24 129.74 92.47 Favored Pre-proline 0 C--N 1.329 -0.295 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.999 179.92 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 54' ' ' PRO . . . . . 0.411 ' O ' ' HB3' ' A' ' 55' ' ' ALA . 52.2 Cg_exo -55.17 -47.42 26.38 Favored 'Trans proline' 0 C--N 1.349 0.567 0 C-N-CA 122.43 2.087 . . . . 0.0 112.266 179.983 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 55' ' ' ALA . . . . . 0.456 ' HB1' ' CD1' ' A' ' 61' ' ' LEU . . . 67.49 -70.97 0.11 Allowed 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.035 -179.992 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . 63.06 -80.29 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.211 -0.449 . . . . 0.0 111.189 -179.981 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 32.8 p90 -131.01 128.97 41.43 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.809 179.926 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 58' ' ' VAL . . . . . 0.699 HG13 ' CD1' ' A' ' 12' ' ' LEU . 36.6 t -152.36 -70.99 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.165 -179.884 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 59' ' ' LYS . . . . . 0.588 ' HG3' HG12 ' A' ' 58' ' ' VAL . 11.3 mtmt -144.59 -68.02 0.32 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.891 -179.875 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 7.3 pttt -121.68 89.25 3.09 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.993 -179.89 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 61' ' ' LEU . . . . . 0.572 HD21 ' H ' ' A' ' 58' ' ' VAL . 2.3 pt? -176.38 130.46 0.21 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.83 179.898 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 30.3 m-20 . . . . . 0 C--O 1.249 1.066 0 CA-C-O 118.285 -0.864 . . . . 0.0 110.978 179.982 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 5.9 pt-20 . . . . . 0 CA--C 1.528 0.125 0 CA-C-O 120.848 0.356 . . . . 0.0 111.462 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.826 HD22 HG21 ' A' ' 30' ' ' ILE . 9.7 mt -159.94 -175.29 5.03 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.901 -179.998 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 9' ' ' VAL . . . . . 0.622 ' HB ' HD21 ' A' ' 31' ' ' LEU . 11.0 t -146.08 80.78 0.13 Allowed 'Isoleucine or valine' 0 C--O 1.232 0.176 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.116 -179.914 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 10' ' ' LEU . . . . . 0.829 ' O ' HG11 ' A' ' 58' ' ' VAL . 0.7 OUTLIER -62.1 -177.23 0.12 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.391 -0.368 . . . . 0.0 110.903 179.95 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -87.37 -27.58 22.71 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.283 -179.798 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.655 ' CD1' HD11 ' A' ' 10' ' ' LEU . 4.6 tp 75.1 -62.97 0.43 Allowed 'General case' 0 N--CA 1.464 0.249 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.803 -179.983 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 13' ' ' TYR . . . . . 0.54 ' OH ' ' HB3' ' A' ' 56' ' ' ALA . 0.1 OUTLIER -136.45 34.26 2.74 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.82 179.909 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 2.4 p30 46.88 -174.43 0.01 OUTLIER 'General case' 0 N--CA 1.463 0.194 0 CA-C-N 115.978 -0.555 . . . . 0.0 111.629 179.938 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 15' ' ' TYR . . . . . 0.431 ' CE1' ' HD2' ' A' ' 54' ' ' PRO . 7.0 t80 -119.41 -26.87 5.71 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 116.094 -0.503 . . . . 0.0 111.245 -179.862 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 8.3 tt0 64.85 120.02 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 120.95 0.405 . . . . 0.0 110.75 -179.759 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 26.9 pt-20 -118.71 135.16 54.63 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.233 -0.439 . . . . 0.0 111.024 -179.992 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 8.7 tptm -82.79 134.21 35.12 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.624 179.743 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 62.63 165.56 0.11 Allowed Pre-proline 0 C--N 1.328 -0.356 0 CA-C-N 116.394 -0.366 . . . . 0.0 110.529 -179.824 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 11.6 Cg_endo -54.93 -22.17 29.29 Favored 'Trans proline' 0 C--N 1.347 0.454 0 C-N-CA 122.641 2.227 . . . . 0.0 112.381 179.959 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -78.28 -168.21 1.26 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.31 -0.405 . . . . 0.0 110.81 179.899 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 4.9 mm-40 62.46 -178.24 0.14 Allowed 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.974 179.95 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 17.7 t -124.62 150.68 29.56 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.156 -0.474 . . . . 0.0 111.187 -179.972 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 10.3 t -140.82 -169.04 2.72 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.884 179.909 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 25' ' ' MET . . . . . 0.642 ' CE ' HG11 ' A' ' 53' ' ' VAL . 7.2 ptp -167.34 62.32 0.08 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.936 179.971 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 13.1 mmtt -61.63 166.21 4.4 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.88 -179.994 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 3.3 ttpt 60.4 -169.66 0.15 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.837 179.913 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -95.78 35.79 4.15 Favored Glycine 0 N--CA 1.45 -0.403 0 C-N-CA 120.805 -0.712 . . . . 0.0 112.55 179.927 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 29' ' ' ASP . . . . . 0.639 ' C ' HD13 ' A' ' 30' ' ' ILE . 12.4 p30 -57.79 172.16 0.42 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.713 0.292 . . . . 0.0 110.891 -179.971 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 30' ' ' ILE . . . . . 0.826 HG21 HD22 ' A' ' 8' ' ' LEU . 0.2 OUTLIER -123.13 -172.33 0.73 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.012 -179.862 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.825 ' HB3' HG22 ' A' ' 46' ' ' VAL . 0.0 OUTLIER -149.55 -177.01 5.63 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.815 -179.833 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 32' ' ' THR . . . . . 0.759 ' O ' HD12 ' A' ' 33' ' ' LEU . 15.4 t -104.26 -47.0 4.26 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.072 -179.928 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.759 HD12 ' O ' ' A' ' 32' ' ' THR . 0.2 OUTLIER 66.5 152.78 0.07 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.785 179.924 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 14.8 tp -57.95 -62.29 1.92 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.888 179.958 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 23.5 t-20 -147.05 -76.95 0.18 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.83 179.861 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER 172.86 127.35 0.02 OUTLIER 'General case' 0 N--CA 1.462 0.125 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.942 179.932 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 37' ' ' THR . . . . . 0.553 HG21 ' CH2' ' A' ' 42' ' ' TRP . 3.2 t 179.34 127.11 0.07 Allowed 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.801 179.981 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 38' ' ' ASN . . . . . 0.495 ' HA ' HD21 ' A' ' 61' ' ' LEU . 25.2 m-80 -59.4 -82.35 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.886 179.966 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 2.4 tttp 46.9 -166.71 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.797 0.332 . . . . 0.0 111.204 179.804 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 40' ' ' ASP . . . . . 0.528 ' O ' ' HB3' ' A' ' 41' ' ' TRP . 1.5 t0 -96.41 85.07 3.83 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.88 179.733 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 41' ' ' TRP . . . . . 0.528 ' HB3' ' O ' ' A' ' 40' ' ' ASP . 0.0 OUTLIER 85.39 170.95 0.07 Allowed 'General case' 0 N--CA 1.466 0.367 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.788 -179.806 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 42' ' ' TRP . . . . . 0.553 ' CH2' HG21 ' A' ' 37' ' ' THR . 6.3 t-105 -155.87 141.43 17.8 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.864 -179.93 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 23.3 mttp -58.4 111.6 1.28 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.949 -179.943 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 44' ' ' VAL . . . . . 0.591 HG12 ' CG2' ' A' ' 46' ' ' VAL . 23.1 t -99.1 76.46 0.65 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.189 -0.46 . . . . 0.0 111.12 179.971 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 45' ' ' GLU . . . . . 0.428 ' C ' HG23 ' A' ' 46' ' ' VAL . 3.1 tm-20 -66.28 -58.3 5.66 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.847 179.957 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 46' ' ' VAL . . . . . 0.825 HG22 ' HB3' ' A' ' 31' ' ' LEU . 2.5 t 68.33 30.1 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.029 179.915 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 8.8 m120 63.39 35.1 12.44 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.94 179.959 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 1.2 t70 -179.33 167.21 1.5 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.91 179.844 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 25.3 mmm180 55.42 -165.95 0.11 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.025 179.991 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 5.8 mm-40 -80.61 -74.67 0.3 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.95 -179.965 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 153.73 -22.95 0.72 Allowed Glycine 0 C--N 1.333 0.415 0 C-N-CA 120.846 -0.692 . . . . 0.0 112.592 -179.965 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 42.9 m-85 -55.89 96.35 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 120.817 0.341 . . . . 0.0 111.128 -179.975 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 53' ' ' VAL . . . . . 0.642 HG11 ' CE ' ' A' ' 25' ' ' MET . 12.2 t -150.82 92.88 3.8 Favored Pre-proline 0 C--N 1.328 -0.36 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.046 179.9 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 54' ' ' PRO . . . . . 0.431 ' HD2' ' CE1' ' A' ' 15' ' ' TYR . 51.3 Cg_exo -53.12 87.46 0.03 OUTLIER 'Trans proline' 0 C--N 1.345 0.365 0 C-N-CA 122.617 2.211 . . . . 0.0 112.386 -179.971 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -60.32 -25.39 65.75 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.047 179.928 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 56' ' ' ALA . . . . . 0.54 ' HB3' ' OH ' ' A' ' 13' ' ' TYR . . . 64.48 -78.09 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.19 -179.915 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 57' ' ' TYR . . . . . 0.463 ' O ' HD22 ' A' ' 12' ' ' LEU . 47.2 p90 -161.47 127.68 3.8 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.028 179.955 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 58' ' ' VAL . . . . . 0.829 HG11 ' O ' ' A' ' 10' ' ' LEU . 24.2 t -145.78 126.82 7.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.018 179.853 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 59' ' ' LYS . . . . . 0.729 ' HE2' HD23 ' A' ' 10' ' ' LEU . 8.9 mmtt 60.56 -167.82 0.18 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.756 -179.868 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 20.4 mttt -58.03 -77.34 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.999 -179.972 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 61' ' ' LEU . . . . . 0.495 HD21 ' HA ' ' A' ' 38' ' ' ASN . 14.6 tp 63.1 -78.31 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.024 -179.993 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 15.2 t0 . . . . . 0 C--O 1.249 1.049 0 CA-C-O 118.233 -0.889 . . . . 0.0 110.906 179.985 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.231 0.125 0 CA-C-O 120.81 0.338 . . . . 0.0 110.966 . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -132.49 79.25 1.84 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.879 179.953 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 9' ' ' VAL . . . . . 0.956 HG23 HD11 ' A' ' 31' ' ' LEU . 15.1 m -150.82 44.34 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.218 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.046 179.942 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 10' ' ' LEU . . . . . 0.529 HD13 ' O ' ' A' ' 28' ' ' GLY . 0.8 OUTLIER -51.08 113.94 1.06 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.12 -179.899 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 11' ' ' ALA . . . . . 0.763 ' HB3' ' OD2' ' A' ' 14' ' ' ASP . . . -56.45 94.11 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.185 -0.462 . . . . 0.0 111.03 179.866 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.756 HD13 ' CE1' ' A' ' 57' ' ' TYR . 0.6 OUTLIER -55.0 -24.93 26.62 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.184 -179.958 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -138.17 84.9 2.06 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.398 -0.364 . . . . 0.0 111.069 -179.959 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 14' ' ' ASP . . . . . 0.763 ' OD2' ' HB3' ' A' ' 11' ' ' ALA . 2.1 m-20 -81.35 -160.2 0.32 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.623 179.711 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 15' ' ' TYR . . . . . 0.437 ' CD1' ' HB ' ' A' ' 24' ' ' THR . 0.9 OUTLIER 76.77 -164.8 0.05 Allowed 'General case' 0 N--CA 1.464 0.266 0 CA-C-O 120.76 0.314 . . . . 0.0 111.032 179.745 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 5.3 mt-30 75.6 -67.48 0.24 Allowed 'General case' 0 C--N 1.333 -0.129 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.787 -179.769 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 6.6 tt0 63.1 -78.71 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.014 179.933 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER 58.71 48.1 12.02 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 120.876 0.369 . . . . 0.0 110.975 179.884 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 9.3 t -178.1 149.18 0.68 Allowed Pre-proline 0 C--N 1.329 -0.316 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.895 179.966 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 44.3 Cg_endo -68.28 -34.15 22.19 Favored 'Trans proline' 0 C--N 1.346 0.437 0 C-N-CA 122.646 2.231 . . . . 0.0 112.216 179.999 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 2.7 tpp180 -107.4 66.2 0.66 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.782 -179.978 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 2.1 mt-10 -149.67 -177.13 5.7 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.968 -179.905 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 23' ' ' VAL . . . . . 0.545 HG22 ' HB2' ' A' ' 49' ' ' ARG . 7.4 t -132.48 154.94 40.83 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.02 179.904 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 24' ' ' THR . . . . . 0.437 ' HB ' ' CD1' ' A' ' 15' ' ' TYR . 0.7 OUTLIER -105.6 -77.7 0.58 Allowed 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.217 -179.883 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 25' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER 47.77 -174.34 0.01 OUTLIER 'General case' 0 CA--C 1.53 0.188 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.432 -179.815 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -178.23 104.72 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.299 -0.409 . . . . 0.0 110.894 -179.935 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 9.7 ptpp? 178.84 165.45 0.87 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.828 179.864 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 28' ' ' GLY . . . . . 0.529 ' O ' HD13 ' A' ' 10' ' ' LEU . . . -95.21 23.0 35.46 Favored Glycine 0 N--CA 1.45 -0.417 0 C-N-CA 120.773 -0.727 . . . . 0.0 112.519 179.941 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 10.7 m-20 -72.29 165.15 25.04 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.736 0.303 . . . . 0.0 110.788 179.945 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 30' ' ' ILE . . . . . 0.536 HG22 ' H ' ' A' ' 31' ' ' LEU . 5.4 mm -86.24 167.25 1.83 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.078 180.0 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.956 HD11 HG23 ' A' ' 9' ' ' VAL . 0.0 OUTLIER -153.11 166.44 32.46 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.78 -179.719 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 32' ' ' THR . . . . . 0.43 HG22 ' N ' ' A' ' 33' ' ' LEU . 76.5 m -103.71 160.14 15.02 Favored 'General case' 0 N--CA 1.462 0.13 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.043 -179.97 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.574 HD21 HG21 ' A' ' 9' ' ' VAL . 5.0 mt -122.93 -169.83 1.99 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.938 -179.94 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 27.9 tp -161.51 86.33 0.66 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.831 179.976 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 3.3 m120 61.62 81.83 0.18 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.82 179.929 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 13.2 p -125.24 -79.24 0.61 Allowed 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.961 179.966 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 51.9 m 62.39 145.1 0.02 OUTLIER 'General case' 0 C--N 1.333 -0.152 0 CA-C-N 116.231 -0.441 . . . . 0.0 111.078 179.993 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 38' ' ' ASN . . . . . 0.403 ' ND2' ' C ' ' A' ' 38' ' ' ASN . 0.0 OUTLIER 56.69 168.77 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.054 179.894 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 5.1 mmtm 59.0 -111.78 0.57 Allowed 'General case' 0 CA--C 1.534 0.335 0 CA-C-N 116.086 -0.507 . . . . 0.0 110.898 179.994 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 59.9 t0 -178.46 -68.6 0.01 OUTLIER 'General case' 0 C--O 1.231 0.085 0 CA-C-O 120.829 0.347 . . . . 0.0 110.867 179.99 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 41' ' ' TRP . . . . . . . . . . . . . 43.0 p90 -73.99 125.41 28.2 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.867 -179.974 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 42' ' ' TRP . . . . . 0.404 ' CE3' ' HA ' ' A' ' 42' ' ' TRP . 4.8 m95 -167.59 81.18 0.19 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.911 -179.951 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 7.9 mtpp 58.29 91.01 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.027 179.968 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 44' ' ' VAL . . . . . 0.807 HG13 HD23 ' A' ' 31' ' ' LEU . 18.8 t -89.73 139.65 17.15 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.111 179.937 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 1.3 pt-20 -160.54 137.63 9.15 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.889 179.943 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 46' ' ' VAL . . . . . 0.489 HG13 ' N ' ' A' ' 47' ' ' ASN . 12.4 p -156.43 -45.61 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.32 -0.4 . . . . 0.0 111.156 -179.919 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 47' ' ' ASN . . . . . 0.489 ' N ' HG13 ' A' ' 46' ' ' VAL . 2.1 t-20 -178.09 37.91 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.91 -179.923 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 46.2 m-20 -136.12 -70.04 0.48 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.951 179.986 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 49' ' ' ARG . . . . . 0.545 ' HB2' HG22 ' A' ' 23' ' ' VAL . 31.6 mtp85 -157.64 -177.63 6.73 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.838 179.931 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 10.5 mm-40 -112.38 140.32 47.2 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.931 179.997 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 136.82 153.69 6.52 Favored Glycine 0 C--N 1.332 0.338 0 C-N-CA 120.956 -0.64 . . . . 0.0 112.497 179.956 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 13.0 p90 -59.36 158.98 8.5 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.768 0.318 . . . . 0.0 110.998 -179.971 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 53' ' ' VAL . . . . . 0.658 ' HB ' HG21 ' A' ' 44' ' ' VAL . 22.0 t -147.97 139.31 13.66 Favored Pre-proline 0 C--N 1.328 -0.33 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.151 -179.844 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 50.8 Cg_exo -53.41 101.35 0.06 OUTLIER 'Trans proline' 0 C--N 1.347 0.481 0 C-N-CA 122.535 2.157 . . . . 0.0 112.191 179.944 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -55.84 -41.8 74.83 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.112 -0.494 . . . . 0.0 111.101 179.998 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 56' ' ' ALA . . . . . 0.413 ' O ' ' CD2' ' A' ' 57' ' ' TYR . . . 52.19 53.21 12.83 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.18 -0.463 . . . . 0.0 111.131 179.981 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 57' ' ' TYR . . . . . 0.756 ' CE1' HD13 ' A' ' 12' ' ' LEU . 0.0 OUTLIER 63.16 119.65 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.611 -179.814 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 58' ' ' VAL . . . . . 0.708 ' HA ' HD12 ' A' ' 12' ' ' LEU . 0.5 OUTLIER -131.07 -168.54 0.58 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.826 -179.758 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 59' ' ' LYS . . . . . 0.638 ' N ' HG13 ' A' ' 58' ' ' VAL . 0.0 OUTLIER -49.85 -77.14 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.791 0.329 . . . . 0.0 111.13 -179.93 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -177.72 -71.32 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.352 -0.385 . . . . 0.0 110.905 179.979 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 61' ' ' LEU . . . . . 0.503 HD22 HG11 ' A' ' 9' ' ' VAL . 7.0 tp 61.58 99.77 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.803 179.987 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 8.1 p-10 . . . . . 0 C--O 1.25 1.08 0 CA-C-O 118.212 -0.899 . . . . 0.0 110.931 -179.988 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 18.2 tt0 . . . . . 0 C--O 1.231 0.096 0 CA-C-O 120.805 0.336 . . . . 0.0 110.833 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -133.14 -68.46 0.59 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.825 179.865 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 9' ' ' VAL . . . . . 0.713 HG22 ' HE3' ' A' ' 59' ' ' LYS . 5.1 t 63.64 134.25 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.236 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.111 179.796 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 10' ' ' LEU . . . . . 0.641 ' N ' HD23 ' A' ' 10' ' ' LEU . 0.2 OUTLIER -130.04 144.88 51.58 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.737 179.853 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 11' ' ' ALA . . . . . 0.736 ' HB1' ' CE1' ' A' ' 13' ' ' TYR . . . -62.92 80.74 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.422 -179.832 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.721 ' H ' HG23 ' A' ' 58' ' ' VAL . 2.1 mt -103.25 32.05 3.97 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.789 179.942 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 13' ' ' TYR . . . . . 0.736 ' CE1' ' HB1' ' A' ' 11' ' ' ALA . 0.0 OUTLIER -86.46 -60.04 2.11 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.384 -0.371 . . . . 0.0 110.43 179.522 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 14' ' ' ASP . . . . . 0.445 ' HA ' ' HA ' ' A' ' 26' ' ' LYS . 58.6 t0 50.21 89.3 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.177 179.798 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 15' ' ' TYR . . . . . 0.662 ' CB ' HG21 ' A' ' 24' ' ' THR . 0.5 OUTLIER -129.34 -78.62 0.56 Allowed 'General case' 0 C--N 1.332 -0.155 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.095 179.787 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 16' ' ' GLN . . . . . 0.415 ' CB ' ' O ' ' A' ' 15' ' ' TYR . 0.0 OUTLIER 164.09 177.58 0.02 OUTLIER 'General case' 0 N--CA 1.465 0.301 0 CA-C-O 120.817 0.342 . . . . 0.0 110.795 179.979 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 57.1 mt-10 -116.02 -29.68 6.25 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.111 179.907 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -72.05 -25.07 61.65 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.235 -179.755 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -54.38 142.68 49.18 Favored Pre-proline 0 C--N 1.33 -0.253 0 CA-C-N 116.453 -0.34 . . . . 0.0 111.13 -179.909 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 80.7 Cg_endo -77.62 57.52 6.02 Favored 'Trans proline' 0 C--N 1.347 0.472 0 C-N-CA 122.653 2.235 . . . . 0.0 112.327 -179.971 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -116.64 -64.78 1.26 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.781 -179.922 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -176.37 -68.03 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.953 179.953 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 23' ' ' VAL . . . . . 0.75 HG11 ' HB3' ' A' ' 49' ' ' ARG . 0.9 OUTLIER -150.21 -68.36 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.201 179.99 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 24' ' ' THR . . . . . 0.662 HG21 ' CB ' ' A' ' 15' ' ' TYR . 0.3 OUTLIER 56.79 178.95 0.04 OUTLIER 'General case' 0 C--O 1.232 0.151 0 CA-C-N 116.11 -0.495 . . . . 0.0 111.062 -179.852 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 25' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -178.87 -173.57 0.31 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.856 -179.803 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 26' ' ' LYS . . . . . 0.445 ' HA ' ' HA ' ' A' ' 14' ' ' ASP . 0.0 OUTLIER -138.25 -173.05 3.42 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.007 179.946 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 5.1 ttpm? 63.43 120.66 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.015 -0.539 . . . . 0.0 111.002 179.901 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -58.82 -86.13 0.03 OUTLIER Glycine 0 N--CA 1.452 -0.242 0 C-N-CA 120.701 -0.761 . . . . 0.0 112.437 179.816 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 2.1 t0 49.05 28.58 2.11 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.806 0.336 . . . . 0.0 111.129 179.935 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 30' ' ' ILE . . . . . 0.577 HG22 ' H ' ' A' ' 31' ' ' LEU . 4.6 mm 58.98 168.42 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.091 -179.975 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.899 ' HB2' HG22 ' A' ' 46' ' ' VAL . 0.0 OUTLIER -157.15 -175.75 5.59 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.755 -179.635 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 32' ' ' THR . . . . . 0.67 ' N ' HD22 ' A' ' 31' ' ' LEU . 86.7 m -126.27 161.72 27.11 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.976 179.941 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.508 ' CD2' HD21 ' A' ' 31' ' ' LEU . 2.3 mt -129.28 -170.11 2.22 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.2 -0.454 . . . . 0.0 111.011 -179.911 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.55 ' O ' HD23 ' A' ' 34' ' ' LEU . 9.3 tt -176.2 92.48 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.955 179.984 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 1.7 t30 61.27 89.8 0.07 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.891 -179.962 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 10.7 t -169.53 119.74 0.67 Allowed 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.861 179.965 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -122.94 170.36 10.2 Favored 'General case' 0 N--CA 1.462 0.129 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.827 -179.969 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 8.3 m-80 64.09 -79.09 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.979 179.984 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -73.71 170.33 15.47 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.856 179.938 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 40' ' ' ASP . . . . . 0.458 ' HB2' HG11 ' A' ' 58' ' ' VAL . 11.2 p30 -132.47 39.02 3.41 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.905 -179.99 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 41' ' ' TRP . . . . . 0.42 ' CD1' ' HA ' ' A' ' 56' ' ' ALA . 41.9 p-90 -159.3 31.65 0.2 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.0 -0.546 . . . . 0.0 110.684 179.942 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 42' ' ' TRP . . . . . . . . . . . . . 21.8 m95 -71.36 -47.76 54.38 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.086 -0.506 . . . . 0.0 111.138 -179.806 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 1.7 ttpm? -167.05 90.4 0.37 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.458 -0.337 . . . . 0.0 111.275 -179.852 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 44' ' ' VAL . . . . . 0.792 HG13 HD23 ' A' ' 31' ' ' LEU . 23.3 t -98.82 136.32 30.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.295 -0.412 . . . . 0.0 110.78 179.444 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 45' ' ' GLU . . . . . 0.425 ' C ' HG23 ' A' ' 46' ' ' VAL . 0.3 OUTLIER -110.89 -67.53 0.99 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.092 -179.651 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 46' ' ' VAL . . . . . 0.899 HG22 ' HB2' ' A' ' 31' ' ' LEU . 4.1 t 74.41 75.86 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 116.361 -0.381 . . . . 0.0 111.077 -179.817 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 36.6 m-20 68.6 -67.6 0.2 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.952 -179.99 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 1.2 t0 -121.9 -164.58 1.17 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.805 179.982 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 49' ' ' ARG . . . . . 0.75 ' HB3' HG11 ' A' ' 23' ' ' VAL . 0.2 OUTLIER 67.47 140.11 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.35 -0.386 . . . . 0.0 110.837 -179.993 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -69.3 -169.25 0.19 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.947 -179.967 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -80.44 -158.45 17.89 Favored Glycine 0 C--N 1.334 0.429 0 C-N-CA 120.95 -0.643 . . . . 0.0 112.425 -179.942 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 2.2 m-85 59.74 108.88 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.83 0.348 . . . . 0.0 110.821 -179.978 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 53' ' ' VAL . . . . . 0.774 HG21 ' HB ' ' A' ' 44' ' ' VAL . 62.8 t -143.12 100.84 5.31 Favored Pre-proline 0 C--N 1.328 -0.327 0 CA-C-N 116.266 -0.425 . . . . 0.0 111.196 -179.821 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 54' ' ' PRO . . . . . 0.595 ' O ' ' HB3' ' A' ' 55' ' ' ALA . 31.1 Cg_exo -59.47 -148.85 0.01 OUTLIER 'Trans proline' 0 C--N 1.347 0.467 0 C-N-CA 122.977 2.451 . . . . 0.0 111.966 179.931 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 55' ' ' ALA . . . . . 0.595 ' HB3' ' O ' ' A' ' 54' ' ' PRO . . . 81.06 -39.02 0.14 Allowed 'General case' 0 C--O 1.232 0.155 0 CA-C-O 120.818 0.342 . . . . 0.0 110.651 -179.299 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 56' ' ' ALA . . . . . 0.437 ' HB3' ' O ' ' A' ' 55' ' ' ALA . . . 68.52 -75.31 0.07 Allowed 'General case' 0 N--CA 1.453 -0.28 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.152 179.674 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 57' ' ' TYR . . . . . 0.437 ' HE1' ' HB1' ' A' ' 55' ' ' ALA . 0.1 OUTLIER -54.08 160.89 1.4 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.893 179.91 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 58' ' ' VAL . . . . . 0.721 HG23 ' H ' ' A' ' 12' ' ' LEU . 6.6 p -179.89 -47.92 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.025 179.925 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 59' ' ' LYS . . . . . 0.713 ' HE3' HG22 ' A' ' 9' ' ' VAL . 0.0 OUTLIER -179.58 178.22 0.67 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.474 -0.33 . . . . 0.0 110.826 179.459 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 7.4 ttpp -125.67 91.93 3.5 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.868 179.953 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 61' ' ' LEU . . . . . 0.409 HD23 HG22 ' A' ' 9' ' ' VAL . 0.2 OUTLIER -61.12 97.1 0.06 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.848 179.984 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 30.0 t0 . . . . . 0 C--O 1.248 1.023 0 CA-C-O 118.215 -0.898 . . . . 0.0 110.932 179.947 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 7' ' ' GLU . . . . . 0.621 ' C ' HG21 ' A' ' 30' ' ' ILE . 0.1 OUTLIER . . . . . 0 C--O 1.232 0.176 0 CA-C-O 120.765 0.317 . . . . 0.0 110.903 . . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.886 ' O ' HG22 ' A' ' 9' ' ' VAL . 1.6 mt -149.34 -166.07 2.45 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.919 -179.859 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 9' ' ' VAL . . . . . 0.886 HG22 ' O ' ' A' ' 8' ' ' LEU . 1.0 OUTLIER 76.59 33.29 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.466 0.35 0 CA-C-N 115.982 -0.554 . . . . 0.0 111.441 -179.837 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 10' ' ' LEU . . . . . 0.587 ' H ' HD23 ' A' ' 10' ' ' LEU . 0.4 OUTLIER -44.99 111.59 0.34 Allowed 'General case' 0 N--CA 1.463 0.181 0 CA-C-N 115.962 -0.563 . . . . 0.0 111.2 179.69 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 11' ' ' ALA . . . . . 0.852 ' HB1' ' HB2' ' A' ' 55' ' ' ALA . . . -53.11 98.94 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 116.037 -0.529 . . . . 0.0 111.191 -179.931 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.775 HD13 ' CZ ' ' A' ' 57' ' ' TYR . 0.5 OUTLIER -52.04 157.54 1.28 Allowed 'General case' 0 C--O 1.231 0.129 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.854 -179.938 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 1.2 m-85 67.95 -70.71 0.12 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.778 -179.809 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 14' ' ' ASP . . . . . 0.446 ' HB3' ' HA ' ' A' ' 26' ' ' LYS . 0.8 OUTLIER 56.8 104.42 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.915 -179.991 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 0.7 OUTLIER -96.08 -175.68 3.46 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.148 -179.698 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 16.6 pt20 -122.43 177.75 5.26 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.792 179.921 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 17' ' ' GLU . . . . . 0.509 ' HG2' ' HA ' ' A' ' 23' ' ' VAL . 0.3 OUTLIER 179.06 156.24 0.49 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.958 -179.898 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -85.79 -38.65 17.96 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.957 179.999 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 19' ' ' SER . . . . . 0.408 ' N ' ' HD2' ' A' ' 20' ' ' PRO . 2.0 t -178.1 -61.78 0.0 OUTLIER Pre-proline 0 C--N 1.328 -0.328 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.918 179.981 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 20' ' ' PRO . . . . . 0.408 ' HD2' ' N ' ' A' ' 19' ' ' SER . 42.8 Cg_endo -67.6 176.37 5.1 Favored 'Trans proline' 0 C--N 1.346 0.428 0 C-N-CA 122.545 2.163 . . . . 0.0 112.29 179.984 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 21.9 mmm180 60.22 34.63 21.0 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.899 -179.968 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 22' ' ' GLU . . . . . 0.405 ' OE1' ' CE1' ' A' ' 52' ' ' PHE . 27.9 mm-40 63.48 124.48 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.886 -179.994 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 23' ' ' VAL . . . . . 0.719 HG11 ' HB3' ' A' ' 49' ' ' ARG . 31.5 m -58.45 179.81 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.049 179.975 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 24' ' ' THR . . . . . 0.518 HG23 ' HD2' ' A' ' 54' ' ' PRO . 0.2 OUTLIER -171.35 -165.93 0.43 Allowed 'General case' 0 N--CA 1.463 0.217 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.502 179.906 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 25' ' ' MET . . . . . 0.426 ' H ' HG22 ' A' ' 24' ' ' THR . 0.1 OUTLIER -177.3 117.16 0.1 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.422 -0.354 . . . . 0.0 110.878 179.878 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 26' ' ' LYS . . . . . 0.446 ' HA ' ' HB3' ' A' ' 14' ' ' ASP . 0.0 OUTLIER -58.84 -166.12 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.989 -179.83 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 22.6 mmtt 64.44 151.25 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.842 179.934 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -94.13 40.77 2.69 Favored Glycine 0 N--CA 1.451 -0.354 0 C-N-CA 120.772 -0.728 . . . . 0.0 112.504 -179.925 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 2.9 t0 -58.27 -176.98 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.691 0.281 . . . . 0.0 110.725 179.843 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 30' ' ' ILE . . . . . 0.621 HG21 ' C ' ' A' ' 7' ' ' GLU . 0.6 OUTLIER -103.9 -179.45 0.64 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-O 120.774 0.321 . . . . 0.0 111.026 179.97 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.75 HD12 ' N ' ' A' ' 31' ' ' LEU . 0.0 OUTLIER -150.68 -157.94 0.86 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.768 -179.376 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 32' ' ' THR . . . . . 0.573 HG23 ' N ' ' A' ' 33' ' ' LEU . 9.8 t -131.84 -53.99 0.99 Allowed 'General case' 0 N--CA 1.462 0.133 0 CA-C-O 120.765 0.317 . . . . 0.0 111.526 -179.696 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 1.018 HD11 HG12 ' A' ' 44' ' ' VAL . 1.9 mm? 62.34 138.09 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.931 0.396 . . . . 0.0 111.179 -179.985 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.567 HD12 ' OE2' ' A' ' 45' ' ' GLU . 6.8 mp -68.35 -74.2 0.13 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.868 179.947 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 7.9 p30 -154.98 31.18 0.4 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.854 179.953 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 3.3 m -70.65 139.44 51.3 Favored 'General case' 0 C--N 1.333 -0.144 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.822 -179.979 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 35.0 m -161.88 69.24 0.29 Allowed 'General case' 0 C--N 1.332 -0.158 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.844 179.968 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 2.3 m120 -158.49 -175.23 5.2 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.93 -179.898 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 1.2 pttt -69.14 -171.18 0.3 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.904 -179.98 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 3.1 p30 46.68 -175.55 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.235 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.672 -179.922 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 41' ' ' TRP . . . . . 0.463 ' CG ' ' N ' ' A' ' 42' ' ' TRP . 0.0 OUTLIER -69.01 -171.67 0.33 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.082 -0.508 . . . . 0.0 111.068 -179.698 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 42' ' ' TRP . . . . . 0.463 ' N ' ' CG ' ' A' ' 41' ' ' TRP . 5.4 m95 -166.67 154.25 9.58 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.938 179.955 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 7.9 tttp -63.67 113.25 3.24 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.965 179.994 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 44' ' ' VAL . . . . . 1.018 HG12 HD11 ' A' ' 33' ' ' LEU . 16.4 m -103.27 -174.7 0.42 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.088 179.789 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 45' ' ' GLU . . . . . 0.567 ' OE2' HD12 ' A' ' 34' ' ' LEU . 12.5 pt-20 -175.79 93.26 0.06 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.914 0.388 . . . . 0.0 110.928 179.857 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 46' ' ' VAL . . . . . 0.483 HG13 ' N ' ' A' ' 47' ' ' ASN . 11.2 p -131.98 -44.9 0.65 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.12 179.931 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 47' ' ' ASN . . . . . 0.483 ' N ' HG13 ' A' ' 46' ' ' VAL . 10.9 p-10 -107.87 -172.15 2.01 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.784 179.985 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 59.7 m-20 -57.07 -75.73 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.899 179.976 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 49' ' ' ARG . . . . . 0.719 ' HB3' HG11 ' A' ' 23' ' ' VAL . 0.7 OUTLIER -80.28 108.52 13.96 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.775 179.93 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 1.5 pp0? -158.49 -178.17 7.07 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.977 179.989 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 132.82 -7.06 5.19 Favored Glycine 0 CA--C 1.519 0.339 0 C-N-CA 120.935 -0.65 . . . . 0.0 112.754 -179.939 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 52' ' ' PHE . . . . . 0.405 ' CE1' ' OE1' ' A' ' 22' ' ' GLU . 58.9 m-85 -136.25 -80.85 0.4 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.662 0.267 . . . . 0.0 110.719 179.965 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 53' ' ' VAL . . . . . 0.607 HG21 HG21 ' A' ' 44' ' ' VAL . 30.2 t 50.34 97.66 0.04 OUTLIER Pre-proline 0 C--N 1.332 -0.187 0 CA-C-N 116.414 -0.357 . . . . 0.0 111.497 179.725 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 54' ' ' PRO . . . . . 0.518 ' HD2' HG23 ' A' ' 24' ' ' THR . 84.8 Cg_exo -47.17 -59.93 1.07 Allowed 'Trans proline' 0 C--N 1.347 0.481 0 C-N-CA 122.615 2.21 . . . . 0.0 112.48 179.958 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 55' ' ' ALA . . . . . 0.852 ' HB2' ' HB1' ' A' ' 11' ' ' ALA . . . 63.12 17.03 9.85 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.543 -179.986 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . 54.26 -88.85 0.02 OUTLIER 'General case' 0 CA--C 1.531 0.222 0 CA-C-N 116.577 -0.283 . . . . 0.0 111.423 179.949 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 57' ' ' TYR . . . . . 0.775 ' CZ ' HD13 ' A' ' 12' ' ' LEU . 25.1 p90 -124.2 -23.5 4.52 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.651 -0.25 . . . . 0.0 111.504 -179.811 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 58' ' ' VAL . . . . . 0.714 HG12 ' O ' ' A' ' 57' ' ' TYR . 9.9 p 52.82 162.86 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.464 0.274 0 CA-C-O 121.04 0.448 . . . . 0.0 111.724 -179.912 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 59' ' ' LYS . . . . . 0.616 ' HD2' HD11 ' A' ' 12' ' ' LEU . 6.4 mmmt -73.01 -48.62 34.78 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.835 -179.772 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 61.17 105.17 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.882 179.994 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 61' ' ' LEU . . . . . 0.553 HD13 ' N ' ' A' ' 62' ' ' ASP . 0.2 OUTLIER -157.51 135.81 11.12 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.882 179.99 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 62' ' ' ASP . . . . . 0.553 ' N ' HD13 ' A' ' 61' ' ' LEU . 3.0 m-20 . . . . . 0 C--O 1.249 1.052 0 CA-C-O 118.309 -0.853 . . . . 0.0 110.883 179.957 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 2.3 pt-20 . . . . . 0 C--O 1.231 0.097 0 CA-C-O 120.854 0.359 . . . . 0.0 110.885 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.672 ' O ' HD12 ' A' ' 8' ' ' LEU . 1.2 pp 175.25 61.62 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.152 -0.477 . . . . 0.0 110.731 179.899 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 9' ' ' VAL . . . . . 0.486 HG12 ' N ' ' A' ' 10' ' ' LEU . 11.6 t 70.89 161.07 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.015 -179.871 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 10' ' ' LEU . . . . . 0.529 HD11 ' CD ' ' A' ' 59' ' ' LYS . 0.0 OUTLIER -144.49 -164.52 1.93 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.145 179.418 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 11' ' ' ALA . . . . . 0.639 ' C ' HD22 ' A' ' 12' ' ' LEU . . . -137.44 15.37 2.97 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.181 179.643 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.995 HD23 ' HB3' ' A' ' 56' ' ' ALA . 1.0 OUTLIER 65.65 -67.02 0.14 Allowed 'General case' 0 C--O 1.231 0.117 0 CA-C-O 120.953 0.406 . . . . 0.0 110.535 -179.756 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 13' ' ' TYR . . . . . 0.547 ' O ' ' HB1' ' A' ' 55' ' ' ALA . 6.6 p90 -156.02 170.24 22.6 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.967 -0.56 . . . . 0.0 110.398 179.609 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 14' ' ' ASP . . . . . 0.438 ' HB3' ' HA ' ' A' ' 26' ' ' LYS . 4.9 p-10 -46.53 159.67 0.09 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.379 -0.373 . . . . 0.0 111.081 179.729 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 15' ' ' TYR . . . . . 0.414 ' CE2' ' HD2' ' A' ' 54' ' ' PRO . 10.7 t80 -115.24 -35.99 4.5 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.387 -0.37 . . . . 0.0 111.151 -179.906 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER 64.99 143.62 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.773 -179.925 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 7.4 pt-20 -59.39 112.09 1.62 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.857 -179.975 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 11.0 mtpp -140.87 -78.76 0.28 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.916 179.973 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 19' ' ' SER . . . . . 0.416 ' CB ' ' CD ' ' A' ' 20' ' ' PRO . 0.0 OUTLIER -75.12 -61.58 0.98 Allowed Pre-proline 0 C--N 1.33 -0.249 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.041 -179.866 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 20' ' ' PRO . . . . . 0.416 ' CD ' ' CB ' ' A' ' 19' ' ' SER . 55.3 Cg_endo -70.01 173.86 10.58 Favored 'Trans proline' 0 C--N 1.347 0.46 0 C-N-CA 122.552 2.168 . . . . 0.0 112.23 -179.941 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -60.48 -53.74 53.86 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.897 179.962 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 69.9 mm-40 -157.8 140.47 14.77 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.996 179.952 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 23' ' ' VAL . . . . . 0.456 HG12 ' HG3' ' A' ' 25' ' ' MET . 26.5 t -153.27 -48.51 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.002 179.911 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 99.1 m 63.27 -80.13 0.03 OUTLIER 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.007 -0.542 . . . . 0.0 111.072 179.91 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 25' ' ' MET . . . . . 0.751 ' SD ' HG21 ' A' ' 46' ' ' VAL . 0.2 OUTLIER 62.16 149.83 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.882 179.968 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 26' ' ' LYS . . . . . 0.438 ' HA ' ' HB3' ' A' ' 14' ' ' ASP . 0.0 OUTLIER -140.32 104.19 4.74 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.956 -179.943 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 4.0 mtpp 61.69 151.76 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.883 -179.945 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -62.76 -83.41 0.07 OUTLIER Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 120.597 -0.811 . . . . 0.0 112.359 179.851 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 29' ' ' ASP . . . . . 0.935 ' O ' HD13 ' A' ' 30' ' ' ILE . 30.1 m-20 52.19 -90.49 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.467 0.175 . . . . 0.0 111.1 -179.967 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 30' ' ' ILE . . . . . 0.935 HD13 ' O ' ' A' ' 29' ' ' ASP . 0.2 OUTLIER -147.1 -173.02 0.36 Allowed 'Isoleucine or valine' 0 C--O 1.232 0.143 0 CA-C-O 120.832 0.349 . . . . 0.0 110.892 179.896 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.918 HD22 HG21 ' A' ' 44' ' ' VAL . 0.1 OUTLIER -163.65 -98.13 0.02 OUTLIER 'General case' 0 CA--C 1.534 0.33 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.27 179.736 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 32' ' ' THR . . . . . 0.63 HG22 ' N ' ' A' ' 33' ' ' LEU . 20.8 m -168.53 -95.75 0.01 OUTLIER 'General case' 0 CA--C 1.53 0.185 0 N-CA-C 110.495 -0.187 . . . . 0.0 110.495 179.182 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.63 ' N ' HG22 ' A' ' 32' ' ' THR . 0.4 OUTLIER 160.35 -66.1 0.0 OUTLIER 'General case' 0 N--CA 1.463 0.211 0 CA-C-O 120.872 0.368 . . . . 0.0 110.663 179.99 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.667 HD13 ' HG2' ' A' ' 45' ' ' GLU . 1.6 mp 63.91 -169.5 0.19 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.816 -179.836 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 4.1 m120 -57.06 125.96 25.05 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.005 -179.936 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 4.3 m -161.75 -44.55 0.04 OUTLIER 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.868 -179.909 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 10.2 p 55.98 31.4 17.88 Favored 'General case' 0 N--CA 1.463 0.2 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.962 -179.937 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 5.8 m-80 -177.65 -174.25 0.45 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.843 -179.954 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -114.23 86.04 2.34 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.853 179.951 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 40' ' ' ASP . . . . . 0.459 ' O ' ' N ' ' A' ' 42' ' ' TRP . 36.1 t70 -177.39 58.57 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.866 179.911 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 41' ' ' TRP . . . . . 0.427 ' CD1' ' N ' ' A' ' 41' ' ' TRP . 0.0 OUTLIER 43.85 -89.0 0.01 OUTLIER 'General case' 0 N--CA 1.467 0.386 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.521 179.894 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 42' ' ' TRP . . . . . 0.459 ' N ' ' O ' ' A' ' 40' ' ' ASP . 0.0 OUTLIER 67.76 -73.01 0.09 Allowed 'General case' 0 C--N 1.333 -0.151 0 CA-C-O 120.695 0.283 . . . . 0.0 110.919 179.952 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 4.1 ttpt -138.47 61.98 1.57 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.878 0.37 . . . . 0.0 111.02 -179.903 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 44' ' ' VAL . . . . . 0.983 HG13 HG22 ' A' ' 53' ' ' VAL . 1.5 p -100.41 139.22 22.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.703 179.768 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 45' ' ' GLU . . . . . 0.667 ' HG2' HD13 ' A' ' 34' ' ' LEU . 7.7 pt-20 -119.06 166.39 12.95 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.916 179.953 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 46' ' ' VAL . . . . . 0.904 HG22 ' HB3' ' A' ' 31' ' ' LEU . 16.1 t -129.18 84.78 0.84 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.292 -179.876 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER 58.9 107.57 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.975 179.885 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 6.3 p-10 43.38 73.47 0.14 Allowed 'General case' 0 N--CA 1.463 0.222 0 CA-C-N 116.065 -0.516 . . . . 0.0 111.514 179.891 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 12.9 mmm180 -146.42 -177.63 5.73 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.855 179.973 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 1.2 tp-100 -85.54 -69.23 0.67 Allowed 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.076 179.983 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 162.68 -175.79 39.04 Favored Glycine 0 C--N 1.333 0.412 0 C-N-CA 120.869 -0.681 . . . . 0.0 112.521 -179.975 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 52' ' ' PHE . . . . . 0.404 ' CD2' ' O ' ' A' ' 42' ' ' TRP . 0.7 OUTLIER 57.99 105.64 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.79 0.328 . . . . 0.0 110.943 179.997 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 53' ' ' VAL . . . . . 0.983 HG22 HG13 ' A' ' 44' ' ' VAL . 17.0 m -135.4 65.8 63.68 Favored Pre-proline 0 CA--C 1.532 0.275 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.313 179.84 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 54' ' ' PRO . . . . . 0.414 ' HD2' ' CE2' ' A' ' 15' ' ' TYR . 3.2 Cg_exo -74.75 52.99 3.1 Favored 'Trans proline' 0 C--N 1.346 0.432 0 C-N-CA 122.887 2.392 . . . . 0.0 112.048 179.9 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 55' ' ' ALA . . . . . 0.592 ' HB3' ' O ' ' A' ' 11' ' ' ALA . . . -59.96 -30.24 68.96 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 121.017 0.437 . . . . 0.0 110.825 179.8 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 56' ' ' ALA . . . . . 0.995 ' HB3' HD23 ' A' ' 12' ' ' LEU . . . -179.12 -163.04 0.05 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.9 -0.591 . . . . 0.0 111.018 179.999 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 57' ' ' TYR . . . . . 0.449 ' CD2' ' N ' ' A' ' 58' ' ' VAL . 48.3 p90 -59.12 -49.37 78.13 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.365 -179.737 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 58' ' ' VAL . . . . . 0.676 ' N ' HD21 ' A' ' 12' ' ' LEU . 8.5 t 72.24 155.63 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-O 120.894 0.378 . . . . 0.0 110.774 -179.673 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 59' ' ' LYS . . . . . 0.529 ' CD ' HD11 ' A' ' 10' ' ' LEU . 7.7 ptmt -57.63 176.57 0.13 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.98 -179.902 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 13.2 mmtm -110.86 -34.97 6.09 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.829 179.926 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 58.6 tp 63.29 -78.3 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.085 179.958 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 34.7 m-20 . . . . . 0 C--O 1.249 1.062 0 CA-C-O 118.205 -0.902 . . . . 0.0 110.9 -179.973 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.528 0.119 0 CA-C-O 120.702 0.287 . . . . 0.0 110.827 . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.759 ' O ' HG13 ' A' ' 9' ' ' VAL . 2.0 tp 179.95 -73.8 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.396 -0.365 . . . . 0.0 110.93 -179.927 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 9' ' ' VAL . . . . . 0.759 HG13 ' O ' ' A' ' 8' ' ' LEU . 0.0 OUTLIER 179.44 123.63 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.463 0.209 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.104 -179.95 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 10' ' ' LEU . . . . . 0.571 ' N ' HD23 ' A' ' 10' ' ' LEU . 0.1 OUTLIER -126.11 142.82 51.37 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.73 179.678 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 11' ' ' ALA . . . . . 0.677 ' HB3' ' HA2' ' A' ' 28' ' ' GLY . . . -52.07 -25.76 9.41 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.308 -0.405 . . . . 0.0 111.065 179.886 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.629 HD23 ' HA ' ' A' ' 58' ' ' VAL . 0.7 OUTLIER 67.8 -69.64 0.14 Allowed 'General case' 0 N--CA 1.461 0.115 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.868 179.914 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 13' ' ' TYR . . . . . 0.4 ' CD1' ' OH ' ' A' ' 57' ' ' TYR . 0.2 OUTLIER -73.34 -72.06 0.28 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.846 179.84 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 14' ' ' ASP . . . . . 0.434 ' O ' ' HG2' ' A' ' 25' ' ' MET . 2.2 p30 167.11 -60.39 0.0 OUTLIER 'General case' 0 N--CA 1.463 0.211 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.976 179.949 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 15' ' ' TYR . . . . . 0.469 ' CG ' ' HA ' ' A' ' 24' ' ' THR . 38.7 p90 -176.67 -163.54 0.1 Allowed 'General case' 0 N--CA 1.463 0.195 0 CA-C-O 120.856 0.36 . . . . 0.0 110.806 -179.779 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 16' ' ' GLN . . . . . 0.51 ' NE2' ' CG ' ' A' ' 54' ' ' PRO . 2.5 pt20 -138.21 -47.47 0.53 Allowed 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.926 179.768 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 17' ' ' GLU . . . . . 0.433 ' HB2' ' CE2' ' A' ' 15' ' ' TYR . 2.9 tm-20 51.53 29.12 5.11 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.038 -179.883 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 15.4 tptp -110.97 -48.28 3.13 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.943 179.963 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -57.89 164.72 3.01 Favored Pre-proline 0 C--N 1.329 -0.302 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.77 179.935 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 20' ' ' PRO . . . . . 0.429 ' HG2' ' CZ ' ' A' ' 52' ' ' PHE . 18.6 Cg_endo -60.09 -176.42 0.13 Allowed 'Trans proline' 0 C--N 1.345 0.354 0 C-N-CA 122.627 2.218 . . . . 0.0 112.332 179.942 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 5.2 mmm180 61.85 -91.68 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.818 -179.837 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 1.3 mt-10 166.34 175.01 0.03 OUTLIER 'General case' 0 N--CA 1.463 0.198 0 CA-C-O 120.941 0.401 . . . . 0.0 110.905 179.881 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 23' ' ' VAL . . . . . 0.692 HG22 ' N ' ' A' ' 24' ' ' THR . 1.1 p -178.28 -92.46 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.535 0.403 0 CA-C-N 116.013 -0.54 . . . . 0.0 110.666 179.61 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 24' ' ' THR . . . . . 0.692 ' N ' HG22 ' A' ' 23' ' ' VAL . 2.1 t 39.59 81.83 0.02 OUTLIER 'General case' 0 N--CA 1.466 0.355 0 N-CA-C 111.929 0.344 . . . . 0.0 111.929 179.568 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 25' ' ' MET . . . . . 0.434 ' HG2' ' O ' ' A' ' 14' ' ' ASP . 0.0 OUTLIER -97.86 -25.98 14.84 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.413 -0.358 . . . . 0.0 111.377 -179.987 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 26' ' ' LYS . . . . . 0.417 ' H ' ' HB3' ' A' ' 15' ' ' TYR . 0.1 OUTLIER 61.85 152.47 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.351 -0.386 . . . . 0.0 111.219 179.817 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 23.6 mtmt 63.83 157.32 0.07 Allowed 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.073 -0.512 . . . . 0.0 111.185 179.73 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 28' ' ' GLY . . . . . 0.677 ' HA2' ' HB3' ' A' ' 11' ' ' ALA . . . -99.26 35.51 4.65 Favored Glycine 0 C--N 1.331 0.251 0 C-N-CA 120.845 -0.693 . . . . 0.0 112.376 179.923 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 63.4 m-20 -60.25 172.55 0.81 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.728 0.299 . . . . 0.0 110.771 179.951 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 30' ' ' ILE . . . . . 0.568 HG22 ' H ' ' A' ' 31' ' ' LEU . 12.8 mm -86.95 167.31 1.78 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.068 179.982 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.907 HD22 HG11 ' A' ' 44' ' ' VAL . 0.0 OUTLIER -158.13 -94.44 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.897 -179.458 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 32' ' ' THR . . . . . 0.653 ' O ' HG13 ' A' ' 44' ' ' VAL . 3.4 t -179.65 -154.46 0.02 OUTLIER 'General case' 0 CA--C 1.53 0.201 0 N-CA-C 110.175 -0.305 . . . . 0.0 110.175 179.808 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.604 ' N ' HG23 ' A' ' 32' ' ' THR . 0.3 OUTLIER -169.7 115.19 0.54 Allowed 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.911 0.386 . . . . 0.0 111.102 179.723 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -59.51 107.28 0.56 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.713 179.848 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 4.2 t-20 65.95 -167.47 0.21 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.64 -179.858 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 3.6 m -62.71 169.57 3.05 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-N 116.332 -0.395 . . . . 0.0 110.835 -179.997 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 37' ' ' THR . . . . . 0.456 HG23 ' N ' ' A' ' 38' ' ' ASN . 9.2 t -107.95 -47.65 3.53 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.862 179.912 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 38' ' ' ASN . . . . . 0.456 ' N ' HG23 ' A' ' 37' ' ' THR . 50.9 t30 64.9 -73.36 0.06 Allowed 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.148 179.927 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 39' ' ' LYS . . . . . 0.406 ' N ' ' O ' ' A' ' 37' ' ' THR . 0.0 OUTLIER -176.66 38.7 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.404 -0.362 . . . . 0.0 110.878 -179.967 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 7.3 m-20 -129.17 153.67 47.5 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.163 -0.472 . . . . 0.0 110.98 -179.978 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 41' ' ' TRP . . . . . 0.462 ' CG ' ' N ' ' A' ' 42' ' ' TRP . 18.3 p90 -58.39 -48.41 80.73 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.876 -179.982 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 42' ' ' TRP . . . . . 0.462 ' N ' ' CG ' ' A' ' 41' ' ' TRP . 77.7 m95 61.75 139.69 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.099 -0.501 . . . . 0.0 111.151 179.912 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 43' ' ' LYS . . . . . 0.415 ' O ' ' N ' ' A' ' 45' ' ' GLU . 0.1 OUTLIER -56.45 -22.12 29.99 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.361 -179.863 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 44' ' ' VAL . . . . . 0.907 HG11 HD22 ' A' ' 31' ' ' LEU . 49.1 t 62.7 -77.89 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.228 0 CA-C-N 116.479 -0.328 . . . . 0.0 111.135 -179.908 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 45' ' ' GLU . . . . . 0.618 ' O ' HG22 ' A' ' 32' ' ' THR . 24.4 mt-10 71.93 161.46 0.24 Allowed 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.053 179.998 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 46' ' ' VAL . . . . . 0.767 HG22 ' OD1' ' A' ' 47' ' ' ASN . 11.2 p -174.46 -47.74 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.175 179.908 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 47' ' ' ASN . . . . . 0.767 ' OD1' HG22 ' A' ' 46' ' ' VAL . 0.6 OUTLIER 169.82 148.86 0.03 OUTLIER 'General case' 0 N--CA 1.463 0.212 0 CA-C-O 120.907 0.384 . . . . 0.0 111.042 179.885 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 44.6 m-20 55.43 25.64 7.95 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.035 -0.53 . . . . 0.0 111.356 179.72 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -165.53 -81.35 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.473 -0.33 . . . . 0.0 110.85 179.865 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 50' ' ' GLN . . . . . 0.415 ' HA ' ' CB ' ' A' ' 45' ' ' GLU . 2.1 tt0 52.24 94.18 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.457 179.79 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 133.86 128.03 2.81 Favored Glycine 0 C--N 1.333 0.38 0 C-N-CA 120.683 -0.77 . . . . 0.0 113.107 179.642 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 52' ' ' PHE . . . . . 0.429 ' CZ ' ' HG2' ' A' ' 20' ' ' PRO . 24.1 m-85 60.75 111.97 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.977 0.417 . . . . 0.0 111.746 179.393 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 53' ' ' VAL . . . . . 0.406 HG23 ' O ' ' A' ' 52' ' ' PHE . 76.9 t -157.73 90.93 2.3 Favored Pre-proline 0 C--N 1.329 -0.3 0 CA-C-N 115.861 -0.609 . . . . 0.0 110.285 179.499 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 54' ' ' PRO . . . . . 0.51 ' CG ' ' NE2' ' A' ' 16' ' ' GLN . 31.6 Cg_exo -59.41 134.23 57.27 Favored 'Trans proline' 0 C--N 1.347 0.463 0 C-N-CA 122.797 2.331 . . . . 0.0 112.414 -179.544 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -99.96 63.3 1.18 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.782 179.625 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 56' ' ' ALA . . . . . 0.658 ' HB3' ' CE1' ' A' ' 57' ' ' TYR . . . -47.08 -29.73 2.35 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.156 -0.474 . . . . 0.0 111.262 -179.83 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 57' ' ' TYR . . . . . 0.658 ' CE1' ' HB3' ' A' ' 56' ' ' ALA . 0.0 OUTLIER -157.41 -74.84 0.09 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.375 179.922 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 58' ' ' VAL . . . . . 0.629 ' HA ' HD23 ' A' ' 12' ' ' LEU . 0.2 OUTLIER 52.48 -179.51 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.079 -0.51 . . . . 0.0 111.15 179.745 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 59' ' ' LYS . . . . . 0.528 ' H ' HG12 ' A' ' 58' ' ' VAL . 0.0 OUTLIER -85.06 153.11 22.94 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.91 -179.959 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -62.43 -37.08 84.47 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.152 -0.477 . . . . 0.0 110.876 -179.993 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 61' ' ' LEU . . . . . 0.637 HD23 ' O ' ' A' ' 8' ' ' LEU . 0.6 OUTLIER 59.82 105.55 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.942 -179.988 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 2.8 p30 . . . . . 0 C--O 1.248 1.006 0 CA-C-O 118.219 -0.896 . . . . 0.0 110.94 179.976 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 2.1 tp10 . . . . . 0 C--O 1.232 0.152 0 CA-C-O 120.721 0.296 . . . . 0.0 110.816 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.555 ' N ' HD22 ' A' ' 8' ' ' LEU . 3.1 mm? -97.65 -80.24 0.45 Allowed 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.959 -179.97 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 9' ' ' VAL . . . . . 0.783 HG21 HD11 ' A' ' 33' ' ' LEU . 23.4 m -151.93 -148.14 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.45 -0.454 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.595 -179.651 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 10' ' ' LEU . . . . . 0.692 HD22 ' CE ' ' A' ' 59' ' ' LYS . 0.9 OUTLIER -169.07 31.41 0.02 OUTLIER 'General case' 0 C--N 1.334 -0.082 0 CA-C-O 120.808 0.337 . . . . 0.0 111.173 -179.993 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . 61.07 -81.55 0.02 OUTLIER 'General case' 0 CA--C 1.529 0.15 0 CA-C-N 116.22 -0.446 . . . . 0.0 111.261 179.817 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.746 HD12 ' HA ' ' A' ' 58' ' ' VAL . 1.0 OUTLIER 64.81 -77.29 0.04 OUTLIER 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 116.387 -0.37 . . . . 0.0 110.853 -179.786 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 13' ' ' TYR . . . . . 0.465 ' HB2' ' HB3' ' A' ' 56' ' ' ALA . 1.2 m-85 -103.72 62.88 0.77 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 121.083 0.468 . . . . 0.0 110.606 179.775 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 14' ' ' ASP . . . . . 0.612 ' OD2' HD21 ' A' ' 31' ' ' LEU . 14.0 m-20 -126.38 70.23 1.24 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.042 -0.527 . . . . 0.0 111.075 -179.948 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 15' ' ' TYR . . . . . 0.415 ' O ' ' CD2' ' A' ' 15' ' ' TYR . 84.0 t80 -145.5 63.41 1.27 Allowed 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.893 -179.973 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER 179.15 170.86 0.92 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.924 179.926 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 27.8 tp10 -177.42 -73.57 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.727 179.967 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -125.03 -176.92 3.69 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.895 179.876 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 19' ' ' SER . . . . . 0.42 ' CB ' ' CD ' ' A' ' 20' ' ' PRO . 2.2 t -60.8 -62.49 5.87 Favored Pre-proline 0 C--N 1.33 -0.257 0 CA-C-N 116.332 -0.395 . . . . 0.0 110.952 179.994 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 20' ' ' PRO . . . . . 0.42 ' CD ' ' CB ' ' A' ' 19' ' ' SER . 20.4 Cg_endo -62.38 -75.36 0.02 OUTLIER 'Trans proline' 0 C--N 1.347 0.463 0 C-N-CA 122.388 2.059 . . . . 0.0 112.323 -179.917 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER 177.61 160.83 0.49 Allowed 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.515 -0.311 . . . . 0.0 110.782 179.993 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 49.0 tt0 -176.72 -71.51 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.956 179.923 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 23' ' ' VAL . . . . . 0.415 HG13 ' CG ' ' A' ' 47' ' ' ASN . 21.5 t -106.74 147.17 12.34 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.262 -0.427 . . . . 0.0 111.114 -179.971 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -178.76 107.54 0.04 OUTLIER 'General case' 0 C--N 1.333 -0.11 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.023 179.927 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 25' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -160.98 125.91 3.65 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.873 179.875 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 1.8 mmmm -128.89 -160.73 1.05 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.956 -179.675 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 5.0 tttm 78.89 -179.67 0.11 Allowed 'General case' 0 N--CA 1.464 0.229 0 CA-C-O 120.864 0.364 . . . . 0.0 110.953 -179.883 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -57.03 -20.12 33.18 Favored Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.934 -0.65 . . . . 0.0 112.896 -179.768 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -47.91 134.66 13.21 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.762 0.315 . . . . 0.0 111.202 -179.85 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 30' ' ' ILE . . . . . 0.608 HG23 ' C ' ' A' ' 9' ' ' VAL . 0.3 OUTLIER -104.92 -168.55 0.25 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.88 179.989 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 1.027 HD22 HG11 ' A' ' 44' ' ' VAL . 0.0 OUTLIER -146.04 -82.26 0.14 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.917 -179.808 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 32' ' ' THR . . . . . 0.509 HG23 ' H ' ' A' ' 33' ' ' LEU . 0.7 OUTLIER 165.97 -56.67 0.0 OUTLIER 'General case' 0 N--CA 1.466 0.33 0 CA-C-O 120.893 0.378 . . . . 0.0 110.692 -179.939 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.783 HD11 HG21 ' A' ' 9' ' ' VAL . 0.3 OUTLIER 58.91 98.89 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.965 179.91 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.457 HD22 ' HD2' ' A' ' 43' ' ' LYS . 1.2 pt? -57.47 -167.19 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.977 179.929 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 7.0 p-10 -59.08 88.58 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.897 179.988 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 11.0 t -59.68 159.97 7.93 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.956 179.908 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 1.4 t -140.29 117.68 11.4 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.832 -179.986 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 10.3 m120 -60.76 89.91 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.877 179.987 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -177.41 -39.78 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.835 179.953 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 9.1 p-10 -130.79 -175.4 3.65 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.958 -179.918 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 41' ' ' TRP . . . . . 0.479 ' O ' ' CG ' ' A' ' 42' ' ' TRP . 0.1 OUTLIER -80.88 -0.9 41.13 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.381 -179.988 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 42' ' ' TRP . . . . . 0.479 ' CG ' ' O ' ' A' ' 41' ' ' TRP . 32.2 p90 45.79 -172.92 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.247 0 CA-C-O 120.853 0.358 . . . . 0.0 111.34 -179.971 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 43' ' ' LYS . . . . . 0.457 ' HD2' HD22 ' A' ' 34' ' ' LEU . 0.0 OUTLIER -126.36 162.92 24.42 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.003 -179.773 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 44' ' ' VAL . . . . . 1.027 HG11 HD22 ' A' ' 31' ' ' LEU . 11.1 t -144.23 157.69 15.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.061 -0.518 . . . . 0.0 111.105 179.99 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 45' ' ' GLU . . . . . 0.569 ' O ' HG12 ' A' ' 46' ' ' VAL . 5.5 mm-40 -101.68 -165.29 1.18 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.827 -179.91 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 46' ' ' VAL . . . . . 0.586 HG13 ' O ' ' A' ' 46' ' ' VAL . 0.4 OUTLIER 80.07 7.81 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.532 0.265 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.43 179.983 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 47' ' ' ASN . . . . . 0.415 ' CG ' HG13 ' A' ' 23' ' ' VAL . 3.0 t-20 -113.8 -36.22 4.9 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.852 0.358 . . . . 0.0 110.953 179.921 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER 73.55 7.03 5.09 Favored 'General case' 0 CA--C 1.532 0.285 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.328 -179.966 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -87.77 -70.24 0.64 Allowed 'General case' 0 C--O 1.231 0.122 0 CA-C-O 120.881 0.372 . . . . 0.0 110.826 179.851 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 2.4 tt0 -164.31 -68.89 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.9 -179.926 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 171.22 -153.25 20.08 Favored Glycine 0 C--N 1.332 0.341 0 C-N-CA 120.857 -0.687 . . . . 0.0 112.523 -179.982 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 10.8 m-85 60.62 113.41 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.773 0.32 . . . . 0.0 110.956 -179.976 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 53' ' ' VAL . . . . . 0.806 HG21 ' HB ' ' A' ' 44' ' ' VAL . 21.4 t -141.64 136.96 15.85 Favored Pre-proline 0 C--N 1.329 -0.311 0 CA-C-N 116.382 -0.372 . . . . 0.0 111.282 -179.96 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 54' ' ' PRO . . . . . 0.474 ' O ' ' HB3' ' A' ' 55' ' ' ALA . 47.5 Cg_exo -55.73 -55.08 3.28 Favored 'Trans proline' 0 C--N 1.347 0.498 0 C-N-CA 122.586 2.191 . . . . 0.0 112.294 179.93 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 55' ' ' ALA . . . . . 0.474 ' HB3' ' O ' ' A' ' 54' ' ' PRO . . . 71.96 -62.3 0.47 Allowed 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.375 -179.982 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 56' ' ' ALA . . . . . 0.468 ' HB3' ' O ' ' A' ' 55' ' ' ALA . . . 70.76 -70.89 0.14 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.132 -179.822 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 57' ' ' TYR . . . . . 0.456 ' CD1' ' N ' ' A' ' 57' ' ' TYR . 0.8 OUTLIER -149.25 -62.87 0.23 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.999 179.766 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 58' ' ' VAL . . . . . 0.746 ' HA ' HD12 ' A' ' 12' ' ' LEU . 7.7 p 39.8 49.56 0.31 Allowed 'Isoleucine or valine' 0 CA--C 1.53 0.206 0 CA-C-N 116.218 -0.446 . . . . 0.0 112.113 179.861 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 59' ' ' LYS . . . . . 0.692 ' CE ' HD22 ' A' ' 10' ' ' LEU . 15.5 mttm 74.8 30.64 0.96 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.76 -179.688 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 62.77 -79.97 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.895 -179.757 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 13.1 tp -178.62 78.99 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.834 179.857 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 39.8 m-20 . . . . . 0 C--O 1.249 1.077 0 CA-C-O 118.29 -0.862 . . . . 0.0 110.916 179.938 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 4.5 pm0 . . . . . 0 N--CA 1.462 0.156 0 CA-C-O 120.923 0.392 . . . . 0.0 111.481 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 1.8 mt 56.66 -160.65 0.21 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.992 -179.864 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 9' ' ' VAL . . . . . 0.591 HG21 HD21 ' A' ' 33' ' ' LEU . 22.3 t -144.28 -38.63 0.14 Allowed 'Isoleucine or valine' 0 N--CA 1.454 -0.242 0 CA-C-N 115.91 -0.586 . . . . 0.0 111.381 179.849 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 10' ' ' LEU . . . . . 0.436 ' HA ' HD13 ' A' ' 30' ' ' ILE . 3.2 mt 67.79 159.45 0.15 Allowed 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.365 -0.38 . . . . 0.0 110.546 -179.618 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 11' ' ' ALA . . . . . 0.737 ' HB3' ' O ' ' A' ' 26' ' ' LYS . . . -108.79 -24.59 11.22 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.931 179.702 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.819 HD12 ' HA ' ' A' ' 58' ' ' VAL . 27.4 mt 52.54 50.17 18.82 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-N 116.196 -0.457 . . . . 0.0 111.003 179.997 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 13' ' ' TYR . . . . . 0.407 ' CD2' ' HG2' ' A' ' 27' ' ' LYS . 3.6 t80 75.65 152.31 0.13 Allowed 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 115.907 -0.588 . . . . 0.0 111.09 -179.989 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 14' ' ' ASP . . . . . 0.413 ' OD1' ' N ' ' A' ' 14' ' ' ASP . 0.4 OUTLIER -45.81 155.32 0.18 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.921 -0.581 . . . . 0.0 111.374 179.837 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 15' ' ' TYR . . . . . 0.605 ' HE1' ' HB3' ' A' ' 56' ' ' ALA . 42.5 t80 -71.17 -66.57 0.6 Allowed 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.787 -179.966 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 16' ' ' GLN . . . . . 0.405 ' O ' ' CB ' ' A' ' 17' ' ' GLU . 18.5 tt0 -177.46 -34.51 0.01 OUTLIER 'General case' 0 CA--C 1.53 0.201 0 CA-C-N 116.306 -0.406 . . . . 0.0 111.469 -179.75 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 17' ' ' GLU . . . . . 0.652 ' CG ' HG21 ' A' ' 24' ' ' THR . 34.3 mt-10 82.27 161.82 0.14 Allowed 'General case' 0 N--CA 1.467 0.408 0 CA-C-N 116.277 -0.419 . . . . 0.0 110.753 -179.618 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -101.68 -68.84 0.8 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.028 -179.838 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 19' ' ' SER . . . . . 0.484 ' N ' ' HD2' ' A' ' 20' ' ' PRO . 3.6 t 174.98 -60.73 0.0 OUTLIER Pre-proline 0 C--N 1.332 -0.168 0 CA-C-N 116.423 -0.353 . . . . 0.0 111.308 -179.832 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 20' ' ' PRO . . . . . 0.484 ' HD2' ' N ' ' A' ' 19' ' ' SER . 9.7 Cg_endo -51.96 -76.31 0.02 OUTLIER 'Trans proline' 0 C--N 1.349 0.567 0 C-N-CA 122.655 2.237 . . . . 0.0 112.568 -179.593 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -95.3 -82.45 0.38 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.631 -0.259 . . . . 0.0 110.999 -179.72 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 13.9 tt0 -178.06 -75.96 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.667 0.27 . . . . 0.0 111.054 -179.981 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 23' ' ' VAL . . . . . 0.765 HG22 ' HB3' ' A' ' 49' ' ' ARG . 35.4 t 59.7 78.92 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.243 0 CA-C-N 116.504 -0.317 . . . . 0.0 111.007 -179.883 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 24' ' ' THR . . . . . 0.652 HG21 ' CG ' ' A' ' 17' ' ' GLU . 41.7 p -158.87 177.11 11.52 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-O 121.022 0.439 . . . . 0.0 111.496 -179.657 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 25' ' ' MET . . . . . 0.719 ' CE ' HG21 ' A' ' 44' ' ' VAL . 0.1 OUTLIER -98.87 -161.45 0.88 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.684 -0.689 . . . . 0.0 110.329 179.541 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 26' ' ' LYS . . . . . 0.737 ' O ' ' HB3' ' A' ' 11' ' ' ALA . 3.2 mmtp -147.88 174.35 11.94 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.84 0.353 . . . . 0.0 111.124 179.516 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 27' ' ' LYS . . . . . 0.407 ' HG2' ' CD2' ' A' ' 13' ' ' TYR . 21.7 mtmm -57.37 102.14 0.08 Allowed 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.453 -179.854 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 45.5 37.05 6.33 Favored Glycine 0 C--N 1.332 0.32 0 C-N-CA 121.065 -0.588 . . . . 0.0 113.032 179.766 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 33.5 t0 -90.24 15.6 10.12 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.742 0.306 . . . . 0.0 111.396 179.817 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 30' ' ' ILE . . . . . 0.707 HG22 ' H ' ' A' ' 31' ' ' LEU . 2.4 mm 54.45 174.91 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.2 0 CA-C-O 120.943 0.401 . . . . 0.0 111.378 179.908 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.707 ' H ' HG22 ' A' ' 30' ' ' ILE . 0.0 OUTLIER -177.84 -170.85 0.27 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.383 -179.313 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 32' ' ' THR . . . . . 0.595 ' N ' HD22 ' A' ' 31' ' ' LEU . 86.8 m -122.94 163.06 21.09 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-O 121.12 0.486 . . . . 0.0 111.159 179.924 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.73 HD22 ' N ' ' A' ' 33' ' ' LEU . 0.6 OUTLIER -120.93 -61.06 1.6 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.881 -0.599 . . . . 0.0 110.955 -179.762 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER 61.88 115.84 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.92 179.978 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 92.9 m-20 60.77 87.59 0.09 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.926 179.965 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 9.2 m -163.36 166.1 23.31 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.807 -179.988 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 4.2 m -145.87 -65.18 0.31 Allowed 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.015 179.975 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 18.9 p-10 -142.56 -49.14 0.35 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.907 -179.953 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -123.56 92.83 3.77 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.861 -179.915 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 40' ' ' ASP . . . . . 0.44 ' HB2' ' CE3' ' A' ' 42' ' ' TRP . 5.1 p30 -177.68 165.81 2.11 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.174 -0.467 . . . . 0.0 110.915 179.854 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 41' ' ' TRP . . . . . . . . . . . . . 10.2 p90 -134.54 -47.61 0.76 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.875 179.931 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 42' ' ' TRP . . . . . 0.44 ' CE3' ' HB2' ' A' ' 40' ' ' ASP . 1.0 OUTLIER 62.17 -81.24 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.99 179.987 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 5.2 pttt -178.32 103.1 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.811 179.915 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 44' ' ' VAL . . . . . 0.719 HG21 ' CE ' ' A' ' 25' ' ' MET . 11.7 t -49.31 -41.89 15.31 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.899 179.816 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 3.8 tt0 58.28 41.35 23.5 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.112 -0.495 . . . . 0.0 111.238 179.689 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 46' ' ' VAL . . . . . 0.4 HG12 ' CG1' ' A' ' 44' ' ' VAL . 14.4 p -102.77 -24.09 4.16 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-O 120.92 0.39 . . . . 0.0 110.959 179.599 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 6.0 p-10 -100.08 -171.23 2.0 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.617 179.664 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 23.2 t0 -109.91 63.26 0.6 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.811 0.339 . . . . 0.0 111.037 -179.879 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 49' ' ' ARG . . . . . 0.765 ' HB3' HG22 ' A' ' 23' ' ' VAL . 54.6 ttt-85 -177.14 104.81 0.05 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.073 179.883 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 24.2 tp60 61.94 -81.57 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.121 -0.49 . . . . 0.0 111.043 179.763 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 127.75 -2.02 6.92 Favored Glycine 0 C--N 1.334 0.448 0 C-N-CA 120.795 -0.717 . . . . 0.0 112.962 -179.869 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 2.2 m-85 -44.66 -82.0 0.01 OUTLIER 'General case' 0 CA--C 1.53 0.178 0 CA-C-N 116.825 0.313 . . . . 0.0 111.395 -179.816 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 53' ' ' VAL . . . . . 0.663 HG11 ' SD ' ' A' ' 25' ' ' MET . 2.8 t 49.47 84.62 0.2 Allowed Pre-proline 0 C--N 1.332 -0.186 0 CA-C-N 116.467 -0.333 . . . . 0.0 111.308 179.912 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 54' ' ' PRO . . . . . 0.449 ' HB2' ' CZ ' ' A' ' 15' ' ' TYR . 56.1 Cg_exo -51.29 139.94 43.44 Favored 'Trans proline' 0 C--N 1.345 0.393 0 C-N-CA 122.54 2.16 . . . . 0.0 112.177 179.886 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -86.95 55.81 3.73 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.336 -179.757 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 56' ' ' ALA . . . . . 0.605 ' HB3' ' HE1' ' A' ' 15' ' ' TYR . . . -94.62 36.91 1.14 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.433 179.209 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -175.79 -168.68 0.3 Allowed 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.655 -179.239 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 58' ' ' VAL . . . . . 0.819 ' HA ' HD12 ' A' ' 12' ' ' LEU . 48.3 t 63.37 157.13 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.575 178.868 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 59' ' ' LYS . . . . . 0.748 ' HD3' HD21 ' A' ' 61' ' ' LEU . 10.0 ptpt -55.92 120.5 7.51 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.945 179.952 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -71.7 96.73 1.63 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.866 -179.9 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 61' ' ' LEU . . . . . 0.748 HD21 ' HD3' ' A' ' 59' ' ' LYS . 1.4 pp -177.07 173.5 1.81 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.913 179.941 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 14.7 t0 . . . . . 0 C--O 1.249 1.058 0 CA-C-O 118.243 -0.885 . . . . 0.0 110.863 179.957 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 7' ' ' GLU . . . . . 0.686 ' C ' HD13 ' A' ' 8' ' ' LEU . 0.3 OUTLIER . . . . . 0 C--O 1.231 0.129 0 CA-C-O 120.816 0.341 . . . . 0.0 110.923 . . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.687 ' N ' HD13 ' A' ' 8' ' ' LEU . 0.0 OUTLIER -156.34 150.85 25.68 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.869 -179.989 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 9' ' ' VAL . . . . . 0.822 HG12 HG11 ' A' ' 58' ' ' VAL . 98.9 t -111.99 -95.32 0.1 OUTLIER 'Isoleucine or valine' 0 CA--C 1.534 0.362 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.167 -179.965 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 10' ' ' LEU . . . . . 0.681 HD12 ' HD3' ' A' ' 59' ' ' LYS . 2.0 mt 166.49 -54.56 0.0 OUTLIER 'General case' 0 N--CA 1.464 0.233 0 CA-C-O 120.882 0.372 . . . . 0.0 110.92 179.953 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 11' ' ' ALA . . . . . 0.576 ' HB1' ' CE ' ' A' ' 25' ' ' MET . . . 64.66 43.79 4.12 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.942 -179.473 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.676 HD13 ' H ' ' A' ' 12' ' ' LEU . 0.0 OUTLIER -56.99 155.98 7.44 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.086 -179.999 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 13' ' ' TYR . . . . . 0.4 ' CD2' ' OH ' ' A' ' 57' ' ' TYR . 0.1 OUTLIER 77.88 -5.16 2.14 Favored 'General case' 0 N--CA 1.463 0.218 0 CA-C-N 116.005 -0.543 . . . . 0.0 111.777 -179.907 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 14' ' ' ASP . . . . . 0.44 ' HB3' ' HA ' ' A' ' 26' ' ' LYS . 5.8 p-10 43.47 95.77 0.01 OUTLIER 'General case' 0 N--CA 1.462 0.146 0 CA-C-O 120.893 0.378 . . . . 0.0 111.657 179.799 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 15' ' ' TYR . . . . . 0.425 ' CZ ' ' HG2' ' A' ' 54' ' ' PRO . 10.3 t80 -74.44 116.11 14.75 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.069 -179.915 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 5.6 pt20 -88.04 -166.0 1.47 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.679 179.867 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 17' ' ' GLU . . . . . 0.441 ' HB3' ' HA ' ' A' ' 22' ' ' GLU . 1.6 pt-20 -101.3 111.08 23.2 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.897 -179.94 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -154.19 23.8 0.49 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.345 -0.389 . . . . 0.0 111.253 -179.999 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 19' ' ' SER . . . . . 0.411 ' CB ' ' CD ' ' A' ' 20' ' ' PRO . 2.2 t 172.98 -62.73 0.0 OUTLIER Pre-proline 0 C--N 1.332 -0.19 0 CA-C-N 116.475 -0.33 . . . . 0.0 110.949 179.735 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 20' ' ' PRO . . . . . 0.411 ' CD ' ' CB ' ' A' ' 19' ' ' SER . 19.1 Cg_endo -61.53 -66.79 0.05 OUTLIER 'Trans proline' 0 C--N 1.348 0.5 0 C-N-CA 122.451 2.101 . . . . 0.0 112.376 -179.972 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 1.8 ttt180 -179.87 -166.63 0.08 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.889 179.998 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 22' ' ' GLU . . . . . 0.441 ' HA ' ' HB3' ' A' ' 17' ' ' GLU . 2.2 mp0 -79.28 81.76 5.51 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.93 -179.98 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 23' ' ' VAL . . . . . 0.516 HG11 ' O ' ' A' ' 51' ' ' GLY . 27.2 m -134.93 134.82 53.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.399 179.951 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 18.0 m -130.83 154.29 48.2 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.76 179.928 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 25' ' ' MET . . . . . 0.576 ' CE ' ' HB1' ' A' ' 11' ' ' ALA . 31.2 mtm -150.09 57.49 0.96 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.959 0.409 . . . . 0.0 110.959 -179.94 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 26' ' ' LYS . . . . . 0.44 ' HA ' ' HB3' ' A' ' 14' ' ' ASP . 2.4 tppt? -40.44 120.77 1.29 Allowed 'General case' 0 N--CA 1.465 0.312 0 CA-C-N 115.899 -0.591 . . . . 0.0 111.908 -179.789 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 4.6 mptt 53.61 174.15 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.011 -0.54 . . . . 0.0 111.44 179.624 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 28' ' ' GLY . . . . . 0.646 ' HA3' HD22 ' A' ' 10' ' ' LEU . . . -82.34 61.45 4.71 Favored Glycine 0 N--CA 1.452 -0.299 0 C-N-CA 120.904 -0.665 . . . . 0.0 112.241 179.786 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -96.87 29.86 2.89 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.909 0.385 . . . . 0.0 110.883 179.91 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 30' ' ' ILE . . . . . 0.58 ' N ' HD13 ' A' ' 30' ' ' ILE . 0.4 OUTLIER 51.97 178.08 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.238 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.187 -179.939 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.897 ' HB2' HG22 ' A' ' 46' ' ' VAL . 0.0 OUTLIER -164.69 18.82 0.05 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.893 -179.057 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 32' ' ' THR . . . . . 0.566 HG22 ' H ' ' A' ' 33' ' ' LEU . 0.6 OUTLIER 52.02 178.2 0.02 OUTLIER 'General case' 0 N--CA 1.465 0.275 0 CA-C-O 120.858 0.361 . . . . 0.0 111.165 179.924 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.615 HD21 HG23 ' A' ' 9' ' ' VAL . 1.0 OUTLIER -179.85 163.99 1.16 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.927 0.394 . . . . 0.0 111.102 -179.981 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.519 HD12 ' N ' ' A' ' 34' ' ' LEU . 4.1 mp -102.16 35.38 2.41 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.938 -0.574 . . . . 0.0 110.798 179.935 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 1.7 m-20 64.68 134.76 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.919 -179.961 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 36' ' ' SER . . . . . 0.697 ' O ' HG23 ' A' ' 37' ' ' THR . 4.6 m -103.4 -172.73 2.16 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.905 179.918 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 37' ' ' THR . . . . . 0.697 HG23 ' O ' ' A' ' 36' ' ' SER . 0.3 OUTLIER -177.22 67.89 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.984 179.971 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 35.7 t-20 -172.81 -94.01 0.01 OUTLIER 'General case' 0 CA--C 1.532 0.27 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.773 179.789 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER 173.58 38.4 0.0 OUTLIER 'General case' 0 C--O 1.232 0.179 0 CA-C-O 120.672 0.272 . . . . 0.0 111.071 179.904 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 40' ' ' ASP . . . . . 0.479 ' O ' ' CG ' ' A' ' 41' ' ' TRP . 2.4 p-10 176.26 87.22 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.571 -0.286 . . . . 0.0 111.088 179.881 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 41' ' ' TRP . . . . . 0.49 ' CH2' ' CD2' ' A' ' 52' ' ' PHE . 66.8 p-90 45.69 -174.89 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.285 0 CA-C-N 116.07 -0.514 . . . . 0.0 111.603 179.833 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 42' ' ' TRP . . . . . . . . . . . . . 1.3 m95 175.82 86.38 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.833 -179.989 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 9.7 mttp 59.16 61.61 2.04 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.878 179.842 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 44' ' ' VAL . . . . . 0.856 HG13 HD23 ' A' ' 31' ' ' LEU . 82.0 t -77.72 83.36 0.88 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.942 179.827 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 6.3 mp0 -101.75 101.72 12.25 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.939 -179.89 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 46' ' ' VAL . . . . . 0.897 HG22 ' HB2' ' A' ' 31' ' ' LEU . 11.7 t -58.85 -30.47 42.82 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.047 179.858 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 63.4 m-20 -150.97 -57.36 0.16 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.773 179.888 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 48' ' ' ASP . . . . . 0.402 ' O ' ' HD2' ' A' ' 49' ' ' ARG . 8.9 p-10 -179.2 149.2 0.4 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.055 -0.521 . . . . 0.0 110.878 179.902 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 49' ' ' ARG . . . . . 0.466 ' HG2' ' O ' ' A' ' 49' ' ' ARG . 0.0 OUTLIER 76.21 -9.33 1.48 Allowed 'General case' 0 CA--C 1.536 0.405 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.629 179.901 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 24.0 mm-40 -94.37 -168.73 1.9 Allowed 'General case' 0 C--N 1.332 -0.17 0 CA-C-O 120.786 0.327 . . . . 0.0 110.835 179.636 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 51' ' ' GLY . . . . . 0.516 ' O ' HG11 ' A' ' 23' ' ' VAL . . . 134.65 166.76 11.26 Favored Glycine 0 C--N 1.334 0.442 0 C-N-CA 120.812 -0.708 . . . . 0.0 112.693 179.877 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 52' ' ' PHE . . . . . 0.49 ' CD2' ' CH2' ' A' ' 41' ' ' TRP . 5.2 m-85 62.86 107.9 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.839 0.352 . . . . 0.0 111.161 179.855 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 53' ' ' VAL . . . . . 0.819 ' CG2' HG21 ' A' ' 44' ' ' VAL . 30.2 m -155.88 105.0 2.12 Favored Pre-proline 0 CA--C 1.531 0.242 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.146 179.752 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 54' ' ' PRO . . . . . 0.425 ' HG2' ' CZ ' ' A' ' 15' ' ' TYR . 32.1 Cg_exo -59.02 93.97 0.08 OUTLIER 'Trans proline' 0 C--N 1.346 0.446 0 C-N-CA 122.539 2.16 . . . . 0.0 112.368 -179.775 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -61.47 89.94 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.912 179.826 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -53.04 -80.26 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.209 -0.451 . . . . 0.0 111.174 -179.793 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 57' ' ' TYR . . . . . 0.553 ' O ' HD11 ' A' ' 12' ' ' LEU . 20.2 p90 -133.57 98.09 4.11 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.39 -0.368 . . . . 0.0 110.729 179.802 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 58' ' ' VAL . . . . . 0.822 HG11 HG12 ' A' ' 9' ' ' VAL . 1.8 t -133.11 167.97 25.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.371 -179.709 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 59' ' ' LYS . . . . . 0.681 ' HD3' HD12 ' A' ' 10' ' ' LEU . 0.0 OUTLIER -79.74 148.21 31.59 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.862 179.817 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 64.41 -75.77 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.049 -179.971 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 61' ' ' LEU . . . . . 0.613 ' O ' HD23 ' A' ' 61' ' ' LEU . 1.1 tt 60.49 33.37 20.58 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.377 -0.374 . . . . 0.0 110.946 179.885 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 6.5 t0 . . . . . 0 C--O 1.249 1.058 0 CA-C-O 118.27 -0.871 . . . . 0.0 110.894 179.984 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 2.4 tt0 . . . . . 0 C--O 1.231 0.104 0 CA-C-O 120.832 0.348 . . . . 0.0 110.828 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.677 ' O ' HG13 ' A' ' 9' ' ' VAL . 0.1 OUTLIER -145.3 -46.09 0.22 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.977 -179.999 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 9' ' ' VAL . . . . . 0.925 HG21 HD11 ' A' ' 33' ' ' LEU . 0.7 OUTLIER -164.36 172.64 0.22 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.195 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.074 -179.93 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 10' ' ' LEU . . . . . 0.571 HD11 ' CD ' ' A' ' 59' ' ' LYS . 0.4 OUTLIER -132.36 -37.94 1.07 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.51 -179.785 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 11' ' ' ALA . . . . . 0.794 ' HB1' ' CZ ' ' A' ' 13' ' ' TYR . . . 73.52 67.39 0.1 Allowed 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 121.018 0.437 . . . . 0.0 110.123 -178.972 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.496 ' H ' HG23 ' A' ' 58' ' ' VAL . 1.2 mp -80.55 12.15 3.27 Favored 'General case' 0 CA--C 1.531 0.213 0 CA-C-N 115.938 -0.574 . . . . 0.0 111.707 -179.639 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 13' ' ' TYR . . . . . 0.805 ' CD2' HG21 ' A' ' 44' ' ' VAL . 0.0 OUTLIER -50.8 177.61 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.171 0 CA-C-O 120.903 0.382 . . . . 0.0 111.175 179.983 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 9.7 p30 -173.14 36.85 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.755 179.859 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 15' ' ' TYR . . . . . 0.4 ' CD1' ' N ' ' A' ' 16' ' ' GLN . 7.1 t80 -83.73 153.49 24.13 Favored 'General case' 0 C--N 1.333 -0.15 0 CA-C-N 116.086 -0.506 . . . . 0.0 111.1 -179.849 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 16' ' ' GLN . . . . . 0.4 ' N ' ' CD1' ' A' ' 15' ' ' TYR . 10.0 mp0 -145.87 90.16 1.96 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.865 179.908 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 4.4 tt0 -98.33 27.66 4.56 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.35 -0.387 . . . . 0.0 111.146 -179.76 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 55.61 -163.89 0.14 Allowed 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.395 -0.366 . . . . 0.0 110.897 179.828 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER 65.33 149.89 0.12 Allowed Pre-proline 0 C--N 1.331 -0.202 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.992 -179.936 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 52.4 Cg_endo -69.25 -46.41 1.44 Allowed 'Trans proline' 0 C--N 1.345 0.393 0 C-N-CA 122.647 2.231 . . . . 0.0 112.418 -179.965 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 4.8 ptt85 -130.41 108.31 9.89 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.921 -179.968 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -176.92 -79.56 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.868 179.946 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 23' ' ' VAL . . . . . 0.63 HG13 ' O ' ' A' ' 52' ' ' PHE . 38.8 t -148.02 110.64 0.68 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.078 -179.978 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 2.7 t -179.17 104.52 0.03 OUTLIER 'General case' 0 N--CA 1.462 0.16 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.954 179.941 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 25' ' ' MET . . . . . 0.425 ' HG2' ' CE2' ' A' ' 13' ' ' TYR . 2.2 mpp? -140.03 170.44 15.85 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.98 179.888 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -176.07 -179.37 1.12 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.876 179.979 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 13.1 mmmt 71.18 -169.75 0.15 Allowed 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.938 -179.994 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -116.06 25.04 9.64 Favored Glycine 0 C--N 1.332 0.337 0 C-N-CA 120.815 -0.707 . . . . 0.0 112.622 -179.842 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 29' ' ' ASP . . . . . 0.471 ' O ' ' HB3' ' A' ' 11' ' ' ALA . 56.4 t0 -65.3 120.97 13.75 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.841 0.353 . . . . 0.0 110.582 179.769 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 30' ' ' ILE . . . . . 0.643 HG23 ' O ' ' A' ' 9' ' ' VAL . 5.2 mt -59.71 166.49 0.62 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.114 -179.684 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.781 HD13 HD21 ' A' ' 33' ' ' LEU . 0.0 OUTLIER -148.22 -167.37 2.79 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.132 -178.928 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 32' ' ' THR . . . . . 0.493 HG23 ' N ' ' A' ' 33' ' ' LEU . 14.8 t -102.36 -47.94 4.33 Favored 'General case' 0 C--N 1.333 -0.127 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.849 179.964 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.925 HD11 HG21 ' A' ' 9' ' ' VAL . 0.2 OUTLIER 64.99 170.86 0.2 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.844 179.81 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.419 HD23 ' N ' ' A' ' 35' ' ' ASN . 0.8 OUTLIER -93.05 -77.43 0.44 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.985 179.984 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 35' ' ' ASN . . . . . 0.419 ' N ' HD23 ' A' ' 34' ' ' LEU . 20.0 t-20 -138.03 -44.24 0.52 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.952 -179.936 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 3.1 t 69.02 112.25 0.05 OUTLIER 'General case' 0 N--CA 1.462 0.168 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.866 179.991 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 8.9 t -177.5 160.8 1.66 Allowed 'General case' 0 C--O 1.231 0.124 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.815 179.873 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 8.7 m120 60.41 172.82 0.09 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.888 -179.913 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -114.83 107.63 15.67 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.986 -180.0 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 40' ' ' ASP . . . . . 0.46 ' O ' ' N ' ' A' ' 42' ' ' TRP . 1.5 m-20 -178.63 81.44 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.081 -0.508 . . . . 0.0 110.893 179.944 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 41' ' ' TRP . . . . . 0.576 ' CG ' ' N ' ' A' ' 42' ' ' TRP . 0.0 OUTLIER 65.18 -65.05 0.16 Allowed 'General case' 0 CA--C 1.532 0.258 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.931 -179.906 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 42' ' ' TRP . . . . . 0.576 ' N ' ' CG ' ' A' ' 41' ' ' TRP . 3.8 t-105 57.89 115.93 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.189 -0.46 . . . . 0.0 111.402 -179.869 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 43' ' ' LYS . . . . . 0.445 ' HG3' ' CZ3' ' A' ' 42' ' ' TRP . 2.5 ptpp? -71.95 -177.21 1.94 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.373 179.417 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 44' ' ' VAL . . . . . 0.805 HG21 ' CD2' ' A' ' 13' ' ' TYR . 0.3 OUTLIER -118.53 -40.87 2.28 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-O 120.868 0.366 . . . . 0.0 111.131 179.975 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER 61.49 114.1 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.022 -179.964 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 46' ' ' VAL . . . . . 0.638 HG22 HD23 ' A' ' 31' ' ' LEU . 21.4 t -141.04 -57.31 0.25 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.048 179.88 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 7.9 m-80 -129.81 -174.82 3.41 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.752 179.93 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 16.6 m-20 -68.44 73.22 0.22 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.886 179.984 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -156.01 26.94 0.37 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.959 -179.954 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER 56.94 -167.61 0.12 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.393 -0.367 . . . . 0.0 110.943 179.919 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -91.18 -108.58 1.5 Allowed Glycine 0 C--N 1.332 0.349 0 C-N-CA 120.958 -0.639 . . . . 0.0 112.538 179.993 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 52' ' ' PHE . . . . . 0.63 ' O ' HG13 ' A' ' 23' ' ' VAL . 19.6 m-85 55.41 79.53 0.15 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.86 0.362 . . . . 0.0 110.562 -179.941 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 53' ' ' VAL . . . . . 0.492 HG13 ' HB ' ' A' ' 44' ' ' VAL . 1.5 p 179.0 92.73 0.17 Allowed Pre-proline 0 C--N 1.327 -0.377 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.708 -179.498 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_exo -52.56 130.85 38.41 Favored 'Trans proline' 0 C--N 1.346 0.424 0 C-N-CA 122.535 2.156 . . . . 0.0 112.295 -179.878 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -64.15 -52.37 59.37 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.057 -0.519 . . . . 0.0 110.969 -179.979 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 56' ' ' ALA . . . . . 0.439 ' O ' ' HD1' ' A' ' 57' ' ' TYR . . . 58.61 47.12 13.67 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.058 179.987 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 57' ' ' TYR . . . . . 0.476 ' CD1' ' C ' ' A' ' 57' ' ' TYR . 0.0 OUTLIER 81.56 147.15 0.09 Allowed 'General case' 0 N--CA 1.464 0.271 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.688 -179.827 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 58' ' ' VAL . . . . . 0.515 HG13 ' N ' ' A' ' 59' ' ' LYS . 8.2 p -178.49 -47.69 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.365 -179.788 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 59' ' ' LYS . . . . . 0.571 ' CD ' HD11 ' A' ' 10' ' ' LEU . 0.4 OUTLIER 178.79 -167.87 0.08 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.361 -0.382 . . . . 0.0 110.788 -179.91 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -130.57 88.25 2.6 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.815 179.925 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 61' ' ' LEU . . . . . 0.534 HD23 HG13 ' A' ' 9' ' ' VAL . 0.6 OUTLIER -59.89 -65.44 0.68 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.924 179.912 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 . . . . . 0 C--O 1.25 1.107 0 CA-C-O 118.251 -0.88 . . . . 0.0 110.896 179.989 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . 0.661 ' O ' HG13 ' A' ' 9' ' ' VAL . 2.1 tp . . . . . 0 CA--C 1.526 0.049 0 CA-C-O 120.836 0.35 . . . . 0.0 110.831 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . 0.661 HG13 ' O ' ' A' ' 8' ' ' LEU . 1.5 m -163.51 64.67 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.333 -0.146 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.092 179.908 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . 0.749 ' O ' HG13 ' A' ' 58' ' ' VAL . 0.8 OUTLIER -61.06 159.31 11.91 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.189 -0.459 . . . . 0.0 111.005 179.941 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . 0.631 ' HB2' ' HG2' ' A' ' 25' ' ' MET . . . -71.91 -20.89 61.71 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.099 -0.501 . . . . 0.0 111.384 179.933 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.805 HD11 ' HA ' ' A' ' 58' ' ' VAL . 0.5 OUTLIER 74.94 16.26 2.94 Favored 'General case' 0 N--CA 1.465 0.313 0 CA-C-N 116.33 -0.396 . . . . 0.0 111.277 179.96 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER 177.19 -77.72 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.181 0 CA-C-O 120.661 0.267 . . . . 0.0 110.97 179.851 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER 169.29 -34.17 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.442 -0.345 . . . . 0.0 110.905 -179.805 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' TYR . . . . . 0.896 ' CD2' HG12 ' A' ' 53' ' ' VAL . 19.4 t80 68.25 -62.58 0.36 Allowed 'General case' 0 N--CA 1.465 0.285 0 CA-C-N 116.145 -0.479 . . . . 0.0 111.265 -179.847 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' GLN . . . . . 0.403 ' HA ' ' HB ' ' A' ' 24' ' ' THR . 13.1 pt20 44.94 88.65 0.02 OUTLIER 'General case' 0 N--CA 1.463 0.201 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.391 -179.769 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . 0.738 ' N ' HG22 ' A' ' 24' ' ' THR . 6.3 tp10 . . . . . 0 C--N 1.329 -0.287 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.969 179.918 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.231 0.102 0 CA-C-O 120.732 0.301 . . . . 0.0 110.939 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 3.0 m -59.21 101.4 0.1 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.202 179.961 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . 0.738 HG22 ' N ' ' A' ' 17' ' ' GLU . 75.0 p -135.44 105.68 6.34 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 116.108 -0.497 . . . . 0.0 111.004 -179.849 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' MET . . . . . 0.707 ' CE ' HG11 ' A' ' 53' ' ' VAL . 1.8 mpp? -87.54 170.06 11.64 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.673 179.877 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 8.3 tptm -156.1 127.47 7.15 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.165 -179.824 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 10.8 ttmt 62.85 -79.79 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.147 179.896 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 179.16 61.05 0.08 OUTLIER Glycine 0 N--CA 1.452 -0.284 0 C-N-CA 120.667 -0.778 . . . . 0.0 112.44 -179.973 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 38.0 m-20 -83.97 4.16 31.0 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.565 0.221 . . . . 0.0 111.249 179.872 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . 0.665 HG22 ' H ' ' A' ' 31' ' ' LEU . 3.4 mm 57.66 172.21 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-O 120.972 0.415 . . . . 0.0 111.199 179.943 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.665 ' H ' HG22 ' A' ' 30' ' ' ILE . 0.0 OUTLIER -173.78 151.12 1.78 Allowed 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.002 -0.544 . . . . 0.0 110.702 -179.184 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . 0.507 HG22 ' H ' ' A' ' 33' ' ' LEU . 0.8 OUTLIER -79.59 175.72 10.36 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.207 179.607 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.507 ' H ' HG22 ' A' ' 32' ' ' THR . 0.6 OUTLIER -173.08 173.07 3.76 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.009 0.433 . . . . 0.0 111.418 -179.788 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 1.3 tt -134.95 97.67 3.81 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.899 -0.591 . . . . 0.0 110.799 -179.944 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 9.8 m-20 62.2 -164.01 0.25 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.784 -179.924 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 4.4 m 69.56 43.36 1.01 Allowed 'General case' 0 N--CA 1.462 0.153 0 CA-C-O 120.897 0.38 . . . . 0.0 110.833 -179.891 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 54.0 m -110.14 -32.42 7.0 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.108 -0.497 . . . . 0.0 110.829 179.9 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 21.5 t-20 -113.54 -52.62 2.75 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.838 -179.981 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 4.6 ttmt -78.0 -58.37 3.3 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.902 179.947 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 19.4 m-20 -105.65 -176.12 2.99 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.854 179.976 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 41' ' ' TRP . . . . . 0.449 ' NE1' ' CZ2' ' A' ' 42' ' ' TRP . 11.9 p-90 -177.1 57.36 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.832 -179.972 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 42' ' ' TRP . . . . . 0.449 ' CZ2' ' NE1' ' A' ' 41' ' ' TRP . 1.8 m-90 -152.66 29.67 0.53 Allowed 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.982 -179.965 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 4.6 tttp -147.06 135.14 21.5 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.893 0.378 . . . . 0.0 111.165 -179.986 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . 0.593 ' CG2' HG22 ' A' ' 53' ' ' VAL . 25.2 m -155.94 -174.97 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.914 179.811 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 31.9 tt0 -145.38 87.35 1.8 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.911 0.386 . . . . 0.0 110.902 179.942 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 46' ' ' VAL . . . . . 0.445 HG22 ' HB2' ' A' ' 31' ' ' LEU . 20.1 t -80.11 -30.87 13.03 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.026 179.949 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 5.8 p30 -159.28 49.31 0.33 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.877 179.988 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 13.0 m-20 61.7 82.39 0.17 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.869 179.946 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -177.02 163.34 2.14 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.932 179.946 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 1.2 pt20 -69.93 86.12 0.52 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.814 179.919 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -58.34 152.81 28.89 Favored Glycine 0 C--N 1.332 0.351 0 C-N-CA 120.911 -0.661 . . . . 0.0 112.533 -179.967 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 3.8 m-85 -139.18 29.58 2.23 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.781 0.324 . . . . 0.0 110.911 179.896 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 53' ' ' VAL . . . . . 0.896 HG12 ' CD2' ' A' ' 15' ' ' TYR . 25.4 m -89.35 160.27 42.76 Favored Pre-proline 0 C--N 1.33 -0.278 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.965 -179.97 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 54' ' ' PRO . . . . . 0.445 ' HD3' ' CD1' ' A' ' 15' ' ' TYR . 53.1 Cg_exo -54.78 -63.11 0.22 Allowed 'Trans proline' 0 C--N 1.346 0.413 0 C-N-CA 122.609 2.206 . . . . 0.0 112.124 179.934 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 55' ' ' ALA . . . . . 0.453 ' C ' HG23 ' A' ' 58' ' ' VAL . . . 65.76 23.53 11.49 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.311 179.98 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . 0.447 ' O ' ' CG ' ' A' ' 57' ' ' TYR . . . -91.12 145.85 24.33 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.372 -0.376 . . . . 0.0 110.766 179.817 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 57' ' ' TYR . . . . . 0.691 ' CD2' HD13 ' A' ' 12' ' ' LEU . 36.7 p90 44.35 39.79 3.32 Favored 'General case' 0 N--CA 1.463 0.216 0 CA-C-O 120.918 0.39 . . . . 0.0 111.208 -179.823 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 58' ' ' VAL . . . . . 0.805 ' HA ' HD11 ' A' ' 12' ' ' LEU . 73.1 t -74.27 -80.96 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 115.976 -0.556 . . . . 0.0 111.11 -179.944 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . 0.465 ' CE ' HD21 ' A' ' 10' ' ' LEU . 60.0 mmtt -147.88 24.78 1.06 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.502 -0.317 . . . . 0.0 111.126 -179.837 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.464 0.226 0 CA-C-N 116.322 -0.399 . . . . 0.0 111.535 179.939 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . 0.583 HD22 HG13 ' A' ' 30' ' ' ILE . 0.4 OUTLIER . . . . . 0 C--O 1.232 0.134 0 CA-C-O 120.775 0.321 . . . . 0.0 110.831 . . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . 0.575 HG23 HD21 ' A' ' 33' ' ' LEU . 20.6 t -118.15 141.17 38.58 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.202 0 CA-C-N 116.277 -0.419 . . . . 0.0 111.253 -179.816 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . 0.736 HD23 HD13 ' A' ' 30' ' ' ILE . 1.4 mt -99.17 -26.76 14.09 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.88 179.822 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . 0.737 ' HB1' ' OD1' ' A' ' 14' ' ' ASP . . . 65.27 51.71 1.57 Allowed 'General case' 0 C--N 1.333 -0.145 0 CA-C-N 116.209 -0.45 . . . . 0.0 111.124 -179.918 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.699 ' CD1' HG13 ' A' ' 58' ' ' VAL . 1.3 mp -56.96 124.89 20.23 Favored 'General case' 0 C--O 1.233 0.191 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.872 179.943 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 3.3 m-85 61.87 63.02 1.17 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.835 -179.89 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . 0.737 ' OD1' ' HB1' ' A' ' 11' ' ' ALA . 13.5 m-20 -60.73 -80.83 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.012 179.98 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' TYR . . . . . 0.446 ' CD2' ' HE3' ' A' ' 26' ' ' LYS . 0.1 OUTLIER 61.84 -165.27 0.23 Allowed 'General case' 0 C--N 1.332 -0.165 0 CA-C-N 116.412 -0.358 . . . . 0.0 110.908 179.987 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -69.91 -170.26 0.32 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.888 179.946 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . 0.519 ' HB2' HG23 ' A' ' 23' ' ' VAL . 0.0 OUTLIER . . . . . 0 C--N 1.329 -0.29 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.901 179.906 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 5.5 pm0 . . . . . 0 C--O 1.232 0.14 0 CA-C-O 120.737 0.303 . . . . 0.0 110.961 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . 0.535 HG11 ' HA ' ' A' ' 53' ' ' VAL . 7.9 t -139.65 161.03 27.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.916 -179.938 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . 0.779 HG23 ' HG3' ' A' ' 25' ' ' MET . 12.4 t -149.2 -161.78 1.42 Allowed 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.907 -179.9 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' MET . . . . . 0.779 ' HG3' HG23 ' A' ' 24' ' ' THR . 0.0 OUTLIER 75.73 174.37 0.24 Allowed 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.84 0.353 . . . . 0.0 111.079 179.974 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . 0.446 ' HE3' ' CD2' ' A' ' 15' ' ' TYR . 0.0 OUTLIER -176.8 -164.83 0.11 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.877 179.985 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 2.0 mtpm? 62.97 165.92 0.12 Allowed 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.944 -179.947 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -63.43 -121.8 0.01 OUTLIER Glycine 0 N--CA 1.451 -0.334 0 C-N-CA 120.724 -0.751 . . . . 0.0 112.54 -179.972 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER 62.95 144.99 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.792 0.33 . . . . 0.0 110.987 -179.896 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . 0.736 HD13 HD23 ' A' ' 10' ' ' LEU . 10.6 mm -85.4 163.27 2.73 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.354 -0.385 . . . . 0.0 110.998 179.989 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 1.061 HD22 HG11 ' A' ' 44' ' ' VAL . 0.2 OUTLIER -130.31 -106.07 0.28 Allowed 'General case' 0 CA--C 1.537 0.476 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.885 -179.891 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . 0.455 HG22 ' N ' ' A' ' 33' ' ' LEU . 51.9 m -168.51 161.95 11.91 Favored 'General case' 0 N--CA 1.462 0.132 0 CA-C-O 120.83 0.348 . . . . 0.0 110.819 179.909 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.575 HD21 HG23 ' A' ' 9' ' ' VAL . 0.1 OUTLIER -149.49 -170.08 3.54 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.916 179.914 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.736 ' O ' HD12 ' A' ' 34' ' ' LEU . 1.0 OUTLIER -150.12 102.84 3.13 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.909 179.868 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 77.9 m-20 62.58 -80.12 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.937 -179.895 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 1.2 m 62.72 150.27 0.03 OUTLIER 'General case' 0 C--N 1.333 -0.144 0 CA-C-O 120.917 0.389 . . . . 0.0 111.018 179.882 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 1.4 t -145.82 -47.93 0.21 Allowed 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.688 179.873 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 51.9 p-10 -100.47 -161.6 0.88 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.526 179.771 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . 0.409 ' O ' ' CD1' ' A' ' 41' ' ' TRP . 0.0 OUTLIER -47.72 97.77 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.916 0.389 . . . . 0.0 111.004 179.922 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 6.7 p-10 -69.14 122.9 19.73 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.213 -179.719 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 41' ' ' TRP . . . . . 0.429 ' CE3' ' HA ' ' A' ' 42' ' ' TRP . 49.2 p-90 -177.12 -35.03 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.291 179.905 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 42' ' ' TRP . . . . . 0.461 ' CE3' ' N ' ' A' ' 42' ' ' TRP . 0.0 OUTLIER -46.82 -96.84 0.0 OUTLIER 'General case' 0 CA--C 1.535 0.387 0 CA-C-N 116.399 -0.364 . . . . 0.0 111.935 -179.305 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 10.9 tttp -89.29 128.38 35.86 Favored 'General case' 0 C--N 1.334 -0.092 0 CA-C-O 120.849 0.357 . . . . 0.0 111.042 -179.836 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . 1.061 HG11 HD22 ' A' ' 31' ' ' LEU . 40.3 t -114.15 -31.89 2.04 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.051 -179.995 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 5.2 tm-20 62.99 33.58 14.73 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.946 -179.991 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 46' ' ' VAL . . . . . 0.643 HG11 ' HE1' ' A' ' 25' ' ' MET . 10.2 p -84.28 151.92 3.81 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.041 179.93 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 2.1 t-20 -62.92 166.65 5.45 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.998 -179.973 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 9.3 m-20 61.08 24.56 14.65 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.125 -0.488 . . . . 0.0 111.11 179.932 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 49' ' ' ARG . . . . . 0.671 ' CG ' HG22 ' A' ' 24' ' ' THR . 0.0 OUTLIER 177.46 -170.02 0.08 Allowed 'General case' 0 C--N 1.333 -0.129 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.748 179.896 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 1.7 tt0 -103.52 -57.34 2.05 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.856 179.972 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 145.93 90.2 0.1 OUTLIER Glycine 0 C--N 1.332 0.331 0 C-N-CA 120.917 -0.659 . . . . 0.0 112.555 -179.986 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 52' ' ' PHE . . . . . 0.495 ' O ' HG21 ' A' ' 23' ' ' VAL . 22.0 m-85 -164.23 31.28 0.07 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.735 0.302 . . . . 0.0 110.953 179.991 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 53' ' ' VAL . . . . . 1.013 HG22 HG21 ' A' ' 44' ' ' VAL . 19.0 m -62.24 129.74 92.47 Favored Pre-proline 0 C--N 1.329 -0.295 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.999 179.92 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 54' ' ' PRO . . . . . 0.411 ' O ' ' HB3' ' A' ' 55' ' ' ALA . 52.2 Cg_exo -55.17 -47.42 26.38 Favored 'Trans proline' 0 C--N 1.349 0.567 0 C-N-CA 122.43 2.087 . . . . 0.0 112.266 179.983 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 55' ' ' ALA . . . . . 0.411 ' HB3' ' O ' ' A' ' 54' ' ' PRO . . . 67.49 -70.97 0.11 Allowed 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.035 -179.992 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . 63.06 -80.29 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.211 -0.449 . . . . 0.0 111.189 -179.981 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 32.8 p90 -131.01 128.97 41.43 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.809 179.926 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 58' ' ' VAL . . . . . 0.699 HG13 ' CD1' ' A' ' 12' ' ' LEU . 36.6 t -152.36 -70.99 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.165 -179.884 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . 0.588 ' HG3' HG12 ' A' ' 58' ' ' VAL . 11.3 mtmt -144.59 -68.02 0.32 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.891 -179.875 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 7.3 pttt . . . . . 0 C--N 1.328 -0.33 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.993 -179.89 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . 0.826 HD22 HG21 ' A' ' 30' ' ' ILE . 9.7 mt . . . . . 0 C--O 1.231 0.122 0 CA-C-O 120.861 0.362 . . . . 0.0 110.901 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . 0.622 ' HB ' HD21 ' A' ' 31' ' ' LEU . 11.0 t -146.08 80.78 0.13 Allowed 'Isoleucine or valine' 0 C--O 1.232 0.176 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.116 -179.914 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . 0.829 ' O ' HG11 ' A' ' 58' ' ' VAL . 0.7 OUTLIER -62.1 -177.23 0.12 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.391 -0.368 . . . . 0.0 110.903 179.95 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -87.37 -27.58 22.71 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.283 -179.798 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.655 ' CD1' HD11 ' A' ' 10' ' ' LEU . 4.6 tp 75.1 -62.97 0.43 Allowed 'General case' 0 N--CA 1.464 0.249 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.803 -179.983 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . 0.54 ' OH ' ' HB3' ' A' ' 56' ' ' ALA . 0.1 OUTLIER -136.45 34.26 2.74 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.82 179.909 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 2.4 p30 46.88 -174.43 0.01 OUTLIER 'General case' 0 N--CA 1.463 0.194 0 CA-C-N 115.978 -0.555 . . . . 0.0 111.629 179.938 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' TYR . . . . . 0.431 ' CE1' ' HD2' ' A' ' 54' ' ' PRO . 7.0 t80 -119.41 -26.87 5.71 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 116.094 -0.503 . . . . 0.0 111.245 -179.862 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 8.3 tt0 64.85 120.02 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 120.95 0.405 . . . . 0.0 110.75 -179.759 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 26.9 pt-20 . . . . . 0 C--N 1.33 -0.273 0 CA-C-N 116.233 -0.439 . . . . 0.0 111.024 -179.992 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 4.9 mm-40 . . . . . 0 C--O 1.231 0.121 0 CA-C-O 120.837 0.351 . . . . 0.0 110.974 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 17.7 t -124.62 150.68 29.56 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.156 -0.474 . . . . 0.0 111.187 -179.972 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 10.3 t -140.82 -169.04 2.72 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.884 179.909 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' MET . . . . . 0.642 ' CE ' HG11 ' A' ' 53' ' ' VAL . 7.2 ptp -167.34 62.32 0.08 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.936 179.971 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 13.1 mmtt -61.63 166.21 4.4 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.88 -179.994 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 3.3 ttpt 60.4 -169.66 0.15 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.837 179.913 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -95.78 35.79 4.15 Favored Glycine 0 N--CA 1.45 -0.403 0 C-N-CA 120.805 -0.712 . . . . 0.0 112.55 179.927 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . 0.639 ' C ' HD13 ' A' ' 30' ' ' ILE . 12.4 p30 -57.79 172.16 0.42 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.713 0.292 . . . . 0.0 110.891 -179.971 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . 0.826 HG21 HD22 ' A' ' 8' ' ' LEU . 0.2 OUTLIER -123.13 -172.33 0.73 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.012 -179.862 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.825 ' HB3' HG22 ' A' ' 46' ' ' VAL . 0.0 OUTLIER -149.55 -177.01 5.63 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.815 -179.833 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . 0.759 ' O ' HD12 ' A' ' 33' ' ' LEU . 15.4 t -104.26 -47.0 4.26 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.072 -179.928 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.759 HD12 ' O ' ' A' ' 32' ' ' THR . 0.2 OUTLIER 66.5 152.78 0.07 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.785 179.924 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 14.8 tp -57.95 -62.29 1.92 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.888 179.958 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 34.4 t30 -147.05 -76.95 0.18 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.83 179.861 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER 172.86 127.35 0.02 OUTLIER 'General case' 0 N--CA 1.462 0.125 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.942 179.932 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 37' ' ' THR . . . . . 0.553 HG21 ' CH2' ' A' ' 42' ' ' TRP . 3.2 t 179.34 127.11 0.07 Allowed 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.801 179.981 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 25.2 m-80 -59.4 -82.35 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.886 179.966 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 2.4 tttp 46.9 -166.71 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.797 0.332 . . . . 0.0 111.204 179.804 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 40' ' ' ASP . . . . . 0.528 ' O ' ' HB3' ' A' ' 41' ' ' TRP . 1.5 t0 -96.41 85.07 3.83 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.88 179.733 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 41' ' ' TRP . . . . . 0.528 ' HB3' ' O ' ' A' ' 40' ' ' ASP . 0.0 OUTLIER 85.39 170.95 0.07 Allowed 'General case' 0 N--CA 1.466 0.367 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.788 -179.806 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 42' ' ' TRP . . . . . 0.553 ' CH2' HG21 ' A' ' 37' ' ' THR . 6.3 t-105 -155.87 141.43 17.8 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.864 -179.93 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 23.3 mttp -58.4 111.6 1.28 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.949 -179.943 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . 0.591 HG12 ' CG2' ' A' ' 46' ' ' VAL . 23.1 t -99.1 76.46 0.65 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.189 -0.46 . . . . 0.0 111.12 179.971 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . 0.428 ' C ' HG23 ' A' ' 46' ' ' VAL . 3.1 tm-20 -66.28 -58.3 5.66 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.847 179.957 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 46' ' ' VAL . . . . . 0.825 HG22 ' HB3' ' A' ' 31' ' ' LEU . 2.5 t 68.33 30.1 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.029 179.915 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 8.8 m120 63.39 35.1 12.44 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.94 179.959 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 1.2 t70 -179.33 167.21 1.5 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.91 179.844 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 25.3 mmm180 55.42 -165.95 0.11 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.025 179.991 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 5.8 mm-40 -80.61 -74.67 0.3 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.95 -179.965 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 153.73 -22.95 0.72 Allowed Glycine 0 C--N 1.333 0.415 0 C-N-CA 120.846 -0.692 . . . . 0.0 112.592 -179.965 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 42.9 m-85 -55.89 96.35 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 120.817 0.341 . . . . 0.0 111.128 -179.975 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 53' ' ' VAL . . . . . 0.642 HG11 ' CE ' ' A' ' 25' ' ' MET . 12.2 t -150.82 92.88 3.8 Favored Pre-proline 0 C--N 1.328 -0.36 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.046 179.9 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 54' ' ' PRO . . . . . 0.431 ' HD2' ' CE1' ' A' ' 15' ' ' TYR . 51.3 Cg_exo -53.12 87.46 0.03 OUTLIER 'Trans proline' 0 C--N 1.345 0.365 0 C-N-CA 122.617 2.211 . . . . 0.0 112.386 -179.971 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -60.32 -25.39 65.75 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.047 179.928 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . 0.54 ' HB3' ' OH ' ' A' ' 13' ' ' TYR . . . 64.48 -78.09 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.19 -179.915 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 57' ' ' TYR . . . . . 0.463 ' O ' HD22 ' A' ' 12' ' ' LEU . 47.2 p90 -161.47 127.68 3.8 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.028 179.955 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 58' ' ' VAL . . . . . 0.829 HG11 ' O ' ' A' ' 10' ' ' LEU . 24.2 t -145.78 126.82 7.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.018 179.853 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . 0.729 ' HE2' HD23 ' A' ' 10' ' ' LEU . 8.9 mmtt 60.56 -167.82 0.18 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.756 -179.868 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 20.4 mttt . . . . . 0 C--N 1.329 -0.299 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.999 -179.972 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.232 0.143 0 CA-C-O 120.879 0.371 . . . . 0.0 110.879 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . 0.956 HG23 HD11 ' A' ' 31' ' ' LEU . 15.1 m -150.82 44.34 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.218 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.046 179.942 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . 0.529 HD13 ' O ' ' A' ' 28' ' ' GLY . 0.8 OUTLIER -51.08 113.94 1.06 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.12 -179.899 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . 0.763 ' HB3' ' OD2' ' A' ' 14' ' ' ASP . . . -56.45 94.11 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.185 -0.462 . . . . 0.0 111.03 179.866 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.756 HD13 ' CE1' ' A' ' 57' ' ' TYR . 0.6 OUTLIER -55.0 -24.93 26.62 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.184 -179.958 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -138.17 84.9 2.06 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.398 -0.364 . . . . 0.0 111.069 -179.959 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . 0.763 ' OD2' ' HB3' ' A' ' 11' ' ' ALA . 2.1 m-20 -81.35 -160.2 0.32 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.623 179.711 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' TYR . . . . . 0.437 ' CD1' ' HB ' ' A' ' 24' ' ' THR . 0.9 OUTLIER 76.77 -164.8 0.05 Allowed 'General case' 0 N--CA 1.464 0.266 0 CA-C-O 120.76 0.314 . . . . 0.0 111.032 179.745 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 5.3 mt-30 75.6 -67.48 0.24 Allowed 'General case' 0 C--N 1.333 -0.129 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.787 -179.769 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 6.6 tt0 . . . . . 0 C--N 1.33 -0.248 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.014 179.933 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 2.1 mt-10 . . . . . 0 C--O 1.231 0.104 0 CA-C-O 120.83 0.348 . . . . 0.0 110.968 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . 0.545 HG22 ' HB2' ' A' ' 49' ' ' ARG . 7.4 t -132.48 154.94 40.83 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.02 179.904 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . 0.437 ' HB ' ' CD1' ' A' ' 15' ' ' TYR . 0.7 OUTLIER -105.6 -77.7 0.58 Allowed 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.217 -179.883 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER 47.77 -174.34 0.01 OUTLIER 'General case' 0 CA--C 1.53 0.188 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.432 -179.815 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -178.23 104.72 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.299 -0.409 . . . . 0.0 110.894 -179.935 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 9.7 ptpp? 178.84 165.45 0.87 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.828 179.864 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . 0.529 ' O ' HD13 ' A' ' 10' ' ' LEU . . . -95.21 23.0 35.46 Favored Glycine 0 N--CA 1.45 -0.417 0 C-N-CA 120.773 -0.727 . . . . 0.0 112.519 179.941 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 10.7 m-20 -72.29 165.15 25.04 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.736 0.303 . . . . 0.0 110.788 179.945 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . 0.536 HG22 ' H ' ' A' ' 31' ' ' LEU . 5.4 mm -86.24 167.25 1.83 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.078 180.0 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.956 HD11 HG23 ' A' ' 9' ' ' VAL . 0.0 OUTLIER -153.11 166.44 32.46 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.78 -179.719 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . 0.43 HG22 ' N ' ' A' ' 33' ' ' LEU . 76.5 m -103.71 160.14 15.02 Favored 'General case' 0 N--CA 1.462 0.13 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.043 -179.97 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.574 HD21 HG21 ' A' ' 9' ' ' VAL . 5.0 mt -122.93 -169.83 1.99 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.938 -179.94 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 27.9 tp -161.51 86.33 0.66 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.831 179.976 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 3.3 m120 61.62 81.83 0.18 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.82 179.929 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 13.2 p -125.24 -79.24 0.61 Allowed 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.961 179.966 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 51.9 m 62.39 145.1 0.02 OUTLIER 'General case' 0 C--N 1.333 -0.152 0 CA-C-N 116.231 -0.441 . . . . 0.0 111.078 179.993 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER 56.69 168.77 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.054 179.894 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 5.1 mmtm 59.0 -111.78 0.57 Allowed 'General case' 0 CA--C 1.534 0.335 0 CA-C-N 116.086 -0.507 . . . . 0.0 110.898 179.994 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 59.9 t0 -178.46 -68.6 0.01 OUTLIER 'General case' 0 C--O 1.231 0.085 0 CA-C-O 120.829 0.347 . . . . 0.0 110.867 179.99 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 41' ' ' TRP . . . . . . . . . . . . . 43.0 p90 -73.99 125.41 28.2 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.867 -179.974 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 42' ' ' TRP . . . . . 0.404 ' CE3' ' HA ' ' A' ' 42' ' ' TRP . 4.8 m95 -167.59 81.18 0.19 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.911 -179.951 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 7.9 mtpp 58.29 91.01 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.027 179.968 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . 0.807 HG13 HD23 ' A' ' 31' ' ' LEU . 18.8 t -89.73 139.65 17.15 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.111 179.937 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 1.3 pt-20 -160.54 137.63 9.15 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.889 179.943 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 46' ' ' VAL . . . . . 0.489 HG13 ' N ' ' A' ' 47' ' ' ASN . 12.4 p -156.43 -45.61 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.32 -0.4 . . . . 0.0 111.156 -179.919 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 47' ' ' ASN . . . . . 0.489 ' N ' HG13 ' A' ' 46' ' ' VAL . 2.1 t-20 -178.09 37.91 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.91 -179.923 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 46.2 m-20 -136.12 -70.04 0.48 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.951 179.986 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 49' ' ' ARG . . . . . 0.545 ' HB2' HG22 ' A' ' 23' ' ' VAL . 31.6 mtp85 -157.64 -177.63 6.73 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.838 179.931 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 10.5 mm-40 -112.38 140.32 47.2 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.931 179.997 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 136.82 153.69 6.52 Favored Glycine 0 C--N 1.332 0.338 0 C-N-CA 120.956 -0.64 . . . . 0.0 112.497 179.956 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 13.0 p90 -59.36 158.98 8.5 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.768 0.318 . . . . 0.0 110.998 -179.971 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 53' ' ' VAL . . . . . 0.658 ' HB ' HG21 ' A' ' 44' ' ' VAL . 22.0 t -147.97 139.31 13.66 Favored Pre-proline 0 C--N 1.328 -0.33 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.151 -179.844 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 50.8 Cg_exo -53.41 101.35 0.06 OUTLIER 'Trans proline' 0 C--N 1.347 0.481 0 C-N-CA 122.535 2.157 . . . . 0.0 112.191 179.944 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -55.84 -41.8 74.83 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.112 -0.494 . . . . 0.0 111.101 179.998 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . 0.413 ' O ' ' CD2' ' A' ' 57' ' ' TYR . . . 52.19 53.21 12.83 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.18 -0.463 . . . . 0.0 111.131 179.981 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 57' ' ' TYR . . . . . 0.756 ' CE1' HD13 ' A' ' 12' ' ' LEU . 0.0 OUTLIER 63.16 119.65 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.611 -179.814 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 58' ' ' VAL . . . . . 0.708 ' HA ' HD12 ' A' ' 12' ' ' LEU . 0.5 OUTLIER -131.07 -168.54 0.58 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.826 -179.758 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . 0.638 ' N ' HG13 ' A' ' 58' ' ' VAL . 0.0 OUTLIER -49.85 -77.14 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.791 0.329 . . . . 0.0 111.13 -179.93 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.33 -0.241 0 CA-C-N 116.352 -0.385 . . . . 0.0 110.905 179.979 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.232 0.152 0 CA-C-O 120.712 0.291 . . . . 0.0 110.825 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . 0.713 HG22 ' HE3' ' A' ' 59' ' ' LYS . 5.1 t 63.64 134.25 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.236 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.111 179.796 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . 0.641 HD23 ' N ' ' A' ' 10' ' ' LEU . 0.2 OUTLIER -130.04 144.88 51.58 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.737 179.853 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . 0.736 ' HB1' ' CE1' ' A' ' 13' ' ' TYR . . . -62.92 80.74 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.422 -179.832 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.721 ' H ' HG23 ' A' ' 58' ' ' VAL . 2.1 mt -103.25 32.05 3.97 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.789 179.942 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . 0.736 ' CE1' ' HB1' ' A' ' 11' ' ' ALA . 0.0 OUTLIER -86.46 -60.04 2.11 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.384 -0.371 . . . . 0.0 110.43 179.522 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . 0.445 ' HA ' ' HA ' ' A' ' 26' ' ' LYS . 58.6 t0 50.21 89.3 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.177 179.798 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' TYR . . . . . 0.662 ' CB ' HG21 ' A' ' 24' ' ' THR . 0.5 OUTLIER -129.34 -78.62 0.56 Allowed 'General case' 0 C--N 1.332 -0.155 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.095 179.787 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' GLN . . . . . 0.415 ' CB ' ' O ' ' A' ' 15' ' ' TYR . 0.0 OUTLIER 164.09 177.58 0.02 OUTLIER 'General case' 0 N--CA 1.465 0.301 0 CA-C-O 120.817 0.342 . . . . 0.0 110.795 179.979 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 57.1 mt-10 . . . . . 0 C--N 1.328 -0.351 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.111 179.907 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.231 0.114 0 CA-C-O 120.784 0.326 . . . . 0.0 110.953 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . 0.75 HG11 ' HB3' ' A' ' 49' ' ' ARG . 0.9 OUTLIER -150.21 -68.36 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.201 179.99 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . 0.662 HG21 ' CB ' ' A' ' 15' ' ' TYR . 0.3 OUTLIER 56.79 178.95 0.04 OUTLIER 'General case' 0 C--O 1.232 0.151 0 CA-C-N 116.11 -0.495 . . . . 0.0 111.062 -179.852 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -178.87 -173.57 0.31 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.856 -179.803 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . 0.445 ' HA ' ' HA ' ' A' ' 14' ' ' ASP . 0.0 OUTLIER -138.25 -173.05 3.42 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.007 179.946 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 5.1 ttpm? 63.43 120.66 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.015 -0.539 . . . . 0.0 111.002 179.901 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -58.82 -86.13 0.03 OUTLIER Glycine 0 N--CA 1.452 -0.242 0 C-N-CA 120.701 -0.761 . . . . 0.0 112.437 179.816 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 2.1 t0 49.05 28.58 2.11 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.806 0.336 . . . . 0.0 111.129 179.935 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . 0.577 HG22 ' H ' ' A' ' 31' ' ' LEU . 4.6 mm 58.98 168.42 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.091 -179.975 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.899 ' HB2' HG22 ' A' ' 46' ' ' VAL . 0.0 OUTLIER -157.15 -175.75 5.59 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.755 -179.635 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . 0.67 ' N ' HD22 ' A' ' 31' ' ' LEU . 86.7 m -126.27 161.72 27.11 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.976 179.941 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.508 ' CD2' HD21 ' A' ' 31' ' ' LEU . 2.3 mt -129.28 -170.11 2.22 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.2 -0.454 . . . . 0.0 111.011 -179.911 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.55 HD23 ' O ' ' A' ' 34' ' ' LEU . 9.3 tt -176.2 92.48 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.955 179.984 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 1.7 t30 61.27 89.8 0.07 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.891 -179.962 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 10.7 t -169.53 119.74 0.67 Allowed 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.861 179.965 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -122.94 170.36 10.2 Favored 'General case' 0 N--CA 1.462 0.129 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.827 -179.969 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 8.3 m-80 64.09 -79.09 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.979 179.984 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -73.71 170.33 15.47 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.856 179.938 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 40' ' ' ASP . . . . . 0.458 ' HB2' HG11 ' A' ' 58' ' ' VAL . 11.2 p30 -132.47 39.02 3.41 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.905 -179.99 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 41' ' ' TRP . . . . . 0.42 ' CD1' ' HA ' ' A' ' 56' ' ' ALA . 41.9 p-90 -159.3 31.65 0.2 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.0 -0.546 . . . . 0.0 110.684 179.942 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 42' ' ' TRP . . . . . . . . . . . . . 21.8 m95 -71.36 -47.76 54.38 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.086 -0.506 . . . . 0.0 111.138 -179.806 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 1.7 ttpm? -167.05 90.4 0.37 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.458 -0.337 . . . . 0.0 111.275 -179.852 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . 0.792 HG13 HD23 ' A' ' 31' ' ' LEU . 23.3 t -98.82 136.32 30.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.295 -0.412 . . . . 0.0 110.78 179.444 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . 0.425 ' C ' HG23 ' A' ' 46' ' ' VAL . 0.3 OUTLIER -110.89 -67.53 0.99 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.092 -179.651 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 46' ' ' VAL . . . . . 0.899 HG22 ' HB2' ' A' ' 31' ' ' LEU . 4.1 t 74.41 75.86 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 116.361 -0.381 . . . . 0.0 111.077 -179.817 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 36.6 m-20 68.6 -67.6 0.2 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.952 -179.99 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 1.2 t0 -121.9 -164.58 1.17 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.805 179.982 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 49' ' ' ARG . . . . . 0.75 ' HB3' HG11 ' A' ' 23' ' ' VAL . 0.2 OUTLIER 67.47 140.11 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.35 -0.386 . . . . 0.0 110.837 -179.993 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -69.3 -169.25 0.19 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.947 -179.967 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -80.44 -158.45 17.89 Favored Glycine 0 C--N 1.334 0.429 0 C-N-CA 120.95 -0.643 . . . . 0.0 112.425 -179.942 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 2.2 m-85 59.74 108.88 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.83 0.348 . . . . 0.0 110.821 -179.978 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 53' ' ' VAL . . . . . 0.774 HG21 ' HB ' ' A' ' 44' ' ' VAL . 62.8 t -143.12 100.84 5.31 Favored Pre-proline 0 C--N 1.328 -0.327 0 CA-C-N 116.266 -0.425 . . . . 0.0 111.196 -179.821 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 54' ' ' PRO . . . . . 0.595 ' O ' ' HB3' ' A' ' 55' ' ' ALA . 31.1 Cg_exo -59.47 -148.85 0.01 OUTLIER 'Trans proline' 0 C--N 1.347 0.467 0 C-N-CA 122.977 2.451 . . . . 0.0 111.966 179.931 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 55' ' ' ALA . . . . . 0.595 ' HB3' ' O ' ' A' ' 54' ' ' PRO . . . 81.06 -39.02 0.14 Allowed 'General case' 0 C--O 1.232 0.155 0 CA-C-O 120.818 0.342 . . . . 0.0 110.651 -179.299 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . 0.437 ' HB3' ' O ' ' A' ' 55' ' ' ALA . . . 68.52 -75.31 0.07 Allowed 'General case' 0 N--CA 1.453 -0.28 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.152 179.674 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 57' ' ' TYR . . . . . 0.437 ' HE1' ' HB1' ' A' ' 55' ' ' ALA . 0.1 OUTLIER -54.08 160.89 1.4 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.893 179.91 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 58' ' ' VAL . . . . . 0.721 HG23 ' H ' ' A' ' 12' ' ' LEU . 6.6 p -179.89 -47.92 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.025 179.925 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . 0.713 ' HE3' HG22 ' A' ' 9' ' ' VAL . 0.0 OUTLIER -179.58 178.22 0.67 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.474 -0.33 . . . . 0.0 110.826 179.459 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 7.4 ttpp . . . . . 0 C--N 1.329 -0.293 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.868 179.953 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . 0.886 ' O ' HG22 ' A' ' 9' ' ' VAL . 1.6 mt . . . . . 0 CA--C 1.527 0.079 0 CA-C-O 120.468 0.175 . . . . 0.0 110.919 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . 0.886 HG22 ' O ' ' A' ' 8' ' ' LEU . 1.0 OUTLIER 76.59 33.29 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.466 0.35 0 CA-C-N 115.982 -0.554 . . . . 0.0 111.441 -179.837 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . 0.587 ' H ' HD23 ' A' ' 10' ' ' LEU . 0.4 OUTLIER -44.99 111.59 0.34 Allowed 'General case' 0 N--CA 1.463 0.181 0 CA-C-N 115.962 -0.563 . . . . 0.0 111.2 179.69 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . 0.852 ' HB1' ' HB2' ' A' ' 55' ' ' ALA . . . -53.11 98.94 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 116.037 -0.529 . . . . 0.0 111.191 -179.931 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.775 HD13 ' CZ ' ' A' ' 57' ' ' TYR . 0.5 OUTLIER -52.04 157.54 1.28 Allowed 'General case' 0 C--O 1.231 0.129 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.854 -179.938 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 1.2 m-85 67.95 -70.71 0.12 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.778 -179.809 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . 0.446 ' HB3' ' HA ' ' A' ' 26' ' ' LYS . 0.8 OUTLIER 56.8 104.42 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.915 -179.991 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 0.7 OUTLIER -96.08 -175.68 3.46 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.148 -179.698 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 16.6 pt20 -122.43 177.75 5.26 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.792 179.921 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . 0.509 ' HG2' ' HA ' ' A' ' 23' ' ' VAL . 0.3 OUTLIER . . . . . 0 C--N 1.33 -0.263 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.958 -179.898 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . 0.405 ' OE1' ' CE1' ' A' ' 52' ' ' PHE . 27.9 mm-40 . . . . . 0 C--O 1.232 0.139 0 CA-C-O 120.832 0.348 . . . . 0.0 110.886 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . 0.719 HG11 ' HB3' ' A' ' 49' ' ' ARG . 31.5 m -58.45 179.81 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.049 179.975 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . 0.518 HG23 ' HD2' ' A' ' 54' ' ' PRO . 0.2 OUTLIER -171.35 -165.93 0.43 Allowed 'General case' 0 N--CA 1.463 0.217 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.502 179.906 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' MET . . . . . 0.426 ' H ' HG22 ' A' ' 24' ' ' THR . 0.1 OUTLIER -177.3 117.16 0.1 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.422 -0.354 . . . . 0.0 110.878 179.878 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . 0.446 ' HA ' ' HB3' ' A' ' 14' ' ' ASP . 0.0 OUTLIER -58.84 -166.12 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.989 -179.83 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 22.6 mmtt 64.44 151.25 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.842 179.934 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -94.13 40.77 2.69 Favored Glycine 0 N--CA 1.451 -0.354 0 C-N-CA 120.772 -0.728 . . . . 0.0 112.504 -179.925 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 2.9 t0 -58.27 -176.98 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.691 0.281 . . . . 0.0 110.725 179.843 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . 0.579 HG22 ' H ' ' A' ' 31' ' ' LEU . 0.6 OUTLIER -103.9 -179.45 0.64 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-O 120.774 0.321 . . . . 0.0 111.026 179.97 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.75 ' N ' HD12 ' A' ' 31' ' ' LEU . 0.0 OUTLIER -150.68 -157.94 0.86 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.768 -179.376 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . 0.573 HG23 ' N ' ' A' ' 33' ' ' LEU . 9.8 t -131.84 -53.99 0.99 Allowed 'General case' 0 N--CA 1.462 0.133 0 CA-C-O 120.765 0.317 . . . . 0.0 111.526 -179.696 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 1.018 HD11 HG12 ' A' ' 44' ' ' VAL . 1.9 mm? 62.34 138.09 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.931 0.396 . . . . 0.0 111.179 -179.985 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.567 HD12 ' OE2' ' A' ' 45' ' ' GLU . 6.8 mp -68.35 -74.2 0.13 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.868 179.947 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 7.9 p30 -154.98 31.18 0.4 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.854 179.953 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 3.3 m -70.65 139.44 51.3 Favored 'General case' 0 C--N 1.333 -0.144 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.822 -179.979 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 35.0 m -161.88 69.24 0.29 Allowed 'General case' 0 C--N 1.332 -0.158 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.844 179.968 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 2.3 m120 -158.49 -175.23 5.2 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.93 -179.898 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 1.2 pttt -69.14 -171.18 0.3 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.904 -179.98 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 3.1 p30 46.68 -175.55 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.235 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.672 -179.922 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 41' ' ' TRP . . . . . 0.463 ' CG ' ' N ' ' A' ' 42' ' ' TRP . 0.0 OUTLIER -69.01 -171.67 0.33 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.082 -0.508 . . . . 0.0 111.068 -179.698 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 42' ' ' TRP . . . . . 0.463 ' N ' ' CG ' ' A' ' 41' ' ' TRP . 5.4 m95 -166.67 154.25 9.58 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.938 179.955 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 7.9 tttp -63.67 113.25 3.24 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.965 179.994 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . 1.018 HG12 HD11 ' A' ' 33' ' ' LEU . 16.4 m -103.27 -174.7 0.42 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.088 179.789 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . 0.567 ' OE2' HD12 ' A' ' 34' ' ' LEU . 12.5 pt-20 -175.79 93.26 0.06 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.914 0.388 . . . . 0.0 110.928 179.857 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 46' ' ' VAL . . . . . 0.483 HG13 ' N ' ' A' ' 47' ' ' ASN . 11.2 p -131.98 -44.9 0.65 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.12 179.931 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 47' ' ' ASN . . . . . 0.483 ' N ' HG13 ' A' ' 46' ' ' VAL . 10.9 p-10 -107.87 -172.15 2.01 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.784 179.985 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 59.7 m-20 -57.07 -75.73 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.899 179.976 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 49' ' ' ARG . . . . . 0.719 ' HB3' HG11 ' A' ' 23' ' ' VAL . 0.7 OUTLIER -80.28 108.52 13.96 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.775 179.93 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -158.49 -178.17 7.07 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.977 179.989 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 132.82 -7.06 5.19 Favored Glycine 0 CA--C 1.519 0.339 0 C-N-CA 120.935 -0.65 . . . . 0.0 112.754 -179.939 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 52' ' ' PHE . . . . . 0.405 ' CE1' ' OE1' ' A' ' 22' ' ' GLU . 58.9 m-85 -136.25 -80.85 0.4 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.662 0.267 . . . . 0.0 110.719 179.965 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 53' ' ' VAL . . . . . 0.607 HG21 HG21 ' A' ' 44' ' ' VAL . 30.2 t 50.34 97.66 0.04 OUTLIER Pre-proline 0 C--N 1.332 -0.187 0 CA-C-N 116.414 -0.357 . . . . 0.0 111.497 179.725 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 54' ' ' PRO . . . . . 0.518 ' HD2' HG23 ' A' ' 24' ' ' THR . 84.8 Cg_exo -47.17 -59.93 1.07 Allowed 'Trans proline' 0 C--N 1.347 0.481 0 C-N-CA 122.615 2.21 . . . . 0.0 112.48 179.958 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 55' ' ' ALA . . . . . 0.852 ' HB2' ' HB1' ' A' ' 11' ' ' ALA . . . 63.12 17.03 9.85 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.543 -179.986 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . 54.26 -88.85 0.02 OUTLIER 'General case' 0 CA--C 1.531 0.222 0 CA-C-N 116.577 -0.283 . . . . 0.0 111.423 179.949 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 57' ' ' TYR . . . . . 0.775 ' CZ ' HD13 ' A' ' 12' ' ' LEU . 25.1 p90 -124.2 -23.5 4.52 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.651 -0.25 . . . . 0.0 111.504 -179.811 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 58' ' ' VAL . . . . . 0.714 HG12 ' O ' ' A' ' 57' ' ' TYR . 9.9 p 52.82 162.86 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.464 0.274 0 CA-C-O 121.04 0.448 . . . . 0.0 111.724 -179.912 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . 0.616 ' HD2' HD11 ' A' ' 12' ' ' LEU . 6.4 mmmt -73.01 -48.62 34.78 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.835 -179.772 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--N 1.33 -0.26 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.882 179.994 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . 0.672 HD12 ' O ' ' A' ' 8' ' ' LEU . 1.2 pp . . . . . 0 C--O 1.232 0.162 0 CA-C-O 120.963 0.411 . . . . 0.0 110.731 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . 0.486 HG12 ' N ' ' A' ' 10' ' ' LEU . 11.6 t 70.89 161.07 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.015 -179.871 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . 0.529 HD11 ' CD ' ' A' ' 59' ' ' LYS . 0.0 OUTLIER -144.49 -164.52 1.93 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.145 179.418 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . 0.639 ' C ' HD22 ' A' ' 12' ' ' LEU . . . -137.44 15.37 2.97 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.181 179.643 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.995 HD23 ' HB3' ' A' ' 56' ' ' ALA . 1.0 OUTLIER 65.65 -67.02 0.14 Allowed 'General case' 0 C--O 1.231 0.117 0 CA-C-O 120.953 0.406 . . . . 0.0 110.535 -179.756 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . 0.547 ' O ' ' HB1' ' A' ' 55' ' ' ALA . 6.6 p90 -156.02 170.24 22.6 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.967 -0.56 . . . . 0.0 110.398 179.609 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . 0.438 ' HB3' ' HA ' ' A' ' 26' ' ' LYS . 4.9 p-10 -46.53 159.67 0.09 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.379 -0.373 . . . . 0.0 111.081 179.729 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' TYR . . . . . 0.414 ' CE2' ' HD2' ' A' ' 54' ' ' PRO . 10.7 t80 -115.24 -35.99 4.5 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.387 -0.37 . . . . 0.0 111.151 -179.906 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER 64.99 143.62 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.773 -179.925 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 7.4 pt-20 . . . . . 0 C--N 1.33 -0.277 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.857 -179.975 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 69.9 mm-40 . . . . . 0 C--O 1.231 0.118 0 CA-C-O 120.814 0.34 . . . . 0.0 110.996 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . 0.456 HG12 ' HG3' ' A' ' 25' ' ' MET . 26.5 t -153.27 -48.51 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.002 179.911 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 99.1 m 63.27 -80.13 0.03 OUTLIER 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.007 -0.542 . . . . 0.0 111.072 179.91 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' MET . . . . . 0.751 ' SD ' HG21 ' A' ' 46' ' ' VAL . 0.2 OUTLIER 62.16 149.83 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.882 179.968 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . 0.438 ' HA ' ' HB3' ' A' ' 14' ' ' ASP . 0.0 OUTLIER -140.32 104.19 4.74 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.956 -179.943 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 4.0 mtpp 61.69 151.76 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.883 -179.945 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -62.76 -83.41 0.07 OUTLIER Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 120.597 -0.811 . . . . 0.0 112.359 179.851 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . 0.935 ' O ' HD13 ' A' ' 30' ' ' ILE . 30.1 m-20 52.19 -90.49 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.467 0.175 . . . . 0.0 111.1 -179.967 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . 0.935 HD13 ' O ' ' A' ' 29' ' ' ASP . 0.2 OUTLIER -147.1 -173.02 0.36 Allowed 'Isoleucine or valine' 0 C--O 1.232 0.143 0 CA-C-O 120.832 0.349 . . . . 0.0 110.892 179.896 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.918 HD22 HG21 ' A' ' 44' ' ' VAL . 0.1 OUTLIER -163.65 -98.13 0.02 OUTLIER 'General case' 0 CA--C 1.534 0.33 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.27 179.736 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . 0.63 HG22 ' N ' ' A' ' 33' ' ' LEU . 20.8 m -168.53 -95.75 0.01 OUTLIER 'General case' 0 CA--C 1.53 0.185 0 N-CA-C 110.495 -0.187 . . . . 0.0 110.495 179.182 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.63 ' N ' HG22 ' A' ' 32' ' ' THR . 0.4 OUTLIER 160.35 -66.1 0.0 OUTLIER 'General case' 0 N--CA 1.463 0.211 0 CA-C-O 120.872 0.368 . . . . 0.0 110.663 179.99 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.667 HD13 ' HG2' ' A' ' 45' ' ' GLU . 1.6 mp 63.91 -169.5 0.19 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.816 -179.836 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 4.1 m120 -57.06 125.96 25.05 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.005 -179.936 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 4.3 m -161.75 -44.55 0.04 OUTLIER 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.868 -179.909 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 10.2 p 55.98 31.4 17.88 Favored 'General case' 0 N--CA 1.463 0.2 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.962 -179.937 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 5.8 m-80 -177.65 -174.25 0.45 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.843 -179.954 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -114.23 86.04 2.34 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.853 179.951 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 40' ' ' ASP . . . . . 0.459 ' O ' ' N ' ' A' ' 42' ' ' TRP . 36.1 t70 -177.39 58.57 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.866 179.911 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 41' ' ' TRP . . . . . 0.427 ' CD1' ' N ' ' A' ' 41' ' ' TRP . 0.0 OUTLIER 43.85 -89.0 0.01 OUTLIER 'General case' 0 N--CA 1.467 0.386 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.521 179.894 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 42' ' ' TRP . . . . . 0.459 ' N ' ' O ' ' A' ' 40' ' ' ASP . 0.0 OUTLIER 67.76 -73.01 0.09 Allowed 'General case' 0 C--N 1.333 -0.151 0 CA-C-O 120.695 0.283 . . . . 0.0 110.919 179.952 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 4.1 ttpt -138.47 61.98 1.57 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.878 0.37 . . . . 0.0 111.02 -179.903 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . 0.983 HG13 HG22 ' A' ' 53' ' ' VAL . 1.5 p -100.41 139.22 22.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.703 179.768 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . 0.667 ' HG2' HD13 ' A' ' 34' ' ' LEU . 7.7 pt-20 -119.06 166.39 12.95 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.916 179.953 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 46' ' ' VAL . . . . . 0.904 HG22 ' HB3' ' A' ' 31' ' ' LEU . 16.1 t -129.18 84.78 0.84 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.292 -179.876 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER 58.9 107.57 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.975 179.885 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 6.3 p-10 43.38 73.47 0.14 Allowed 'General case' 0 N--CA 1.463 0.222 0 CA-C-N 116.065 -0.516 . . . . 0.0 111.514 179.891 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 12.9 mmm180 -146.42 -177.63 5.73 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.855 179.973 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 1.2 tp-100 -85.54 -69.23 0.67 Allowed 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.076 179.983 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 162.68 -175.79 39.04 Favored Glycine 0 C--N 1.333 0.412 0 C-N-CA 120.869 -0.681 . . . . 0.0 112.521 -179.975 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 52' ' ' PHE . . . . . 0.404 ' CD2' ' O ' ' A' ' 42' ' ' TRP . 0.7 OUTLIER 57.99 105.64 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.79 0.328 . . . . 0.0 110.943 179.997 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 53' ' ' VAL . . . . . 0.983 HG22 HG13 ' A' ' 44' ' ' VAL . 17.0 m -135.4 65.8 63.68 Favored Pre-proline 0 CA--C 1.532 0.275 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.313 179.84 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 54' ' ' PRO . . . . . 0.414 ' HD2' ' CE2' ' A' ' 15' ' ' TYR . 3.2 Cg_exo -74.75 52.99 3.1 Favored 'Trans proline' 0 C--N 1.346 0.432 0 C-N-CA 122.887 2.392 . . . . 0.0 112.048 179.9 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 55' ' ' ALA . . . . . 0.592 ' HB3' ' O ' ' A' ' 11' ' ' ALA . . . -59.96 -30.24 68.96 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 121.017 0.437 . . . . 0.0 110.825 179.8 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . 0.995 ' HB3' HD23 ' A' ' 12' ' ' LEU . . . -179.12 -163.04 0.05 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.9 -0.591 . . . . 0.0 111.018 179.999 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 57' ' ' TYR . . . . . 0.449 ' CD2' ' N ' ' A' ' 58' ' ' VAL . 48.3 p90 -59.12 -49.37 78.13 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.365 -179.737 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 58' ' ' VAL . . . . . 0.676 ' N ' HD21 ' A' ' 12' ' ' LEU . 8.5 t 72.24 155.63 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-O 120.894 0.378 . . . . 0.0 110.774 -179.673 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . 0.529 ' CD ' HD11 ' A' ' 10' ' ' LEU . 7.7 ptmt -57.63 176.57 0.13 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.98 -179.902 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 13.2 mmtm . . . . . 0 C--N 1.329 -0.305 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.829 179.926 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . 0.759 ' O ' HG13 ' A' ' 9' ' ' VAL . 2.0 tp . . . . . 0 C--O 1.231 0.132 0 CA-C-O 120.644 0.259 . . . . 0.0 110.93 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . 0.759 HG13 ' O ' ' A' ' 8' ' ' LEU . 0.0 OUTLIER 179.44 123.63 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.463 0.209 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.104 -179.95 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . 0.571 HD23 ' N ' ' A' ' 10' ' ' LEU . 0.1 OUTLIER -126.11 142.82 51.37 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.73 179.678 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . 0.677 ' HB3' ' HA2' ' A' ' 28' ' ' GLY . . . -52.07 -25.76 9.41 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.308 -0.405 . . . . 0.0 111.065 179.886 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.629 HD23 ' HA ' ' A' ' 58' ' ' VAL . 0.7 OUTLIER 67.8 -69.64 0.14 Allowed 'General case' 0 N--CA 1.461 0.115 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.868 179.914 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . 0.4 ' CD1' ' OH ' ' A' ' 57' ' ' TYR . 0.2 OUTLIER -73.34 -72.06 0.28 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.846 179.84 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . 0.434 ' O ' ' HG2' ' A' ' 25' ' ' MET . 2.2 p30 167.11 -60.39 0.0 OUTLIER 'General case' 0 N--CA 1.463 0.211 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.976 179.949 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' TYR . . . . . 0.469 ' CG ' ' HA ' ' A' ' 24' ' ' THR . 38.7 p90 -176.67 -163.54 0.1 Allowed 'General case' 0 N--CA 1.463 0.195 0 CA-C-O 120.856 0.36 . . . . 0.0 110.806 -179.779 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' GLN . . . . . 0.426 ' HG3' ' N ' ' A' ' 17' ' ' GLU . 26.5 pt20 -138.21 -47.47 0.53 Allowed 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.926 179.768 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . 0.433 ' HB2' ' CE2' ' A' ' 15' ' ' TYR . 2.9 tm-20 . . . . . 0 C--N 1.331 -0.237 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.038 -179.883 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 1.3 mt-10 . . . . . 0 N--CA 1.463 0.198 0 CA-C-O 120.941 0.401 . . . . 0.0 110.905 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . 0.692 HG22 ' N ' ' A' ' 24' ' ' THR . 1.1 p -178.28 -92.46 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.535 0.403 0 CA-C-N 116.013 -0.54 . . . . 0.0 110.666 179.61 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . 0.692 ' N ' HG22 ' A' ' 23' ' ' VAL . 2.1 t 39.59 81.83 0.02 OUTLIER 'General case' 0 N--CA 1.466 0.355 0 N-CA-C 111.929 0.344 . . . . 0.0 111.929 179.568 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' MET . . . . . 0.434 ' HG2' ' O ' ' A' ' 14' ' ' ASP . 0.0 OUTLIER -97.86 -25.98 14.84 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.413 -0.358 . . . . 0.0 111.377 -179.987 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . 0.417 ' H ' ' HB3' ' A' ' 15' ' ' TYR . 0.1 OUTLIER 61.85 152.47 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.351 -0.386 . . . . 0.0 111.219 179.817 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 23.6 mtmt 63.83 157.32 0.07 Allowed 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.073 -0.512 . . . . 0.0 111.185 179.73 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . 0.677 ' HA2' ' HB3' ' A' ' 11' ' ' ALA . . . -99.26 35.51 4.65 Favored Glycine 0 C--N 1.331 0.251 0 C-N-CA 120.845 -0.693 . . . . 0.0 112.376 179.923 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 63.4 m-20 -60.25 172.55 0.81 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.728 0.299 . . . . 0.0 110.771 179.951 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . 0.568 HG22 ' H ' ' A' ' 31' ' ' LEU . 12.8 mm -86.95 167.31 1.78 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.068 179.982 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.907 HD22 HG11 ' A' ' 44' ' ' VAL . 0.0 OUTLIER -158.13 -94.44 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.897 -179.458 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . 0.653 ' O ' HG13 ' A' ' 44' ' ' VAL . 3.4 t -179.65 -154.46 0.02 OUTLIER 'General case' 0 CA--C 1.53 0.201 0 N-CA-C 110.175 -0.305 . . . . 0.0 110.175 179.808 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.604 ' N ' HG23 ' A' ' 32' ' ' THR . 0.3 OUTLIER -169.7 115.19 0.54 Allowed 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.911 0.386 . . . . 0.0 111.102 179.723 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -59.51 107.28 0.56 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.713 179.848 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 4.2 t-20 65.95 -167.47 0.21 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.64 -179.858 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 3.6 m -62.71 169.57 3.05 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-N 116.332 -0.395 . . . . 0.0 110.835 -179.997 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 37' ' ' THR . . . . . 0.456 HG23 ' N ' ' A' ' 38' ' ' ASN . 9.2 t -107.95 -47.65 3.53 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.862 179.912 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 38' ' ' ASN . . . . . 0.456 ' N ' HG23 ' A' ' 37' ' ' THR . 50.9 t30 64.9 -73.36 0.06 Allowed 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.148 179.927 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . 0.406 ' N ' ' O ' ' A' ' 37' ' ' THR . 0.0 OUTLIER -176.66 38.7 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.404 -0.362 . . . . 0.0 110.878 -179.967 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 7.3 m-20 -129.17 153.67 47.5 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.163 -0.472 . . . . 0.0 110.98 -179.978 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 41' ' ' TRP . . . . . 0.462 ' CG ' ' N ' ' A' ' 42' ' ' TRP . 18.3 p90 -58.39 -48.41 80.73 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.876 -179.982 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 42' ' ' TRP . . . . . 0.462 ' N ' ' CG ' ' A' ' 41' ' ' TRP . 77.7 m95 61.75 139.69 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.099 -0.501 . . . . 0.0 111.151 179.912 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . 0.415 ' O ' ' N ' ' A' ' 45' ' ' GLU . 0.1 OUTLIER -56.45 -22.12 29.99 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.361 -179.863 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . 0.907 HG11 HD22 ' A' ' 31' ' ' LEU . 49.1 t 62.7 -77.89 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.228 0 CA-C-N 116.479 -0.328 . . . . 0.0 111.135 -179.908 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . 0.618 ' O ' HG22 ' A' ' 32' ' ' THR . 24.4 mt-10 71.93 161.46 0.24 Allowed 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.053 179.998 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 46' ' ' VAL . . . . . 0.767 HG22 ' OD1' ' A' ' 47' ' ' ASN . 11.2 p -174.46 -47.74 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.175 179.908 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 47' ' ' ASN . . . . . 0.767 ' OD1' HG22 ' A' ' 46' ' ' VAL . 0.6 OUTLIER 169.82 148.86 0.03 OUTLIER 'General case' 0 N--CA 1.463 0.212 0 CA-C-O 120.907 0.384 . . . . 0.0 111.042 179.885 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 44.6 m-20 55.43 25.64 7.95 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.035 -0.53 . . . . 0.0 111.356 179.72 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -165.53 -81.35 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.473 -0.33 . . . . 0.0 110.85 179.865 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . 0.415 ' HA ' ' CB ' ' A' ' 45' ' ' GLU . 2.1 tt0 52.24 94.18 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.457 179.79 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 133.86 128.03 2.81 Favored Glycine 0 C--N 1.333 0.38 0 C-N-CA 120.683 -0.77 . . . . 0.0 113.107 179.642 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 52' ' ' PHE . . . . . 0.406 ' O ' HG23 ' A' ' 53' ' ' VAL . 24.1 m-85 60.75 111.97 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.977 0.417 . . . . 0.0 111.746 179.393 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 53' ' ' VAL . . . . . 0.406 HG23 ' O ' ' A' ' 52' ' ' PHE . 76.9 t -157.73 90.93 2.3 Favored Pre-proline 0 C--N 1.329 -0.3 0 CA-C-N 115.861 -0.609 . . . . 0.0 110.285 179.499 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 31.6 Cg_exo -59.41 134.23 57.27 Favored 'Trans proline' 0 C--N 1.347 0.463 0 C-N-CA 122.797 2.331 . . . . 0.0 112.414 -179.544 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -99.96 63.3 1.18 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.782 179.625 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . 0.658 ' HB3' ' CE1' ' A' ' 57' ' ' TYR . . . -47.08 -29.73 2.35 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.156 -0.474 . . . . 0.0 111.262 -179.83 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 57' ' ' TYR . . . . . 0.658 ' CE1' ' HB3' ' A' ' 56' ' ' ALA . 0.0 OUTLIER -157.41 -74.84 0.09 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.375 179.922 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 58' ' ' VAL . . . . . 0.629 ' HA ' HD23 ' A' ' 12' ' ' LEU . 0.2 OUTLIER 52.48 -179.51 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.079 -0.51 . . . . 0.0 111.15 179.745 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . 0.528 ' H ' HG12 ' A' ' 58' ' ' VAL . 0.0 OUTLIER -85.06 153.11 22.94 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.91 -179.959 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 C--N 1.329 -0.319 0 CA-C-N 116.152 -0.477 . . . . 0.0 110.876 -179.993 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . 0.555 ' N ' HD22 ' A' ' 8' ' ' LEU . 3.1 mm? . . . . . 0 CA--C 1.521 -0.143 0 CA-C-O 121.017 0.437 . . . . 0.0 110.959 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . 0.783 HG21 HD11 ' A' ' 33' ' ' LEU . 23.4 m -151.93 -148.14 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.45 -0.454 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.595 -179.651 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . 0.692 HD22 ' CE ' ' A' ' 59' ' ' LYS . 0.9 OUTLIER -169.07 31.41 0.02 OUTLIER 'General case' 0 C--N 1.334 -0.082 0 CA-C-O 120.808 0.337 . . . . 0.0 111.173 -179.993 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . 61.07 -81.55 0.02 OUTLIER 'General case' 0 CA--C 1.529 0.15 0 CA-C-N 116.22 -0.446 . . . . 0.0 111.261 179.817 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.746 HD12 ' HA ' ' A' ' 58' ' ' VAL . 1.0 OUTLIER 64.81 -77.29 0.04 OUTLIER 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 116.387 -0.37 . . . . 0.0 110.853 -179.786 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . 0.465 ' HB2' ' HB3' ' A' ' 56' ' ' ALA . 1.2 m-85 -103.72 62.88 0.77 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 121.083 0.468 . . . . 0.0 110.606 179.775 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . 0.612 ' OD2' HD21 ' A' ' 31' ' ' LEU . 14.0 m-20 -126.38 70.23 1.24 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.042 -0.527 . . . . 0.0 111.075 -179.948 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' TYR . . . . . 0.415 ' CD2' ' O ' ' A' ' 15' ' ' TYR . 84.0 t80 -145.5 63.41 1.27 Allowed 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.893 -179.973 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER 179.15 170.86 0.92 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.924 179.926 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 27.8 tp10 . . . . . 0 C--N 1.331 -0.23 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.727 179.967 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 49.0 tt0 . . . . . 0 CA--C 1.526 0.047 0 CA-C-O 120.752 0.31 . . . . 0.0 110.956 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . 0.415 HG13 ' CG ' ' A' ' 47' ' ' ASN . 21.5 t -106.74 147.17 12.34 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.262 -0.427 . . . . 0.0 111.114 -179.971 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -178.76 107.54 0.04 OUTLIER 'General case' 0 C--N 1.333 -0.11 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.023 179.927 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -160.98 125.91 3.65 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.873 179.875 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 1.8 mmmm -128.89 -160.73 1.05 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.956 -179.675 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 5.0 tttm 78.89 -179.67 0.11 Allowed 'General case' 0 N--CA 1.464 0.229 0 CA-C-O 120.864 0.364 . . . . 0.0 110.953 -179.883 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -57.03 -20.12 33.18 Favored Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.934 -0.65 . . . . 0.0 112.896 -179.768 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -47.91 134.66 13.21 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.762 0.315 . . . . 0.0 111.202 -179.85 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . 0.608 HG23 ' C ' ' A' ' 9' ' ' VAL . 0.3 OUTLIER -104.92 -168.55 0.25 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.88 179.989 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 1.027 HD22 HG11 ' A' ' 44' ' ' VAL . 0.0 OUTLIER -146.04 -82.26 0.14 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.917 -179.808 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . 0.509 HG23 ' H ' ' A' ' 33' ' ' LEU . 0.7 OUTLIER 165.97 -56.67 0.0 OUTLIER 'General case' 0 N--CA 1.466 0.33 0 CA-C-O 120.893 0.378 . . . . 0.0 110.692 -179.939 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.783 HD11 HG21 ' A' ' 9' ' ' VAL . 0.3 OUTLIER 58.91 98.89 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.965 179.91 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.457 HD22 ' HD2' ' A' ' 43' ' ' LYS . 1.2 pt? -57.47 -167.19 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.977 179.929 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 7.0 p-10 -59.08 88.58 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.897 179.988 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 11.0 t -59.68 159.97 7.93 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.956 179.908 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 1.4 t -140.29 117.68 11.4 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.832 -179.986 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 16.4 m-80 -60.76 89.91 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.877 179.987 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -177.41 -39.78 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.835 179.953 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 9.1 p-10 -130.79 -175.4 3.65 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.958 -179.918 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 41' ' ' TRP . . . . . 0.479 ' O ' ' CG ' ' A' ' 42' ' ' TRP . 0.1 OUTLIER -80.88 -0.9 41.13 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.381 -179.988 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 42' ' ' TRP . . . . . 0.479 ' CG ' ' O ' ' A' ' 41' ' ' TRP . 32.2 p90 45.79 -172.92 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.247 0 CA-C-O 120.853 0.358 . . . . 0.0 111.34 -179.971 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . 0.457 ' HD2' HD22 ' A' ' 34' ' ' LEU . 0.0 OUTLIER -126.36 162.92 24.42 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.003 -179.773 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . 1.027 HG11 HD22 ' A' ' 31' ' ' LEU . 11.1 t -144.23 157.69 15.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.061 -0.518 . . . . 0.0 111.105 179.99 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . 0.569 ' O ' HG12 ' A' ' 46' ' ' VAL . 5.5 mm-40 -101.68 -165.29 1.18 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.827 -179.91 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 46' ' ' VAL . . . . . 0.586 ' O ' HG13 ' A' ' 46' ' ' VAL . 0.4 OUTLIER 80.07 7.81 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.532 0.265 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.43 179.983 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 47' ' ' ASN . . . . . 0.415 ' CG ' HG13 ' A' ' 23' ' ' VAL . 3.0 t-20 -113.8 -36.22 4.9 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.852 0.358 . . . . 0.0 110.953 179.921 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER 73.55 7.03 5.09 Favored 'General case' 0 CA--C 1.532 0.285 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.328 -179.966 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -87.77 -70.24 0.64 Allowed 'General case' 0 C--O 1.231 0.122 0 CA-C-O 120.881 0.372 . . . . 0.0 110.826 179.851 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 2.4 tt0 -164.31 -68.89 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.9 -179.926 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 171.22 -153.25 20.08 Favored Glycine 0 C--N 1.332 0.341 0 C-N-CA 120.857 -0.687 . . . . 0.0 112.523 -179.982 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 10.8 m-85 60.62 113.41 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.773 0.32 . . . . 0.0 110.956 -179.976 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 53' ' ' VAL . . . . . 0.806 HG21 ' HB ' ' A' ' 44' ' ' VAL . 21.4 t -141.64 136.96 15.85 Favored Pre-proline 0 C--N 1.329 -0.311 0 CA-C-N 116.382 -0.372 . . . . 0.0 111.282 -179.96 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 54' ' ' PRO . . . . . 0.474 ' O ' ' HB3' ' A' ' 55' ' ' ALA . 47.5 Cg_exo -55.73 -55.08 3.28 Favored 'Trans proline' 0 C--N 1.347 0.498 0 C-N-CA 122.586 2.191 . . . . 0.0 112.294 179.93 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 55' ' ' ALA . . . . . 0.474 ' HB3' ' O ' ' A' ' 54' ' ' PRO . . . 71.96 -62.3 0.47 Allowed 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.375 -179.982 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . 0.468 ' HB3' ' O ' ' A' ' 55' ' ' ALA . . . 70.76 -70.89 0.14 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.132 -179.822 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 57' ' ' TYR . . . . . 0.456 ' CD1' ' N ' ' A' ' 57' ' ' TYR . 0.8 OUTLIER -149.25 -62.87 0.23 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.999 179.766 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 58' ' ' VAL . . . . . 0.746 ' HA ' HD12 ' A' ' 12' ' ' LEU . 7.7 p 39.8 49.56 0.31 Allowed 'Isoleucine or valine' 0 CA--C 1.53 0.206 0 CA-C-N 116.218 -0.446 . . . . 0.0 112.113 179.861 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . 0.692 ' CE ' HD22 ' A' ' 10' ' ' LEU . 15.5 mttm 74.8 30.64 0.96 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.76 -179.688 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--N 1.33 -0.258 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.895 -179.757 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 1.8 mt . . . . . 0 CA--C 1.521 -0.146 0 CA-C-O 120.907 0.384 . . . . 0.0 110.992 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . 0.591 HG21 HD21 ' A' ' 33' ' ' LEU . 22.3 t -144.28 -38.63 0.14 Allowed 'Isoleucine or valine' 0 N--CA 1.454 -0.242 0 CA-C-N 115.91 -0.586 . . . . 0.0 111.381 179.849 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . 0.436 ' HA ' HD13 ' A' ' 30' ' ' ILE . 3.2 mt 67.79 159.45 0.15 Allowed 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.365 -0.38 . . . . 0.0 110.546 -179.618 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . 0.737 ' HB3' ' O ' ' A' ' 26' ' ' LYS . . . -108.79 -24.59 11.22 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.931 179.702 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.819 HD12 ' HA ' ' A' ' 58' ' ' VAL . 27.4 mt 52.54 50.17 18.82 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-N 116.196 -0.457 . . . . 0.0 111.003 179.997 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . 0.407 ' CD2' ' HG2' ' A' ' 27' ' ' LYS . 3.6 t80 75.65 152.31 0.13 Allowed 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 115.907 -0.588 . . . . 0.0 111.09 -179.989 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . 0.413 ' OD1' ' N ' ' A' ' 14' ' ' ASP . 0.4 OUTLIER -45.81 155.32 0.18 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.921 -0.581 . . . . 0.0 111.374 179.837 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' TYR . . . . . 0.605 ' HE1' ' HB3' ' A' ' 56' ' ' ALA . 42.5 t80 -71.17 -66.57 0.6 Allowed 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.787 -179.966 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' GLN . . . . . 0.405 ' O ' ' CB ' ' A' ' 17' ' ' GLU . 18.5 tt0 -177.46 -34.51 0.01 OUTLIER 'General case' 0 CA--C 1.53 0.201 0 CA-C-N 116.306 -0.406 . . . . 0.0 111.469 -179.75 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . 0.652 ' CG ' HG21 ' A' ' 24' ' ' THR . 34.3 mt-10 . . . . . 0 N--CA 1.467 0.408 0 CA-C-N 116.277 -0.419 . . . . 0.0 110.753 -179.618 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 13.9 tt0 . . . . . 0 C--O 1.232 0.179 0 CA-C-O 120.667 0.27 . . . . 0.0 111.054 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . 0.765 HG22 ' HB3' ' A' ' 49' ' ' ARG . 35.4 t 59.7 78.92 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.243 0 CA-C-N 116.504 -0.317 . . . . 0.0 111.007 -179.883 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . 0.652 HG21 ' CG ' ' A' ' 17' ' ' GLU . 41.7 p -158.87 177.11 11.52 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-O 121.022 0.439 . . . . 0.0 111.496 -179.657 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' MET . . . . . 0.719 ' CE ' HG21 ' A' ' 44' ' ' VAL . 0.1 OUTLIER -98.87 -161.45 0.88 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.684 -0.689 . . . . 0.0 110.329 179.541 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . 0.737 ' O ' ' HB3' ' A' ' 11' ' ' ALA . 3.2 mmtp -147.88 174.35 11.94 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.84 0.353 . . . . 0.0 111.124 179.516 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . 0.407 ' HG2' ' CD2' ' A' ' 13' ' ' TYR . 21.7 mtmm -57.37 102.14 0.08 Allowed 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.453 -179.854 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 45.5 37.05 6.33 Favored Glycine 0 C--N 1.332 0.32 0 C-N-CA 121.065 -0.588 . . . . 0.0 113.032 179.766 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 33.5 t0 -90.24 15.6 10.12 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.742 0.306 . . . . 0.0 111.396 179.817 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . 0.707 HG22 ' H ' ' A' ' 31' ' ' LEU . 2.4 mm 54.45 174.91 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.2 0 CA-C-O 120.943 0.401 . . . . 0.0 111.378 179.908 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.707 ' H ' HG22 ' A' ' 30' ' ' ILE . 0.0 OUTLIER -177.84 -170.85 0.27 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.383 -179.313 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . 0.595 ' N ' HD22 ' A' ' 31' ' ' LEU . 86.8 m -122.94 163.06 21.09 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-O 121.12 0.486 . . . . 0.0 111.159 179.924 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.73 HD22 ' N ' ' A' ' 33' ' ' LEU . 0.6 OUTLIER -120.93 -61.06 1.6 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.881 -0.599 . . . . 0.0 110.955 -179.762 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER 61.88 115.84 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.92 179.978 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 92.9 m-20 60.77 87.59 0.09 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.926 179.965 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 9.2 m -163.36 166.1 23.31 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.807 -179.988 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 4.2 m -145.87 -65.18 0.31 Allowed 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.015 179.975 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 18.9 p-10 -142.56 -49.14 0.35 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.907 -179.953 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -123.56 92.83 3.77 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.861 -179.915 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 40' ' ' ASP . . . . . 0.44 ' HB2' ' CE3' ' A' ' 42' ' ' TRP . 5.1 p30 -177.68 165.81 2.11 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.174 -0.467 . . . . 0.0 110.915 179.854 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 41' ' ' TRP . . . . . . . . . . . . . 10.2 p90 -134.54 -47.61 0.76 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.875 179.931 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 42' ' ' TRP . . . . . 0.44 ' CE3' ' HB2' ' A' ' 40' ' ' ASP . 1.0 OUTLIER 62.17 -81.24 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.99 179.987 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 5.2 pttt -178.32 103.1 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.811 179.915 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . 0.719 HG21 ' CE ' ' A' ' 25' ' ' MET . 11.7 t -49.31 -41.89 15.31 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.899 179.816 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 3.8 tt0 58.28 41.35 23.5 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.112 -0.495 . . . . 0.0 111.238 179.689 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 46' ' ' VAL . . . . . 0.4 HG12 ' CG1' ' A' ' 44' ' ' VAL . 14.4 p -102.77 -24.09 4.16 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-O 120.92 0.39 . . . . 0.0 110.959 179.599 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 5.6 p30 -100.08 -171.23 2.0 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.617 179.664 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 23.2 t0 -109.91 63.26 0.6 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.811 0.339 . . . . 0.0 111.037 -179.879 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 49' ' ' ARG . . . . . 0.765 ' HB3' HG22 ' A' ' 23' ' ' VAL . 54.6 ttt-85 -177.14 104.81 0.05 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.073 179.883 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 24.2 tp60 61.94 -81.57 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.121 -0.49 . . . . 0.0 111.043 179.763 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 127.75 -2.02 6.92 Favored Glycine 0 C--N 1.334 0.448 0 C-N-CA 120.795 -0.717 . . . . 0.0 112.962 -179.869 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 2.2 m-85 -44.66 -82.0 0.01 OUTLIER 'General case' 0 CA--C 1.53 0.178 0 CA-C-N 116.825 0.313 . . . . 0.0 111.395 -179.816 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 53' ' ' VAL . . . . . 0.663 HG11 ' SD ' ' A' ' 25' ' ' MET . 2.8 t 49.47 84.62 0.2 Allowed Pre-proline 0 C--N 1.332 -0.186 0 CA-C-N 116.467 -0.333 . . . . 0.0 111.308 179.912 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 54' ' ' PRO . . . . . 0.449 ' HB2' ' CZ ' ' A' ' 15' ' ' TYR . 56.1 Cg_exo -51.29 139.94 43.44 Favored 'Trans proline' 0 C--N 1.345 0.393 0 C-N-CA 122.54 2.16 . . . . 0.0 112.177 179.886 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -86.95 55.81 3.73 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.336 -179.757 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . 0.605 ' HB3' ' HE1' ' A' ' 15' ' ' TYR . . . -94.62 36.91 1.14 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.433 179.209 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -175.79 -168.68 0.3 Allowed 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.655 -179.239 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 58' ' ' VAL . . . . . 0.819 ' HA ' HD12 ' A' ' 12' ' ' LEU . 48.3 t 63.37 157.13 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.575 178.868 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . 0.442 ' N ' HG12 ' A' ' 58' ' ' VAL . 10.0 ptpt -55.92 120.5 7.51 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.945 179.952 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.329 -0.309 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.866 -179.9 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . 0.687 ' N ' HD13 ' A' ' 8' ' ' LEU . 0.0 OUTLIER . . . . . 0 C--O 1.231 0.103 0 CA-C-O 120.82 0.343 . . . . 0.0 110.869 . . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . 0.822 HG12 HG11 ' A' ' 58' ' ' VAL . 98.9 t -111.99 -95.32 0.1 OUTLIER 'Isoleucine or valine' 0 CA--C 1.534 0.362 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.167 -179.965 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . 0.681 HD12 ' HD3' ' A' ' 59' ' ' LYS . 2.0 mt 166.49 -54.56 0.0 OUTLIER 'General case' 0 N--CA 1.464 0.233 0 CA-C-O 120.882 0.372 . . . . 0.0 110.92 179.953 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . 0.576 ' HB1' ' CE ' ' A' ' 25' ' ' MET . . . 64.66 43.79 4.12 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.942 -179.473 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.676 HD13 ' H ' ' A' ' 12' ' ' LEU . 0.0 OUTLIER -56.99 155.98 7.44 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.086 -179.999 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . 0.4 ' CD2' ' OH ' ' A' ' 57' ' ' TYR . 0.1 OUTLIER 77.88 -5.16 2.14 Favored 'General case' 0 N--CA 1.463 0.218 0 CA-C-N 116.005 -0.543 . . . . 0.0 111.777 -179.907 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . 0.44 ' HB3' ' HA ' ' A' ' 26' ' ' LYS . 5.8 p-10 43.47 95.77 0.01 OUTLIER 'General case' 0 N--CA 1.462 0.146 0 CA-C-O 120.893 0.378 . . . . 0.0 111.657 179.799 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 15' ' ' TYR . . . . . 0.425 ' CZ ' ' HG2' ' A' ' 54' ' ' PRO . 10.3 t80 -74.44 116.11 14.75 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.069 -179.915 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 5.6 pt20 -88.04 -166.0 1.47 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.679 179.867 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . 0.441 ' HB3' ' HA ' ' A' ' 22' ' ' GLU . 1.6 pt-20 . . . . . 0 C--N 1.328 -0.348 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.897 -179.94 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . 0.441 ' HA ' ' HB3' ' A' ' 17' ' ' GLU . 2.2 mp0 . . . . . 0 N--CA 1.457 -0.083 0 CA-C-O 120.749 0.309 . . . . 0.0 110.93 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . 0.516 HG11 ' O ' ' A' ' 51' ' ' GLY . 27.2 m -134.93 134.82 53.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.399 179.951 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 18.0 m -130.83 154.29 48.2 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.76 179.928 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 25' ' ' MET . . . . . 0.576 ' CE ' ' HB1' ' A' ' 11' ' ' ALA . 31.2 mtm -150.09 57.49 0.96 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.959 0.409 . . . . 0.0 110.959 -179.94 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . 0.44 ' HA ' ' HB3' ' A' ' 14' ' ' ASP . 2.4 tppt? -40.44 120.77 1.29 Allowed 'General case' 0 N--CA 1.465 0.312 0 CA-C-N 115.899 -0.591 . . . . 0.0 111.908 -179.789 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 4.6 mptt 53.61 174.15 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.011 -0.54 . . . . 0.0 111.44 179.624 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . 0.646 ' HA3' HD22 ' A' ' 10' ' ' LEU . . . -82.34 61.45 4.71 Favored Glycine 0 N--CA 1.452 -0.299 0 C-N-CA 120.904 -0.665 . . . . 0.0 112.241 179.786 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -96.87 29.86 2.89 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.909 0.385 . . . . 0.0 110.883 179.91 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . 0.58 HD13 ' N ' ' A' ' 30' ' ' ILE . 0.4 OUTLIER 51.97 178.08 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.238 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.187 -179.939 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.897 ' HB2' HG22 ' A' ' 46' ' ' VAL . 0.0 OUTLIER -164.69 18.82 0.05 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.893 -179.057 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . 0.566 HG22 ' H ' ' A' ' 33' ' ' LEU . 0.6 OUTLIER 52.02 178.2 0.02 OUTLIER 'General case' 0 N--CA 1.465 0.275 0 CA-C-O 120.858 0.361 . . . . 0.0 111.165 179.924 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.615 HD21 HG23 ' A' ' 9' ' ' VAL . 1.0 OUTLIER -179.85 163.99 1.16 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.927 0.394 . . . . 0.0 111.102 -179.981 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.519 ' N ' HD12 ' A' ' 34' ' ' LEU . 4.1 mp -102.16 35.38 2.41 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.938 -0.574 . . . . 0.0 110.798 179.935 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 1.7 m-20 64.68 134.76 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.919 -179.961 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . 0.697 ' O ' HG23 ' A' ' 37' ' ' THR . 4.6 m -103.4 -172.73 2.16 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.905 179.918 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 37' ' ' THR . . . . . 0.697 HG23 ' O ' ' A' ' 36' ' ' SER . 0.3 OUTLIER -177.22 67.89 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.984 179.971 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 35.7 t-20 -172.81 -94.01 0.01 OUTLIER 'General case' 0 CA--C 1.532 0.27 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.773 179.789 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER 173.58 38.4 0.0 OUTLIER 'General case' 0 C--O 1.232 0.179 0 CA-C-O 120.672 0.272 . . . . 0.0 111.071 179.904 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 40' ' ' ASP . . . . . 0.479 ' O ' ' CG ' ' A' ' 41' ' ' TRP . 2.4 p-10 176.26 87.22 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.571 -0.286 . . . . 0.0 111.088 179.881 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 41' ' ' TRP . . . . . 0.49 ' CH2' ' CD2' ' A' ' 52' ' ' PHE . 66.8 p-90 45.69 -174.89 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.285 0 CA-C-N 116.07 -0.514 . . . . 0.0 111.603 179.833 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 42' ' ' TRP . . . . . . . . . . . . . 1.3 m95 175.82 86.38 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.833 -179.989 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 9.7 mttp 59.16 61.61 2.04 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.878 179.842 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . 0.856 HG13 HD23 ' A' ' 31' ' ' LEU . 82.0 t -77.72 83.36 0.88 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.942 179.827 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 6.3 mp0 -101.75 101.72 12.25 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.939 -179.89 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 46' ' ' VAL . . . . . 0.897 HG22 ' HB2' ' A' ' 31' ' ' LEU . 11.7 t -58.85 -30.47 42.82 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.047 179.858 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 63.4 m-20 -150.97 -57.36 0.16 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.773 179.888 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 48' ' ' ASP . . . . . 0.402 ' O ' ' HD2' ' A' ' 49' ' ' ARG . 8.9 p-10 -179.2 149.2 0.4 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.055 -0.521 . . . . 0.0 110.878 179.902 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 49' ' ' ARG . . . . . 0.466 ' HG2' ' O ' ' A' ' 49' ' ' ARG . 0.0 OUTLIER 76.21 -9.33 1.48 Allowed 'General case' 0 CA--C 1.536 0.405 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.629 179.901 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 24.0 mm-40 -94.37 -168.73 1.9 Allowed 'General case' 0 C--N 1.332 -0.17 0 CA-C-O 120.786 0.327 . . . . 0.0 110.835 179.636 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . 0.516 ' O ' HG11 ' A' ' 23' ' ' VAL . . . 134.65 166.76 11.26 Favored Glycine 0 C--N 1.334 0.442 0 C-N-CA 120.812 -0.708 . . . . 0.0 112.693 179.877 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 52' ' ' PHE . . . . . 0.49 ' CD2' ' CH2' ' A' ' 41' ' ' TRP . 5.2 m-85 62.86 107.9 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.839 0.352 . . . . 0.0 111.161 179.855 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 53' ' ' VAL . . . . . 0.819 ' CG2' HG21 ' A' ' 44' ' ' VAL . 30.2 m -155.88 105.0 2.12 Favored Pre-proline 0 CA--C 1.531 0.242 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.146 179.752 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 54' ' ' PRO . . . . . 0.425 ' HG2' ' CZ ' ' A' ' 15' ' ' TYR . 32.1 Cg_exo -59.02 93.97 0.08 OUTLIER 'Trans proline' 0 C--N 1.346 0.446 0 C-N-CA 122.539 2.16 . . . . 0.0 112.368 -179.775 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -61.47 89.94 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.912 179.826 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -53.04 -80.26 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.209 -0.451 . . . . 0.0 111.174 -179.793 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 57' ' ' TYR . . . . . 0.553 ' O ' HD11 ' A' ' 12' ' ' LEU . 20.2 p90 -133.57 98.09 4.11 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.39 -0.368 . . . . 0.0 110.729 179.802 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 58' ' ' VAL . . . . . 0.822 HG11 HG12 ' A' ' 9' ' ' VAL . 1.8 t -133.11 167.97 25.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.371 -179.709 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . 0.681 ' HD3' HD12 ' A' ' 10' ' ' LEU . 0.0 OUTLIER -79.74 148.21 31.59 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.862 179.817 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.329 -0.285 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.049 -179.971 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . 0.677 ' O ' HG13 ' A' ' 9' ' ' VAL . 0.1 OUTLIER . . . . . 0 C--O 1.231 0.122 0 CA-C-O 120.763 0.316 . . . . 0.0 110.977 . . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . 0.925 HG21 HD11 ' A' ' 33' ' ' LEU . 0.7 OUTLIER -164.36 172.64 0.22 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.195 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.074 -179.93 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . 0.571 HD11 ' CD ' ' A' ' 59' ' ' LYS . 0.4 OUTLIER -132.36 -37.94 1.07 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.51 -179.785 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . 0.794 ' HB1' ' CZ ' ' A' ' 13' ' ' TYR . . . 73.52 67.39 0.1 Allowed 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 121.018 0.437 . . . . 0.0 110.123 -178.972 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.496 ' H ' HG23 ' A' ' 58' ' ' VAL . 1.2 mp -80.55 12.15 3.27 Favored 'General case' 0 CA--C 1.531 0.213 0 CA-C-N 115.938 -0.574 . . . . 0.0 111.707 -179.639 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . 0.805 ' CD2' HG21 ' A' ' 44' ' ' VAL . 0.0 OUTLIER -50.8 177.61 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.171 0 CA-C-O 120.903 0.382 . . . . 0.0 111.175 179.983 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 9.7 p30 -173.14 36.85 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.755 179.859 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 15' ' ' TYR . . . . . 0.4 ' CD1' ' N ' ' A' ' 16' ' ' GLN . 7.1 t80 -83.73 153.49 24.13 Favored 'General case' 0 C--N 1.333 -0.15 0 CA-C-N 116.086 -0.506 . . . . 0.0 111.1 -179.849 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 16' ' ' GLN . . . . . 0.4 ' N ' ' CD1' ' A' ' 15' ' ' TYR . 10.0 mp0 -145.87 90.16 1.96 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.865 179.908 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 4.4 tt0 . . . . . 0 C--N 1.329 -0.32 0 CA-C-N 116.35 -0.387 . . . . 0.0 111.146 -179.76 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 C--O 1.23 0.074 0 CA-C-O 120.795 0.331 . . . . 0.0 110.868 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . 0.63 HG13 ' O ' ' A' ' 52' ' ' PHE . 38.8 t -148.02 110.64 0.68 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.078 -179.978 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 2.7 t -179.17 104.52 0.03 OUTLIER 'General case' 0 N--CA 1.462 0.16 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.954 179.941 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 25' ' ' MET . . . . . 0.425 ' HG2' ' CE2' ' A' ' 13' ' ' TYR . 2.2 mpp? -140.03 170.44 15.85 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.98 179.888 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -176.07 -179.37 1.12 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.876 179.979 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 13.1 mmmt 71.18 -169.75 0.15 Allowed 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.938 -179.994 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -116.06 25.04 9.64 Favored Glycine 0 C--N 1.332 0.337 0 C-N-CA 120.815 -0.707 . . . . 0.0 112.622 -179.842 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . 0.471 ' O ' ' HB3' ' A' ' 11' ' ' ALA . 56.4 t0 -65.3 120.97 13.75 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.841 0.353 . . . . 0.0 110.582 179.769 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . 0.643 HG23 ' O ' ' A' ' 9' ' ' VAL . 5.2 mt -59.71 166.49 0.62 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.114 -179.684 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.781 HD13 HD21 ' A' ' 33' ' ' LEU . 0.0 OUTLIER -148.22 -167.37 2.79 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.132 -178.928 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . 0.493 HG23 ' N ' ' A' ' 33' ' ' LEU . 14.8 t -102.36 -47.94 4.33 Favored 'General case' 0 C--N 1.333 -0.127 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.849 179.964 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.925 HD11 HG21 ' A' ' 9' ' ' VAL . 0.2 OUTLIER 64.99 170.86 0.2 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.844 179.81 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.419 HD23 ' N ' ' A' ' 35' ' ' ASN . 0.8 OUTLIER -93.05 -77.43 0.44 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.985 179.984 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 35' ' ' ASN . . . . . 0.419 ' N ' HD23 ' A' ' 34' ' ' LEU . 20.0 t-20 -138.03 -44.24 0.52 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.952 -179.936 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 3.1 t 69.02 112.25 0.05 OUTLIER 'General case' 0 N--CA 1.462 0.168 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.866 179.991 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 8.9 t -177.5 160.8 1.66 Allowed 'General case' 0 C--O 1.231 0.124 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.815 179.873 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 8.7 m120 60.41 172.82 0.09 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.888 -179.913 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -114.83 107.63 15.67 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.986 -180.0 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 40' ' ' ASP . . . . . 0.46 ' O ' ' N ' ' A' ' 42' ' ' TRP . 1.5 m-20 -178.63 81.44 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.081 -0.508 . . . . 0.0 110.893 179.944 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 41' ' ' TRP . . . . . 0.576 ' CG ' ' N ' ' A' ' 42' ' ' TRP . 0.0 OUTLIER 65.18 -65.05 0.16 Allowed 'General case' 0 CA--C 1.532 0.258 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.931 -179.906 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 42' ' ' TRP . . . . . 0.576 ' N ' ' CG ' ' A' ' 41' ' ' TRP . 3.8 t-105 57.89 115.93 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.189 -0.46 . . . . 0.0 111.402 -179.869 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . 0.445 ' HG3' ' CZ3' ' A' ' 42' ' ' TRP . 2.5 ptpp? -71.95 -177.21 1.94 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.373 179.417 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . 0.805 HG21 ' CD2' ' A' ' 13' ' ' TYR . 0.3 OUTLIER -118.53 -40.87 2.28 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-O 120.868 0.366 . . . . 0.0 111.131 179.975 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER 61.49 114.1 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.022 -179.964 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 46' ' ' VAL . . . . . 0.638 HG22 HD23 ' A' ' 31' ' ' LEU . 21.4 t -141.04 -57.31 0.25 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.048 179.88 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 7.9 m-80 -129.81 -174.82 3.41 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.752 179.93 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 16.6 m-20 -68.44 73.22 0.22 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.886 179.984 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -156.01 26.94 0.37 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.959 -179.954 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER 56.94 -167.61 0.12 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.393 -0.367 . . . . 0.0 110.943 179.919 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -91.18 -108.58 1.5 Allowed Glycine 0 C--N 1.332 0.349 0 C-N-CA 120.958 -0.639 . . . . 0.0 112.538 179.993 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 52' ' ' PHE . . . . . 0.63 ' O ' HG13 ' A' ' 23' ' ' VAL . 19.6 m-85 55.41 79.53 0.15 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.86 0.362 . . . . 0.0 110.562 -179.941 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 53' ' ' VAL . . . . . 0.492 HG13 ' HB ' ' A' ' 44' ' ' VAL . 1.5 p 179.0 92.73 0.17 Allowed Pre-proline 0 C--N 1.327 -0.377 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.708 -179.498 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_exo -52.56 130.85 38.41 Favored 'Trans proline' 0 C--N 1.346 0.424 0 C-N-CA 122.535 2.156 . . . . 0.0 112.295 -179.878 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -64.15 -52.37 59.37 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.057 -0.519 . . . . 0.0 110.969 -179.979 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . 0.439 ' O ' ' HD1' ' A' ' 57' ' ' TYR . . . 58.61 47.12 13.67 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.058 179.987 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 57' ' ' TYR . . . . . 0.476 ' CD1' ' C ' ' A' ' 57' ' ' TYR . 0.0 OUTLIER 81.56 147.15 0.09 Allowed 'General case' 0 N--CA 1.464 0.271 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.688 -179.827 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 58' ' ' VAL . . . . . 0.515 HG13 ' N ' ' A' ' 59' ' ' LYS . 8.2 p -178.49 -47.69 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.365 -179.788 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . 0.571 ' CD ' HD11 ' A' ' 10' ' ' LEU . 0.4 OUTLIER 178.79 -167.87 0.08 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.361 -0.382 . . . . 0.0 110.788 -179.91 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--N 1.33 -0.281 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.815 179.925 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 69.3 tt0 . . . . . 0 C--O 1.232 0.132 0 CA-C-O 120.732 0.301 . . . . 0.0 110.914 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.661 ' O ' HG13 ' A' ' 9' ' ' VAL . 2.1 tp -178.5 -71.71 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.831 179.876 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . 0.661 HG13 ' O ' ' A' ' 8' ' ' LEU . 1.5 m -163.51 64.67 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.333 -0.146 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.092 179.908 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . 0.749 ' O ' HG13 ' A' ' 58' ' ' VAL . 0.8 OUTLIER -61.06 159.31 11.91 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.189 -0.459 . . . . 0.0 111.005 179.941 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . 0.631 ' HB2' ' HG2' ' A' ' 25' ' ' MET . . . -71.91 -20.89 61.71 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.099 -0.501 . . . . 0.0 111.384 179.933 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.805 HD11 ' HA ' ' A' ' 58' ' ' VAL . 0.5 OUTLIER 74.94 16.26 2.94 Favored 'General case' 0 N--CA 1.465 0.313 0 CA-C-N 116.33 -0.396 . . . . 0.0 111.277 179.96 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER 177.19 -77.72 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.181 0 CA-C-O 120.661 0.267 . . . . 0.0 110.97 179.851 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER 169.29 -34.17 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.442 -0.345 . . . . 0.0 110.905 -179.805 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' TYR . . . . . 0.896 ' CD2' HG12 ' A' ' 53' ' ' VAL . 19.4 t80 68.25 -62.58 0.36 Allowed 'General case' 0 N--CA 1.465 0.285 0 CA-C-N 116.145 -0.479 . . . . 0.0 111.265 -179.847 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . 0.403 ' HA ' ' HB ' ' A' ' 24' ' ' THR . 13.1 pt20 44.94 88.65 0.02 OUTLIER 'General case' 0 N--CA 1.463 0.201 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.391 -179.769 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . 0.738 ' N ' HG22 ' A' ' 24' ' ' THR . 6.3 tp10 -58.11 -63.72 1.16 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.969 179.918 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -176.69 106.85 0.07 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.917 -179.953 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER 59.61 161.54 0.1 OUTLIER Pre-proline 0 C--N 1.33 -0.261 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.889 179.975 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.55 63.16 1.67 Allowed 'Trans proline' 0 C--N 1.345 0.387 0 C-N-CA 122.607 2.204 . . . . 0.0 112.306 -179.986 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -134.68 -61.6 0.76 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.871 179.987 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -88.17 -169.58 2.63 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.939 179.946 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 3.0 m -59.21 101.4 0.1 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.202 179.961 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . 0.738 HG22 ' N ' ' A' ' 17' ' ' GLU . 75.0 p -135.44 105.68 6.34 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 116.108 -0.497 . . . . 0.0 111.004 -179.849 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' MET . . . . . 0.707 ' CE ' HG11 ' A' ' 53' ' ' VAL . 1.8 mpp? -87.54 170.06 11.64 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.673 179.877 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 8.3 tptm -156.1 127.47 7.15 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.165 -179.824 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 10.8 ttmt 62.85 -79.79 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.147 179.896 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 179.16 61.05 0.08 OUTLIER Glycine 0 N--CA 1.452 -0.284 0 C-N-CA 120.667 -0.778 . . . . 0.0 112.44 -179.973 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 38.0 m-20 -83.97 4.16 31.0 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.565 0.221 . . . . 0.0 111.249 179.872 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . 0.665 HG22 ' H ' ' A' ' 31' ' ' LEU . 3.4 mm 57.66 172.21 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-O 120.972 0.415 . . . . 0.0 111.199 179.943 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.665 ' H ' HG22 ' A' ' 30' ' ' ILE . 0.0 OUTLIER -173.78 151.12 1.78 Allowed 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.002 -0.544 . . . . 0.0 110.702 -179.184 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . 0.507 HG22 ' H ' ' A' ' 33' ' ' LEU . 0.8 OUTLIER -79.59 175.72 10.36 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.207 179.607 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.507 ' H ' HG22 ' A' ' 32' ' ' THR . 0.6 OUTLIER -173.08 173.07 3.76 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.009 0.433 . . . . 0.0 111.418 -179.788 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 1.3 tt -134.95 97.67 3.81 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.899 -0.591 . . . . 0.0 110.799 -179.944 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 9.8 m-20 62.2 -164.01 0.25 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.784 -179.924 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 4.4 m 69.56 43.36 1.01 Allowed 'General case' 0 N--CA 1.462 0.153 0 CA-C-O 120.897 0.38 . . . . 0.0 110.833 -179.891 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 54.0 m -110.14 -32.42 7.0 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.108 -0.497 . . . . 0.0 110.829 179.9 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 21.5 t-20 -113.54 -52.62 2.75 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.838 -179.981 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 4.6 ttmt -78.0 -58.37 3.3 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.902 179.947 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 19.4 m-20 -105.65 -176.12 2.99 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.854 179.976 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' TRP . . . . . 0.449 ' NE1' ' CZ2' ' A' ' 42' ' ' TRP . 11.9 p-90 -177.1 57.36 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.832 -179.972 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' TRP . . . . . 0.449 ' CZ2' ' NE1' ' A' ' 41' ' ' TRP . 1.8 m-90 -152.66 29.67 0.53 Allowed 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.982 -179.965 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 4.6 tttp -147.06 135.14 21.5 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.893 0.378 . . . . 0.0 111.165 -179.986 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . 0.593 ' CG2' HG22 ' A' ' 53' ' ' VAL . 25.2 m -155.94 -174.97 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.914 179.811 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 31.9 tt0 -145.38 87.35 1.8 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.911 0.386 . . . . 0.0 110.902 179.942 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' VAL . . . . . 0.445 HG22 ' HB2' ' A' ' 31' ' ' LEU . 20.1 t -80.11 -30.87 13.03 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.026 179.949 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 5.8 p30 -159.28 49.31 0.33 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.877 179.988 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 13.0 m-20 61.7 82.39 0.17 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.869 179.946 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -177.02 163.34 2.14 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.932 179.946 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 1.2 pt20 -69.93 86.12 0.52 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.814 179.919 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -58.34 152.81 28.89 Favored Glycine 0 C--N 1.332 0.351 0 C-N-CA 120.911 -0.661 . . . . 0.0 112.533 -179.967 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 3.8 m-85 -139.18 29.58 2.23 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.781 0.324 . . . . 0.0 110.911 179.896 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' VAL . . . . . 0.896 HG12 ' CD2' ' A' ' 15' ' ' TYR . 25.4 m -89.35 160.27 42.76 Favored Pre-proline 0 C--N 1.33 -0.278 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.965 -179.97 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' PRO . . . . . 0.445 ' HD3' ' CD1' ' A' ' 15' ' ' TYR . 53.1 Cg_exo -54.78 -63.11 0.22 Allowed 'Trans proline' 0 C--N 1.346 0.413 0 C-N-CA 122.609 2.206 . . . . 0.0 112.124 179.934 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . 0.453 ' C ' HG23 ' A' ' 58' ' ' VAL . . . 65.76 23.53 11.49 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.311 179.98 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . 0.447 ' O ' ' CG ' ' A' ' 57' ' ' TYR . . . -91.12 145.85 24.33 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.372 -0.376 . . . . 0.0 110.766 179.817 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' TYR . . . . . 0.691 ' CD2' HD13 ' A' ' 12' ' ' LEU . 36.7 p90 44.35 39.79 3.32 Favored 'General case' 0 N--CA 1.463 0.216 0 CA-C-O 120.918 0.39 . . . . 0.0 111.208 -179.823 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . 0.805 ' HA ' HD11 ' A' ' 12' ' ' LEU . 73.1 t -74.27 -80.96 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 115.976 -0.556 . . . . 0.0 111.11 -179.944 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . 0.465 ' CE ' HD21 ' A' ' 10' ' ' LEU . 60.0 mmtt -147.88 24.78 1.06 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.502 -0.317 . . . . 0.0 111.126 -179.837 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 42.61 35.17 0.64 Allowed 'General case' 0 N--CA 1.464 0.226 0 CA-C-N 116.322 -0.399 . . . . 0.0 111.535 179.939 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . 0.65 HD13 HG13 ' A' ' 9' ' ' VAL . 1.5 tp -59.19 127.18 30.88 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.976 179.969 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 2.5 t0 . . . . . 0 C--O 1.248 1.0 0 CA-C-O 118.3 -0.857 . . . . 0.0 110.869 179.999 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--O 1.231 0.106 0 CA-C-O 120.796 0.332 . . . . 0.0 110.929 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.583 HD22 HG13 ' A' ' 30' ' ' ILE . 0.4 OUTLIER -176.27 167.33 2.86 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.831 -179.967 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . 0.575 HG23 HD21 ' A' ' 33' ' ' LEU . 20.6 t -118.15 141.17 38.58 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.202 0 CA-C-N 116.277 -0.419 . . . . 0.0 111.253 -179.816 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . 0.736 HD23 HD13 ' A' ' 30' ' ' ILE . 1.4 mt -99.17 -26.76 14.09 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.88 179.822 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . 0.737 ' HB1' ' OD1' ' A' ' 14' ' ' ASP . . . 65.27 51.71 1.57 Allowed 'General case' 0 C--N 1.333 -0.145 0 CA-C-N 116.209 -0.45 . . . . 0.0 111.124 -179.918 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.699 ' CD1' HG13 ' A' ' 58' ' ' VAL . 1.3 mp -56.96 124.89 20.23 Favored 'General case' 0 C--O 1.233 0.191 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.872 179.943 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 3.3 m-85 61.87 63.02 1.17 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.835 -179.89 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . 0.737 ' OD1' ' HB1' ' A' ' 11' ' ' ALA . 13.5 m-20 -60.73 -80.83 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.012 179.98 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' TYR . . . . . 0.446 ' CD2' ' HE3' ' A' ' 26' ' ' LYS . 0.1 OUTLIER 61.84 -165.27 0.23 Allowed 'General case' 0 C--N 1.332 -0.165 0 CA-C-N 116.412 -0.358 . . . . 0.0 110.908 179.987 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -69.91 -170.26 0.32 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.888 179.946 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . 0.519 ' HB2' HG23 ' A' ' 23' ' ' VAL . 0.0 OUTLIER -103.38 -178.49 3.68 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.901 179.906 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.5 -32.25 73.8 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.889 179.937 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . 0.413 ' CB ' ' CD ' ' A' ' 20' ' ' PRO . 1.2 m -178.9 -61.61 0.0 OUTLIER Pre-proline 0 C--N 1.329 -0.292 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.952 179.892 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' PRO . . . . . 0.413 ' CD ' ' CB ' ' A' ' 19' ' ' SER . 58.7 Cg_endo -71.55 137.39 30.32 Favored 'Trans proline' 0 C--N 1.347 0.461 0 C-N-CA 122.588 2.192 . . . . 0.0 112.349 179.972 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 13.3 mmp_? 63.43 128.62 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.998 -179.993 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 5.5 pm0 -80.77 147.91 30.29 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.136 -0.483 . . . . 0.0 110.961 179.969 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . 0.535 HG11 ' HA ' ' A' ' 53' ' ' VAL . 7.9 t -139.65 161.03 27.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.916 -179.938 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . 0.779 HG23 ' HG3' ' A' ' 25' ' ' MET . 12.4 t -149.2 -161.78 1.42 Allowed 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.907 -179.9 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' MET . . . . . 0.779 ' HG3' HG23 ' A' ' 24' ' ' THR . 0.0 OUTLIER 75.73 174.37 0.24 Allowed 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.84 0.353 . . . . 0.0 111.079 179.974 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . 0.446 ' HE3' ' CD2' ' A' ' 15' ' ' TYR . 0.0 OUTLIER -176.8 -164.83 0.11 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.877 179.985 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 2.0 mtpm? 62.97 165.92 0.12 Allowed 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.944 -179.947 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -63.43 -121.8 0.01 OUTLIER Glycine 0 N--CA 1.451 -0.334 0 C-N-CA 120.724 -0.751 . . . . 0.0 112.54 -179.972 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER 62.95 144.99 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.792 0.33 . . . . 0.0 110.987 -179.896 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . 0.736 HD13 HD23 ' A' ' 10' ' ' LEU . 10.6 mm -85.4 163.27 2.73 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.354 -0.385 . . . . 0.0 110.998 179.989 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 1.061 HD22 HG11 ' A' ' 44' ' ' VAL . 0.2 OUTLIER -130.31 -106.07 0.28 Allowed 'General case' 0 CA--C 1.537 0.476 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.885 -179.891 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . 0.455 HG22 ' N ' ' A' ' 33' ' ' LEU . 51.9 m -168.51 161.95 11.91 Favored 'General case' 0 N--CA 1.462 0.132 0 CA-C-O 120.83 0.348 . . . . 0.0 110.819 179.909 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.575 HD21 HG23 ' A' ' 9' ' ' VAL . 0.1 OUTLIER -149.49 -170.08 3.54 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.916 179.914 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.736 ' O ' HD12 ' A' ' 34' ' ' LEU . 1.0 OUTLIER -150.12 102.84 3.13 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.909 179.868 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 77.9 m-20 62.58 -80.12 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.937 -179.895 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 1.2 m 62.72 150.27 0.03 OUTLIER 'General case' 0 C--N 1.333 -0.144 0 CA-C-O 120.917 0.389 . . . . 0.0 111.018 179.882 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 1.4 t -145.82 -47.93 0.21 Allowed 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.688 179.873 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 51.9 p-10 -100.47 -161.6 0.88 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.526 179.771 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . 0.409 ' O ' ' CD1' ' A' ' 41' ' ' TRP . 0.0 OUTLIER -47.72 97.77 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.916 0.389 . . . . 0.0 111.004 179.922 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 6.7 p-10 -69.14 122.9 19.73 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.213 -179.719 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' TRP . . . . . 0.429 ' CE3' ' HA ' ' A' ' 42' ' ' TRP . 49.2 p-90 -177.12 -35.03 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.291 179.905 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' TRP . . . . . 0.461 ' CE3' ' N ' ' A' ' 42' ' ' TRP . 0.0 OUTLIER -46.82 -96.84 0.0 OUTLIER 'General case' 0 CA--C 1.535 0.387 0 CA-C-N 116.399 -0.364 . . . . 0.0 111.935 -179.305 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 10.9 tttp -89.29 128.38 35.86 Favored 'General case' 0 C--N 1.334 -0.092 0 CA-C-O 120.849 0.357 . . . . 0.0 111.042 -179.836 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . 1.061 HG11 HD22 ' A' ' 31' ' ' LEU . 40.3 t -114.15 -31.89 2.04 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.051 -179.995 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 5.2 tm-20 62.99 33.58 14.73 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.946 -179.991 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' VAL . . . . . 0.643 HG11 ' HE1' ' A' ' 25' ' ' MET . 10.2 p -84.28 151.92 3.81 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.041 179.93 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 2.1 t-20 -62.92 166.65 5.45 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.998 -179.973 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 9.3 m-20 61.08 24.56 14.65 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.125 -0.488 . . . . 0.0 111.11 179.932 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . 0.671 ' CG ' HG22 ' A' ' 24' ' ' THR . 0.0 OUTLIER 177.46 -170.02 0.08 Allowed 'General case' 0 C--N 1.333 -0.129 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.748 179.896 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 1.7 tt0 -103.52 -57.34 2.05 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.856 179.972 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 145.93 90.2 0.1 OUTLIER Glycine 0 C--N 1.332 0.331 0 C-N-CA 120.917 -0.659 . . . . 0.0 112.555 -179.986 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 52' ' ' PHE . . . . . 0.495 ' O ' HG21 ' A' ' 23' ' ' VAL . 22.0 m-85 -164.23 31.28 0.07 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.735 0.302 . . . . 0.0 110.953 179.991 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 53' ' ' VAL . . . . . 1.013 HG22 HG21 ' A' ' 44' ' ' VAL . 19.0 m -62.24 129.74 92.47 Favored Pre-proline 0 C--N 1.329 -0.295 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.999 179.92 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 54' ' ' PRO . . . . . 0.411 ' O ' ' HB3' ' A' ' 55' ' ' ALA . 52.2 Cg_exo -55.17 -47.42 26.38 Favored 'Trans proline' 0 C--N 1.349 0.567 0 C-N-CA 122.43 2.087 . . . . 0.0 112.266 179.983 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . 0.456 ' HB1' ' CD1' ' A' ' 61' ' ' LEU . . . 67.49 -70.97 0.11 Allowed 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.035 -179.992 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . 63.06 -80.29 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.211 -0.449 . . . . 0.0 111.189 -179.981 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 32.8 p90 -131.01 128.97 41.43 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.809 179.926 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . 0.699 HG13 ' CD1' ' A' ' 12' ' ' LEU . 36.6 t -152.36 -70.99 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.165 -179.884 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . 0.588 ' HG3' HG12 ' A' ' 58' ' ' VAL . 11.3 mtmt -144.59 -68.02 0.32 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.891 -179.875 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 7.3 pttt -121.68 89.25 3.09 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.993 -179.89 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . 0.572 HD21 ' H ' ' A' ' 58' ' ' VAL . 2.3 pt? -176.38 130.46 0.21 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.83 179.898 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 30.3 m-20 . . . . . 0 C--O 1.249 1.066 0 CA-C-O 118.285 -0.864 . . . . 0.0 110.978 179.982 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 5.9 pt-20 . . . . . 0 CA--C 1.528 0.125 0 CA-C-O 120.848 0.356 . . . . 0.0 111.462 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.826 HD22 HG21 ' A' ' 30' ' ' ILE . 9.7 mt -159.94 -175.29 5.03 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.901 -179.998 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . 0.622 ' HB ' HD21 ' A' ' 31' ' ' LEU . 11.0 t -146.08 80.78 0.13 Allowed 'Isoleucine or valine' 0 C--O 1.232 0.176 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.116 -179.914 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . 0.829 ' O ' HG11 ' A' ' 58' ' ' VAL . 0.7 OUTLIER -62.1 -177.23 0.12 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.391 -0.368 . . . . 0.0 110.903 179.95 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -87.37 -27.58 22.71 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.283 -179.798 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.655 ' CD1' HD11 ' A' ' 10' ' ' LEU . 4.6 tp 75.1 -62.97 0.43 Allowed 'General case' 0 N--CA 1.464 0.249 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.803 -179.983 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . 0.54 ' OH ' ' HB3' ' A' ' 56' ' ' ALA . 0.1 OUTLIER -136.45 34.26 2.74 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.82 179.909 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 2.4 p30 46.88 -174.43 0.01 OUTLIER 'General case' 0 N--CA 1.463 0.194 0 CA-C-N 115.978 -0.555 . . . . 0.0 111.629 179.938 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' TYR . . . . . 0.431 ' CE1' ' HD2' ' A' ' 54' ' ' PRO . 7.0 t80 -119.41 -26.87 5.71 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 116.094 -0.503 . . . . 0.0 111.245 -179.862 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 8.3 tt0 64.85 120.02 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 120.95 0.405 . . . . 0.0 110.75 -179.759 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 26.9 pt-20 -118.71 135.16 54.63 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.233 -0.439 . . . . 0.0 111.024 -179.992 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 8.7 tptm -82.79 134.21 35.12 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.624 179.743 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 62.63 165.56 0.11 Allowed Pre-proline 0 C--N 1.328 -0.356 0 CA-C-N 116.394 -0.366 . . . . 0.0 110.529 -179.824 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 11.6 Cg_endo -54.93 -22.17 29.29 Favored 'Trans proline' 0 C--N 1.347 0.454 0 C-N-CA 122.641 2.227 . . . . 0.0 112.381 179.959 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -78.28 -168.21 1.26 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.31 -0.405 . . . . 0.0 110.81 179.899 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 4.9 mm-40 62.46 -178.24 0.14 Allowed 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.974 179.95 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 17.7 t -124.62 150.68 29.56 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.156 -0.474 . . . . 0.0 111.187 -179.972 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 10.3 t -140.82 -169.04 2.72 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.884 179.909 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' MET . . . . . 0.642 ' CE ' HG11 ' A' ' 53' ' ' VAL . 7.2 ptp -167.34 62.32 0.08 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.936 179.971 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 13.1 mmtt -61.63 166.21 4.4 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.88 -179.994 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 3.3 ttpt 60.4 -169.66 0.15 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.837 179.913 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -95.78 35.79 4.15 Favored Glycine 0 N--CA 1.45 -0.403 0 C-N-CA 120.805 -0.712 . . . . 0.0 112.55 179.927 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . 0.639 ' C ' HD13 ' A' ' 30' ' ' ILE . 12.4 p30 -57.79 172.16 0.42 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.713 0.292 . . . . 0.0 110.891 -179.971 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . 0.826 HG21 HD22 ' A' ' 8' ' ' LEU . 0.2 OUTLIER -123.13 -172.33 0.73 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.012 -179.862 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.825 ' HB3' HG22 ' A' ' 46' ' ' VAL . 0.0 OUTLIER -149.55 -177.01 5.63 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.815 -179.833 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . 0.759 ' O ' HD12 ' A' ' 33' ' ' LEU . 15.4 t -104.26 -47.0 4.26 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.072 -179.928 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.759 HD12 ' O ' ' A' ' 32' ' ' THR . 0.2 OUTLIER 66.5 152.78 0.07 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.785 179.924 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 14.8 tp -57.95 -62.29 1.92 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.888 179.958 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 34.4 t30 -147.05 -76.95 0.18 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.83 179.861 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER 172.86 127.35 0.02 OUTLIER 'General case' 0 N--CA 1.462 0.125 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.942 179.932 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . 0.553 HG21 ' CH2' ' A' ' 42' ' ' TRP . 3.2 t 179.34 127.11 0.07 Allowed 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.801 179.981 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' ASN . . . . . 0.495 ' HA ' HD21 ' A' ' 61' ' ' LEU . 25.2 m-80 -59.4 -82.35 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.886 179.966 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 2.4 tttp 46.9 -166.71 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.797 0.332 . . . . 0.0 111.204 179.804 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . 0.528 ' O ' ' HB3' ' A' ' 41' ' ' TRP . 1.5 t0 -96.41 85.07 3.83 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.88 179.733 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' TRP . . . . . 0.528 ' HB3' ' O ' ' A' ' 40' ' ' ASP . 0.0 OUTLIER 85.39 170.95 0.07 Allowed 'General case' 0 N--CA 1.466 0.367 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.788 -179.806 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' TRP . . . . . 0.553 ' CH2' HG21 ' A' ' 37' ' ' THR . 6.3 t-105 -155.87 141.43 17.8 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.864 -179.93 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 23.3 mttp -58.4 111.6 1.28 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.949 -179.943 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . 0.591 HG12 ' CG2' ' A' ' 46' ' ' VAL . 23.1 t -99.1 76.46 0.65 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.189 -0.46 . . . . 0.0 111.12 179.971 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . 0.428 ' C ' HG23 ' A' ' 46' ' ' VAL . 3.1 tm-20 -66.28 -58.3 5.66 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.847 179.957 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' VAL . . . . . 0.825 HG22 ' HB3' ' A' ' 31' ' ' LEU . 2.5 t 68.33 30.1 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.029 179.915 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 8.8 m120 63.39 35.1 12.44 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.94 179.959 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 1.2 t70 -179.33 167.21 1.5 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.91 179.844 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 25.3 mmm180 55.42 -165.95 0.11 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.025 179.991 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 5.8 mm-40 -80.61 -74.67 0.3 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.95 -179.965 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 153.73 -22.95 0.72 Allowed Glycine 0 C--N 1.333 0.415 0 C-N-CA 120.846 -0.692 . . . . 0.0 112.592 -179.965 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 42.9 m-85 -55.89 96.35 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 120.817 0.341 . . . . 0.0 111.128 -179.975 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 53' ' ' VAL . . . . . 0.642 HG11 ' CE ' ' A' ' 25' ' ' MET . 12.2 t -150.82 92.88 3.8 Favored Pre-proline 0 C--N 1.328 -0.36 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.046 179.9 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 54' ' ' PRO . . . . . 0.431 ' HD2' ' CE1' ' A' ' 15' ' ' TYR . 51.3 Cg_exo -53.12 87.46 0.03 OUTLIER 'Trans proline' 0 C--N 1.345 0.365 0 C-N-CA 122.617 2.211 . . . . 0.0 112.386 -179.971 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -60.32 -25.39 65.75 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.047 179.928 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . 0.54 ' HB3' ' OH ' ' A' ' 13' ' ' TYR . . . 64.48 -78.09 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.19 -179.915 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 57' ' ' TYR . . . . . 0.463 ' O ' HD22 ' A' ' 12' ' ' LEU . 47.2 p90 -161.47 127.68 3.8 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.028 179.955 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . 0.829 HG11 ' O ' ' A' ' 10' ' ' LEU . 24.2 t -145.78 126.82 7.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.018 179.853 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . 0.729 ' HE2' HD23 ' A' ' 10' ' ' LEU . 8.9 mmtt 60.56 -167.82 0.18 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.756 -179.868 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 20.4 mttt -58.03 -77.34 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.999 -179.972 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . 0.495 HD21 ' HA ' ' A' ' 38' ' ' ASN . 14.6 tp 63.1 -78.31 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.024 -179.993 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 15.2 t0 . . . . . 0 C--O 1.249 1.049 0 CA-C-O 118.233 -0.889 . . . . 0.0 110.906 179.985 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.231 0.125 0 CA-C-O 120.81 0.338 . . . . 0.0 110.966 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -132.49 79.25 1.84 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.879 179.953 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . 0.956 HG23 HD11 ' A' ' 31' ' ' LEU . 15.1 m -150.82 44.34 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.218 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.046 179.942 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . 0.529 HD13 ' O ' ' A' ' 28' ' ' GLY . 0.8 OUTLIER -51.08 113.94 1.06 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.12 -179.899 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . 0.763 ' HB3' ' OD2' ' A' ' 14' ' ' ASP . . . -56.45 94.11 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.185 -0.462 . . . . 0.0 111.03 179.866 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.756 HD13 ' CE1' ' A' ' 57' ' ' TYR . 0.6 OUTLIER -55.0 -24.93 26.62 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.184 -179.958 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -138.17 84.9 2.06 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.398 -0.364 . . . . 0.0 111.069 -179.959 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . 0.763 ' OD2' ' HB3' ' A' ' 11' ' ' ALA . 2.1 m-20 -81.35 -160.2 0.32 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.623 179.711 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' TYR . . . . . 0.437 ' CD1' ' HB ' ' A' ' 24' ' ' THR . 0.9 OUTLIER 76.77 -164.8 0.05 Allowed 'General case' 0 N--CA 1.464 0.266 0 CA-C-O 120.76 0.314 . . . . 0.0 111.032 179.745 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 5.3 mt-30 75.6 -67.48 0.24 Allowed 'General case' 0 C--N 1.333 -0.129 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.787 -179.769 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 6.6 tt0 63.1 -78.71 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.014 179.933 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER 58.71 48.1 12.02 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 120.876 0.369 . . . . 0.0 110.975 179.884 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 9.3 t -178.1 149.18 0.68 Allowed Pre-proline 0 C--N 1.329 -0.316 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.895 179.966 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 44.3 Cg_endo -68.28 -34.15 22.19 Favored 'Trans proline' 0 C--N 1.346 0.437 0 C-N-CA 122.646 2.231 . . . . 0.0 112.216 179.999 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 2.7 tpp180 -107.4 66.2 0.66 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.782 -179.978 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 2.1 mt-10 -149.67 -177.13 5.7 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.968 -179.905 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . 0.545 HG22 ' HB2' ' A' ' 49' ' ' ARG . 7.4 t -132.48 154.94 40.83 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.02 179.904 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . 0.437 ' HB ' ' CD1' ' A' ' 15' ' ' TYR . 0.7 OUTLIER -105.6 -77.7 0.58 Allowed 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.217 -179.883 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER 47.77 -174.34 0.01 OUTLIER 'General case' 0 CA--C 1.53 0.188 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.432 -179.815 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -178.23 104.72 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.299 -0.409 . . . . 0.0 110.894 -179.935 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 9.7 ptpp? 178.84 165.45 0.87 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.828 179.864 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . 0.529 ' O ' HD13 ' A' ' 10' ' ' LEU . . . -95.21 23.0 35.46 Favored Glycine 0 N--CA 1.45 -0.417 0 C-N-CA 120.773 -0.727 . . . . 0.0 112.519 179.941 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 10.7 m-20 -72.29 165.15 25.04 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.736 0.303 . . . . 0.0 110.788 179.945 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . 0.536 HG22 ' H ' ' A' ' 31' ' ' LEU . 5.4 mm -86.24 167.25 1.83 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.078 180.0 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.956 HD11 HG23 ' A' ' 9' ' ' VAL . 0.0 OUTLIER -153.11 166.44 32.46 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.78 -179.719 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . 0.43 HG22 ' N ' ' A' ' 33' ' ' LEU . 76.5 m -103.71 160.14 15.02 Favored 'General case' 0 N--CA 1.462 0.13 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.043 -179.97 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.574 HD21 HG21 ' A' ' 9' ' ' VAL . 5.0 mt -122.93 -169.83 1.99 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.938 -179.94 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 27.9 tp -161.51 86.33 0.66 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.831 179.976 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 3.3 m120 61.62 81.83 0.18 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.82 179.929 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 13.2 p -125.24 -79.24 0.61 Allowed 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.961 179.966 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 51.9 m 62.39 145.1 0.02 OUTLIER 'General case' 0 C--N 1.333 -0.152 0 CA-C-N 116.231 -0.441 . . . . 0.0 111.078 179.993 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER 56.69 168.77 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.054 179.894 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 5.1 mmtm 59.0 -111.78 0.57 Allowed 'General case' 0 CA--C 1.534 0.335 0 CA-C-N 116.086 -0.507 . . . . 0.0 110.898 179.994 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 59.9 t0 -178.46 -68.6 0.01 OUTLIER 'General case' 0 C--O 1.231 0.085 0 CA-C-O 120.829 0.347 . . . . 0.0 110.867 179.99 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' TRP . . . . . . . . . . . . . 43.0 p90 -73.99 125.41 28.2 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.867 -179.974 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' TRP . . . . . 0.404 ' CE3' ' HA ' ' A' ' 42' ' ' TRP . 4.8 m95 -167.59 81.18 0.19 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.911 -179.951 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 7.9 mtpp 58.29 91.01 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.027 179.968 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . 0.807 HG13 HD23 ' A' ' 31' ' ' LEU . 18.8 t -89.73 139.65 17.15 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.111 179.937 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 1.3 pt-20 -160.54 137.63 9.15 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.889 179.943 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' VAL . . . . . 0.489 HG13 ' N ' ' A' ' 47' ' ' ASN . 12.4 p -156.43 -45.61 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.32 -0.4 . . . . 0.0 111.156 -179.919 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' ASN . . . . . 0.489 ' N ' HG13 ' A' ' 46' ' ' VAL . 2.1 t-20 -178.09 37.91 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.91 -179.923 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 46.2 m-20 -136.12 -70.04 0.48 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.951 179.986 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . 0.545 ' HB2' HG22 ' A' ' 23' ' ' VAL . 31.6 mtp85 -157.64 -177.63 6.73 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.838 179.931 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 10.5 mm-40 -112.38 140.32 47.2 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.931 179.997 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 136.82 153.69 6.52 Favored Glycine 0 C--N 1.332 0.338 0 C-N-CA 120.956 -0.64 . . . . 0.0 112.497 179.956 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 13.0 p90 -59.36 158.98 8.5 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.768 0.318 . . . . 0.0 110.998 -179.971 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 53' ' ' VAL . . . . . 0.658 ' HB ' HG21 ' A' ' 44' ' ' VAL . 22.0 t -147.97 139.31 13.66 Favored Pre-proline 0 C--N 1.328 -0.33 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.151 -179.844 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 50.8 Cg_exo -53.41 101.35 0.06 OUTLIER 'Trans proline' 0 C--N 1.347 0.481 0 C-N-CA 122.535 2.157 . . . . 0.0 112.191 179.944 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -55.84 -41.8 74.83 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.112 -0.494 . . . . 0.0 111.101 179.998 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . 0.413 ' O ' ' CD2' ' A' ' 57' ' ' TYR . . . 52.19 53.21 12.83 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.18 -0.463 . . . . 0.0 111.131 179.981 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 57' ' ' TYR . . . . . 0.756 ' CE1' HD13 ' A' ' 12' ' ' LEU . 0.0 OUTLIER 63.16 119.65 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.611 -179.814 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . 0.708 ' HA ' HD12 ' A' ' 12' ' ' LEU . 0.5 OUTLIER -131.07 -168.54 0.58 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.826 -179.758 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . 0.638 ' N ' HG13 ' A' ' 58' ' ' VAL . 0.0 OUTLIER -49.85 -77.14 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.791 0.329 . . . . 0.0 111.13 -179.93 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -177.72 -71.32 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.352 -0.385 . . . . 0.0 110.905 179.979 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . 0.503 HD22 HG11 ' A' ' 9' ' ' VAL . 7.0 tp 61.58 99.77 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.803 179.987 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 8.1 p-10 . . . . . 0 C--O 1.25 1.08 0 CA-C-O 118.212 -0.899 . . . . 0.0 110.931 -179.988 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 18.2 tt0 . . . . . 0 C--O 1.231 0.096 0 CA-C-O 120.805 0.336 . . . . 0.0 110.833 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -133.14 -68.46 0.59 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.825 179.865 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . 0.713 HG22 ' HE3' ' A' ' 59' ' ' LYS . 5.1 t 63.64 134.25 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.236 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.111 179.796 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . 0.641 HD23 ' N ' ' A' ' 10' ' ' LEU . 0.2 OUTLIER -130.04 144.88 51.58 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.737 179.853 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . 0.736 ' HB1' ' CE1' ' A' ' 13' ' ' TYR . . . -62.92 80.74 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.422 -179.832 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.721 ' H ' HG23 ' A' ' 58' ' ' VAL . 2.1 mt -103.25 32.05 3.97 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.789 179.942 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . 0.736 ' CE1' ' HB1' ' A' ' 11' ' ' ALA . 0.0 OUTLIER -86.46 -60.04 2.11 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.384 -0.371 . . . . 0.0 110.43 179.522 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . 0.445 ' HA ' ' HA ' ' A' ' 26' ' ' LYS . 58.6 t0 50.21 89.3 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.177 179.798 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' TYR . . . . . 0.662 ' CB ' HG21 ' A' ' 24' ' ' THR . 0.5 OUTLIER -129.34 -78.62 0.56 Allowed 'General case' 0 C--N 1.332 -0.155 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.095 179.787 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . 0.415 ' CB ' ' O ' ' A' ' 15' ' ' TYR . 0.0 OUTLIER 164.09 177.58 0.02 OUTLIER 'General case' 0 N--CA 1.465 0.301 0 CA-C-O 120.817 0.342 . . . . 0.0 110.795 179.979 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 57.1 mt-10 -116.02 -29.68 6.25 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.111 179.907 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -72.05 -25.07 61.65 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.235 -179.755 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -54.38 142.68 49.18 Favored Pre-proline 0 C--N 1.33 -0.253 0 CA-C-N 116.453 -0.34 . . . . 0.0 111.13 -179.909 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 80.7 Cg_endo -77.62 57.52 6.02 Favored 'Trans proline' 0 C--N 1.347 0.472 0 C-N-CA 122.653 2.235 . . . . 0.0 112.327 -179.971 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -116.64 -64.78 1.26 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.781 -179.922 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -176.37 -68.03 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.953 179.953 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . 0.75 HG11 ' HB3' ' A' ' 49' ' ' ARG . 0.9 OUTLIER -150.21 -68.36 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.201 179.99 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . 0.662 HG21 ' CB ' ' A' ' 15' ' ' TYR . 0.3 OUTLIER 56.79 178.95 0.04 OUTLIER 'General case' 0 C--O 1.232 0.151 0 CA-C-N 116.11 -0.495 . . . . 0.0 111.062 -179.852 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -178.87 -173.57 0.31 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.856 -179.803 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . 0.445 ' HA ' ' HA ' ' A' ' 14' ' ' ASP . 0.0 OUTLIER -138.25 -173.05 3.42 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.007 179.946 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 5.1 ttpm? 63.43 120.66 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.015 -0.539 . . . . 0.0 111.002 179.901 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -58.82 -86.13 0.03 OUTLIER Glycine 0 N--CA 1.452 -0.242 0 C-N-CA 120.701 -0.761 . . . . 0.0 112.437 179.816 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 2.1 t0 49.05 28.58 2.11 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.806 0.336 . . . . 0.0 111.129 179.935 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . 0.577 HG22 ' H ' ' A' ' 31' ' ' LEU . 4.6 mm 58.98 168.42 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.091 -179.975 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.899 ' HB2' HG22 ' A' ' 46' ' ' VAL . 0.0 OUTLIER -157.15 -175.75 5.59 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.755 -179.635 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . 0.67 ' N ' HD22 ' A' ' 31' ' ' LEU . 86.7 m -126.27 161.72 27.11 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.976 179.941 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.508 ' CD2' HD21 ' A' ' 31' ' ' LEU . 2.3 mt -129.28 -170.11 2.22 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.2 -0.454 . . . . 0.0 111.011 -179.911 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.55 HD23 ' O ' ' A' ' 34' ' ' LEU . 9.3 tt -176.2 92.48 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.955 179.984 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 1.7 t30 61.27 89.8 0.07 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.891 -179.962 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 10.7 t -169.53 119.74 0.67 Allowed 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.861 179.965 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -122.94 170.36 10.2 Favored 'General case' 0 N--CA 1.462 0.129 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.827 -179.969 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 8.3 m-80 64.09 -79.09 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.979 179.984 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -73.71 170.33 15.47 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.856 179.938 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . 0.458 ' HB2' HG11 ' A' ' 58' ' ' VAL . 11.2 p30 -132.47 39.02 3.41 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.905 -179.99 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' TRP . . . . . 0.42 ' CD1' ' HA ' ' A' ' 56' ' ' ALA . 41.9 p-90 -159.3 31.65 0.2 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.0 -0.546 . . . . 0.0 110.684 179.942 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' TRP . . . . . . . . . . . . . 21.8 m95 -71.36 -47.76 54.38 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.086 -0.506 . . . . 0.0 111.138 -179.806 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 1.7 ttpm? -167.05 90.4 0.37 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.458 -0.337 . . . . 0.0 111.275 -179.852 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . 0.792 HG13 HD23 ' A' ' 31' ' ' LEU . 23.3 t -98.82 136.32 30.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.295 -0.412 . . . . 0.0 110.78 179.444 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . 0.425 ' C ' HG23 ' A' ' 46' ' ' VAL . 0.3 OUTLIER -110.89 -67.53 0.99 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.092 -179.651 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' VAL . . . . . 0.899 HG22 ' HB2' ' A' ' 31' ' ' LEU . 4.1 t 74.41 75.86 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 116.361 -0.381 . . . . 0.0 111.077 -179.817 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 36.6 m-20 68.6 -67.6 0.2 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.952 -179.99 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 1.2 t0 -121.9 -164.58 1.17 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.805 179.982 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . 0.75 ' HB3' HG11 ' A' ' 23' ' ' VAL . 0.2 OUTLIER 67.47 140.11 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.35 -0.386 . . . . 0.0 110.837 -179.993 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -69.3 -169.25 0.19 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.947 -179.967 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -80.44 -158.45 17.89 Favored Glycine 0 C--N 1.334 0.429 0 C-N-CA 120.95 -0.643 . . . . 0.0 112.425 -179.942 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 2.2 m-85 59.74 108.88 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.83 0.348 . . . . 0.0 110.821 -179.978 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 53' ' ' VAL . . . . . 0.774 HG21 ' HB ' ' A' ' 44' ' ' VAL . 62.8 t -143.12 100.84 5.31 Favored Pre-proline 0 C--N 1.328 -0.327 0 CA-C-N 116.266 -0.425 . . . . 0.0 111.196 -179.821 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 54' ' ' PRO . . . . . 0.595 ' O ' ' HB3' ' A' ' 55' ' ' ALA . 31.1 Cg_exo -59.47 -148.85 0.01 OUTLIER 'Trans proline' 0 C--N 1.347 0.467 0 C-N-CA 122.977 2.451 . . . . 0.0 111.966 179.931 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . 0.595 ' HB3' ' O ' ' A' ' 54' ' ' PRO . . . 81.06 -39.02 0.14 Allowed 'General case' 0 C--O 1.232 0.155 0 CA-C-O 120.818 0.342 . . . . 0.0 110.651 -179.299 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . 0.437 ' HB3' ' O ' ' A' ' 55' ' ' ALA . . . 68.52 -75.31 0.07 Allowed 'General case' 0 N--CA 1.453 -0.28 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.152 179.674 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 57' ' ' TYR . . . . . 0.437 ' HE1' ' HB1' ' A' ' 55' ' ' ALA . 0.1 OUTLIER -54.08 160.89 1.4 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.893 179.91 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . 0.721 HG23 ' H ' ' A' ' 12' ' ' LEU . 6.6 p -179.89 -47.92 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.025 179.925 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . 0.713 ' HE3' HG22 ' A' ' 9' ' ' VAL . 0.0 OUTLIER -179.58 178.22 0.67 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.474 -0.33 . . . . 0.0 110.826 179.459 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 7.4 ttpp -125.67 91.93 3.5 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.868 179.953 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . 0.409 HD23 HG22 ' A' ' 9' ' ' VAL . 0.2 OUTLIER -61.12 97.1 0.06 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.848 179.984 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 30.0 t0 . . . . . 0 C--O 1.248 1.023 0 CA-C-O 118.215 -0.898 . . . . 0.0 110.932 179.947 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . 0.621 ' C ' HG21 ' A' ' 30' ' ' ILE . 0.1 OUTLIER . . . . . 0 C--O 1.232 0.176 0 CA-C-O 120.765 0.317 . . . . 0.0 110.903 . . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.886 ' O ' HG22 ' A' ' 9' ' ' VAL . 1.6 mt -149.34 -166.07 2.45 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.919 -179.859 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . 0.886 HG22 ' O ' ' A' ' 8' ' ' LEU . 1.0 OUTLIER 76.59 33.29 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.466 0.35 0 CA-C-N 115.982 -0.554 . . . . 0.0 111.441 -179.837 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . 0.587 ' H ' HD23 ' A' ' 10' ' ' LEU . 0.4 OUTLIER -44.99 111.59 0.34 Allowed 'General case' 0 N--CA 1.463 0.181 0 CA-C-N 115.962 -0.563 . . . . 0.0 111.2 179.69 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . 0.852 ' HB1' ' HB2' ' A' ' 55' ' ' ALA . . . -53.11 98.94 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 116.037 -0.529 . . . . 0.0 111.191 -179.931 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.775 HD13 ' CZ ' ' A' ' 57' ' ' TYR . 0.5 OUTLIER -52.04 157.54 1.28 Allowed 'General case' 0 C--O 1.231 0.129 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.854 -179.938 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 1.2 m-85 67.95 -70.71 0.12 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.778 -179.809 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . 0.446 ' HB3' ' HA ' ' A' ' 26' ' ' LYS . 0.8 OUTLIER 56.8 104.42 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.915 -179.991 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 0.7 OUTLIER -96.08 -175.68 3.46 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.148 -179.698 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 16.6 pt20 -122.43 177.75 5.26 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.792 179.921 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . 0.509 ' HG2' ' HA ' ' A' ' 23' ' ' VAL . 0.3 OUTLIER 179.06 156.24 0.49 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.958 -179.898 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -85.79 -38.65 17.96 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.957 179.999 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . 0.408 ' N ' ' HD2' ' A' ' 20' ' ' PRO . 2.0 t -178.1 -61.78 0.0 OUTLIER Pre-proline 0 C--N 1.328 -0.328 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.918 179.981 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' PRO . . . . . 0.408 ' HD2' ' N ' ' A' ' 19' ' ' SER . 42.8 Cg_endo -67.6 176.37 5.1 Favored 'Trans proline' 0 C--N 1.346 0.428 0 C-N-CA 122.545 2.163 . . . . 0.0 112.29 179.984 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 21.9 mmm180 60.22 34.63 21.0 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.899 -179.968 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . 0.405 ' OE1' ' CE1' ' A' ' 52' ' ' PHE . 27.9 mm-40 63.48 124.48 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.886 -179.994 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . 0.719 HG11 ' HB3' ' A' ' 49' ' ' ARG . 31.5 m -58.45 179.81 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.049 179.975 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . 0.518 HG23 ' HD2' ' A' ' 54' ' ' PRO . 0.2 OUTLIER -171.35 -165.93 0.43 Allowed 'General case' 0 N--CA 1.463 0.217 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.502 179.906 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' MET . . . . . 0.426 ' H ' HG22 ' A' ' 24' ' ' THR . 0.1 OUTLIER -177.3 117.16 0.1 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.422 -0.354 . . . . 0.0 110.878 179.878 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . 0.446 ' HA ' ' HB3' ' A' ' 14' ' ' ASP . 0.0 OUTLIER -58.84 -166.12 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.989 -179.83 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 22.6 mmtt 64.44 151.25 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.842 179.934 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -94.13 40.77 2.69 Favored Glycine 0 N--CA 1.451 -0.354 0 C-N-CA 120.772 -0.728 . . . . 0.0 112.504 -179.925 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 2.9 t0 -58.27 -176.98 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.691 0.281 . . . . 0.0 110.725 179.843 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . 0.621 HG21 ' C ' ' A' ' 7' ' ' GLU . 0.6 OUTLIER -103.9 -179.45 0.64 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-O 120.774 0.321 . . . . 0.0 111.026 179.97 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.75 ' N ' HD12 ' A' ' 31' ' ' LEU . 0.0 OUTLIER -150.68 -157.94 0.86 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.768 -179.376 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . 0.573 HG23 ' N ' ' A' ' 33' ' ' LEU . 9.8 t -131.84 -53.99 0.99 Allowed 'General case' 0 N--CA 1.462 0.133 0 CA-C-O 120.765 0.317 . . . . 0.0 111.526 -179.696 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 1.018 HD11 HG12 ' A' ' 44' ' ' VAL . 1.9 mm? 62.34 138.09 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.931 0.396 . . . . 0.0 111.179 -179.985 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.567 HD12 ' OE2' ' A' ' 45' ' ' GLU . 6.8 mp -68.35 -74.2 0.13 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.868 179.947 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 7.9 p30 -154.98 31.18 0.4 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.854 179.953 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 3.3 m -70.65 139.44 51.3 Favored 'General case' 0 C--N 1.333 -0.144 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.822 -179.979 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 35.0 m -161.88 69.24 0.29 Allowed 'General case' 0 C--N 1.332 -0.158 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.844 179.968 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 2.3 m120 -158.49 -175.23 5.2 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.93 -179.898 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 1.2 pttt -69.14 -171.18 0.3 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.904 -179.98 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 3.1 p30 46.68 -175.55 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.235 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.672 -179.922 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' TRP . . . . . 0.463 ' CG ' ' N ' ' A' ' 42' ' ' TRP . 0.0 OUTLIER -69.01 -171.67 0.33 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.082 -0.508 . . . . 0.0 111.068 -179.698 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' TRP . . . . . 0.463 ' N ' ' CG ' ' A' ' 41' ' ' TRP . 5.4 m95 -166.67 154.25 9.58 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.938 179.955 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 7.9 tttp -63.67 113.25 3.24 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.965 179.994 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . 1.018 HG12 HD11 ' A' ' 33' ' ' LEU . 16.4 m -103.27 -174.7 0.42 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.088 179.789 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . 0.567 ' OE2' HD12 ' A' ' 34' ' ' LEU . 12.5 pt-20 -175.79 93.26 0.06 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.914 0.388 . . . . 0.0 110.928 179.857 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' VAL . . . . . 0.483 HG13 ' N ' ' A' ' 47' ' ' ASN . 11.2 p -131.98 -44.9 0.65 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.12 179.931 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 47' ' ' ASN . . . . . 0.483 ' N ' HG13 ' A' ' 46' ' ' VAL . 10.9 p-10 -107.87 -172.15 2.01 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.784 179.985 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 59.7 m-20 -57.07 -75.73 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.899 179.976 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . 0.719 ' HB3' HG11 ' A' ' 23' ' ' VAL . 0.7 OUTLIER -80.28 108.52 13.96 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.775 179.93 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -158.49 -178.17 7.07 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.977 179.989 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 132.82 -7.06 5.19 Favored Glycine 0 CA--C 1.519 0.339 0 C-N-CA 120.935 -0.65 . . . . 0.0 112.754 -179.939 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 52' ' ' PHE . . . . . 0.405 ' CE1' ' OE1' ' A' ' 22' ' ' GLU . 58.9 m-85 -136.25 -80.85 0.4 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.662 0.267 . . . . 0.0 110.719 179.965 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 53' ' ' VAL . . . . . 0.607 HG21 HG21 ' A' ' 44' ' ' VAL . 30.2 t 50.34 97.66 0.04 OUTLIER Pre-proline 0 C--N 1.332 -0.187 0 CA-C-N 116.414 -0.357 . . . . 0.0 111.497 179.725 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 54' ' ' PRO . . . . . 0.518 ' HD2' HG23 ' A' ' 24' ' ' THR . 84.8 Cg_exo -47.17 -59.93 1.07 Allowed 'Trans proline' 0 C--N 1.347 0.481 0 C-N-CA 122.615 2.21 . . . . 0.0 112.48 179.958 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . 0.852 ' HB2' ' HB1' ' A' ' 11' ' ' ALA . . . 63.12 17.03 9.85 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.543 -179.986 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . 54.26 -88.85 0.02 OUTLIER 'General case' 0 CA--C 1.531 0.222 0 CA-C-N 116.577 -0.283 . . . . 0.0 111.423 179.949 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 57' ' ' TYR . . . . . 0.775 ' CZ ' HD13 ' A' ' 12' ' ' LEU . 25.1 p90 -124.2 -23.5 4.52 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.651 -0.25 . . . . 0.0 111.504 -179.811 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . 0.714 HG12 ' O ' ' A' ' 57' ' ' TYR . 9.9 p 52.82 162.86 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.464 0.274 0 CA-C-O 121.04 0.448 . . . . 0.0 111.724 -179.912 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . 0.616 ' HD2' HD11 ' A' ' 12' ' ' LEU . 6.4 mmmt -73.01 -48.62 34.78 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.835 -179.772 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 61.17 105.17 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.882 179.994 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . 0.553 HD13 ' N ' ' A' ' 62' ' ' ASP . 0.2 OUTLIER -157.51 135.81 11.12 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.882 179.99 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 62' ' ' ASP . . . . . 0.553 ' N ' HD13 ' A' ' 61' ' ' LEU . 3.0 m-20 . . . . . 0 C--O 1.249 1.052 0 CA-C-O 118.309 -0.853 . . . . 0.0 110.883 179.957 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 2.3 pt-20 . . . . . 0 C--O 1.231 0.097 0 CA-C-O 120.854 0.359 . . . . 0.0 110.885 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.672 HD12 ' O ' ' A' ' 8' ' ' LEU . 1.2 pp 175.25 61.62 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.152 -0.477 . . . . 0.0 110.731 179.899 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . 0.486 HG12 ' N ' ' A' ' 10' ' ' LEU . 11.6 t 70.89 161.07 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.015 -179.871 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . 0.529 HD11 ' CD ' ' A' ' 59' ' ' LYS . 0.0 OUTLIER -144.49 -164.52 1.93 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.145 179.418 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . 0.639 ' C ' HD22 ' A' ' 12' ' ' LEU . . . -137.44 15.37 2.97 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.181 179.643 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.995 HD23 ' HB3' ' A' ' 56' ' ' ALA . 1.0 OUTLIER 65.65 -67.02 0.14 Allowed 'General case' 0 C--O 1.231 0.117 0 CA-C-O 120.953 0.406 . . . . 0.0 110.535 -179.756 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . 0.547 ' O ' ' HB1' ' A' ' 55' ' ' ALA . 6.6 p90 -156.02 170.24 22.6 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.967 -0.56 . . . . 0.0 110.398 179.609 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . 0.438 ' HB3' ' HA ' ' A' ' 26' ' ' LYS . 4.9 p-10 -46.53 159.67 0.09 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.379 -0.373 . . . . 0.0 111.081 179.729 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' TYR . . . . . 0.414 ' CE2' ' HD2' ' A' ' 54' ' ' PRO . 10.7 t80 -115.24 -35.99 4.5 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.387 -0.37 . . . . 0.0 111.151 -179.906 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER 64.99 143.62 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.773 -179.925 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 7.4 pt-20 -59.39 112.09 1.62 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.857 -179.975 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 11.0 mtpp -140.87 -78.76 0.28 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.916 179.973 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . 0.416 ' CB ' ' CD ' ' A' ' 20' ' ' PRO . 0.0 OUTLIER -75.12 -61.58 0.98 Allowed Pre-proline 0 C--N 1.33 -0.249 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.041 -179.866 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' PRO . . . . . 0.416 ' CD ' ' CB ' ' A' ' 19' ' ' SER . 55.3 Cg_endo -70.01 173.86 10.58 Favored 'Trans proline' 0 C--N 1.347 0.46 0 C-N-CA 122.552 2.168 . . . . 0.0 112.23 -179.941 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -60.48 -53.74 53.86 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.897 179.962 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 69.9 mm-40 -157.8 140.47 14.77 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.996 179.952 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . 0.456 HG12 ' HG3' ' A' ' 25' ' ' MET . 26.5 t -153.27 -48.51 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.002 179.911 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 99.1 m 63.27 -80.13 0.03 OUTLIER 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.007 -0.542 . . . . 0.0 111.072 179.91 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' MET . . . . . 0.751 ' SD ' HG21 ' A' ' 46' ' ' VAL . 0.2 OUTLIER 62.16 149.83 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.882 179.968 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . 0.438 ' HA ' ' HB3' ' A' ' 14' ' ' ASP . 0.0 OUTLIER -140.32 104.19 4.74 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.956 -179.943 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 4.0 mtpp 61.69 151.76 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.883 -179.945 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -62.76 -83.41 0.07 OUTLIER Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 120.597 -0.811 . . . . 0.0 112.359 179.851 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . 0.935 ' O ' HD13 ' A' ' 30' ' ' ILE . 30.1 m-20 52.19 -90.49 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.467 0.175 . . . . 0.0 111.1 -179.967 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . 0.935 HD13 ' O ' ' A' ' 29' ' ' ASP . 0.2 OUTLIER -147.1 -173.02 0.36 Allowed 'Isoleucine or valine' 0 C--O 1.232 0.143 0 CA-C-O 120.832 0.349 . . . . 0.0 110.892 179.896 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.918 HD22 HG21 ' A' ' 44' ' ' VAL . 0.1 OUTLIER -163.65 -98.13 0.02 OUTLIER 'General case' 0 CA--C 1.534 0.33 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.27 179.736 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . 0.63 HG22 ' N ' ' A' ' 33' ' ' LEU . 20.8 m -168.53 -95.75 0.01 OUTLIER 'General case' 0 CA--C 1.53 0.185 0 N-CA-C 110.495 -0.187 . . . . 0.0 110.495 179.182 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.63 ' N ' HG22 ' A' ' 32' ' ' THR . 0.4 OUTLIER 160.35 -66.1 0.0 OUTLIER 'General case' 0 N--CA 1.463 0.211 0 CA-C-O 120.872 0.368 . . . . 0.0 110.663 179.99 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.667 HD13 ' HG2' ' A' ' 45' ' ' GLU . 1.6 mp 63.91 -169.5 0.19 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.816 -179.836 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 4.1 m120 -57.06 125.96 25.05 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.005 -179.936 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 4.3 m -161.75 -44.55 0.04 OUTLIER 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.868 -179.909 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 10.2 p 55.98 31.4 17.88 Favored 'General case' 0 N--CA 1.463 0.2 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.962 -179.937 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 5.8 m-80 -177.65 -174.25 0.45 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.843 -179.954 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -114.23 86.04 2.34 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.853 179.951 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . 0.459 ' O ' ' N ' ' A' ' 42' ' ' TRP . 36.1 t70 -177.39 58.57 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.866 179.911 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' TRP . . . . . 0.427 ' CD1' ' N ' ' A' ' 41' ' ' TRP . 0.0 OUTLIER 43.85 -89.0 0.01 OUTLIER 'General case' 0 N--CA 1.467 0.386 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.521 179.894 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' TRP . . . . . 0.459 ' N ' ' O ' ' A' ' 40' ' ' ASP . 0.0 OUTLIER 67.76 -73.01 0.09 Allowed 'General case' 0 C--N 1.333 -0.151 0 CA-C-O 120.695 0.283 . . . . 0.0 110.919 179.952 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 4.1 ttpt -138.47 61.98 1.57 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.878 0.37 . . . . 0.0 111.02 -179.903 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . 0.983 HG13 HG22 ' A' ' 53' ' ' VAL . 1.5 p -100.41 139.22 22.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.703 179.768 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . 0.667 ' HG2' HD13 ' A' ' 34' ' ' LEU . 7.7 pt-20 -119.06 166.39 12.95 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.916 179.953 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' VAL . . . . . 0.904 HG22 ' HB3' ' A' ' 31' ' ' LEU . 16.1 t -129.18 84.78 0.84 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.292 -179.876 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER 58.9 107.57 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.975 179.885 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 6.3 p-10 43.38 73.47 0.14 Allowed 'General case' 0 N--CA 1.463 0.222 0 CA-C-N 116.065 -0.516 . . . . 0.0 111.514 179.891 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 12.9 mmm180 -146.42 -177.63 5.73 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.855 179.973 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 1.2 tp-100 -85.54 -69.23 0.67 Allowed 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.076 179.983 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 162.68 -175.79 39.04 Favored Glycine 0 C--N 1.333 0.412 0 C-N-CA 120.869 -0.681 . . . . 0.0 112.521 -179.975 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 52' ' ' PHE . . . . . 0.404 ' CD2' ' O ' ' A' ' 42' ' ' TRP . 0.7 OUTLIER 57.99 105.64 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.79 0.328 . . . . 0.0 110.943 179.997 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 53' ' ' VAL . . . . . 0.983 HG22 HG13 ' A' ' 44' ' ' VAL . 17.0 m -135.4 65.8 63.68 Favored Pre-proline 0 CA--C 1.532 0.275 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.313 179.84 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 54' ' ' PRO . . . . . 0.414 ' HD2' ' CE2' ' A' ' 15' ' ' TYR . 3.2 Cg_exo -74.75 52.99 3.1 Favored 'Trans proline' 0 C--N 1.346 0.432 0 C-N-CA 122.887 2.392 . . . . 0.0 112.048 179.9 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . 0.592 ' HB3' ' O ' ' A' ' 11' ' ' ALA . . . -59.96 -30.24 68.96 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 121.017 0.437 . . . . 0.0 110.825 179.8 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . 0.995 ' HB3' HD23 ' A' ' 12' ' ' LEU . . . -179.12 -163.04 0.05 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.9 -0.591 . . . . 0.0 111.018 179.999 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 57' ' ' TYR . . . . . 0.449 ' CD2' ' N ' ' A' ' 58' ' ' VAL . 48.3 p90 -59.12 -49.37 78.13 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.365 -179.737 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . 0.676 ' N ' HD21 ' A' ' 12' ' ' LEU . 8.5 t 72.24 155.63 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-O 120.894 0.378 . . . . 0.0 110.774 -179.673 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . 0.529 ' CD ' HD11 ' A' ' 10' ' ' LEU . 7.7 ptmt -57.63 176.57 0.13 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.98 -179.902 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 13.2 mmtm -110.86 -34.97 6.09 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.829 179.926 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 58.6 tp 63.29 -78.3 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.085 179.958 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 34.7 m-20 . . . . . 0 C--O 1.249 1.062 0 CA-C-O 118.205 -0.902 . . . . 0.0 110.9 -179.973 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.528 0.119 0 CA-C-O 120.702 0.287 . . . . 0.0 110.827 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.759 ' O ' HG13 ' A' ' 9' ' ' VAL . 2.0 tp 179.95 -73.8 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.396 -0.365 . . . . 0.0 110.93 -179.927 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . 0.759 HG13 ' O ' ' A' ' 8' ' ' LEU . 0.0 OUTLIER 179.44 123.63 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.463 0.209 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.104 -179.95 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . 0.571 HD23 ' N ' ' A' ' 10' ' ' LEU . 0.1 OUTLIER -126.11 142.82 51.37 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.73 179.678 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . 0.677 ' HB3' ' HA2' ' A' ' 28' ' ' GLY . . . -52.07 -25.76 9.41 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.308 -0.405 . . . . 0.0 111.065 179.886 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.629 HD23 ' HA ' ' A' ' 58' ' ' VAL . 0.7 OUTLIER 67.8 -69.64 0.14 Allowed 'General case' 0 N--CA 1.461 0.115 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.868 179.914 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . 0.4 ' CD1' ' OH ' ' A' ' 57' ' ' TYR . 0.2 OUTLIER -73.34 -72.06 0.28 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.846 179.84 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . 0.434 ' O ' ' HG2' ' A' ' 25' ' ' MET . 2.2 p30 167.11 -60.39 0.0 OUTLIER 'General case' 0 N--CA 1.463 0.211 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.976 179.949 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' TYR . . . . . 0.469 ' CG ' ' HA ' ' A' ' 24' ' ' THR . 38.7 p90 -176.67 -163.54 0.1 Allowed 'General case' 0 N--CA 1.463 0.195 0 CA-C-O 120.856 0.36 . . . . 0.0 110.806 -179.779 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . 0.426 ' HG3' ' N ' ' A' ' 17' ' ' GLU . 26.5 pt20 -138.21 -47.47 0.53 Allowed 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.926 179.768 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . 0.433 ' HB2' ' CE2' ' A' ' 15' ' ' TYR . 2.9 tm-20 51.53 29.12 5.11 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.038 -179.883 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 15.4 tptp -110.97 -48.28 3.13 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.943 179.963 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -57.89 164.72 3.01 Favored Pre-proline 0 C--N 1.329 -0.302 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.77 179.935 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' PRO . . . . . 0.429 ' HG2' ' CZ ' ' A' ' 52' ' ' PHE . 18.6 Cg_endo -60.09 -176.42 0.13 Allowed 'Trans proline' 0 C--N 1.345 0.354 0 C-N-CA 122.627 2.218 . . . . 0.0 112.332 179.942 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 5.2 mmm180 61.85 -91.68 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.818 -179.837 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 1.3 mt-10 166.34 175.01 0.03 OUTLIER 'General case' 0 N--CA 1.463 0.198 0 CA-C-O 120.941 0.401 . . . . 0.0 110.905 179.881 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . 0.692 HG22 ' N ' ' A' ' 24' ' ' THR . 1.1 p -178.28 -92.46 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.535 0.403 0 CA-C-N 116.013 -0.54 . . . . 0.0 110.666 179.61 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . 0.692 ' N ' HG22 ' A' ' 23' ' ' VAL . 2.1 t 39.59 81.83 0.02 OUTLIER 'General case' 0 N--CA 1.466 0.355 0 N-CA-C 111.929 0.344 . . . . 0.0 111.929 179.568 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' MET . . . . . 0.434 ' HG2' ' O ' ' A' ' 14' ' ' ASP . 0.0 OUTLIER -97.86 -25.98 14.84 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.413 -0.358 . . . . 0.0 111.377 -179.987 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . 0.417 ' H ' ' HB3' ' A' ' 15' ' ' TYR . 0.1 OUTLIER 61.85 152.47 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.351 -0.386 . . . . 0.0 111.219 179.817 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 23.6 mtmt 63.83 157.32 0.07 Allowed 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.073 -0.512 . . . . 0.0 111.185 179.73 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . 0.677 ' HA2' ' HB3' ' A' ' 11' ' ' ALA . . . -99.26 35.51 4.65 Favored Glycine 0 C--N 1.331 0.251 0 C-N-CA 120.845 -0.693 . . . . 0.0 112.376 179.923 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 63.4 m-20 -60.25 172.55 0.81 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.728 0.299 . . . . 0.0 110.771 179.951 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . 0.568 HG22 ' H ' ' A' ' 31' ' ' LEU . 12.8 mm -86.95 167.31 1.78 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.068 179.982 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.907 HD22 HG11 ' A' ' 44' ' ' VAL . 0.0 OUTLIER -158.13 -94.44 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.897 -179.458 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . 0.653 ' O ' HG13 ' A' ' 44' ' ' VAL . 3.4 t -179.65 -154.46 0.02 OUTLIER 'General case' 0 CA--C 1.53 0.201 0 N-CA-C 110.175 -0.305 . . . . 0.0 110.175 179.808 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.604 ' N ' HG23 ' A' ' 32' ' ' THR . 0.3 OUTLIER -169.7 115.19 0.54 Allowed 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.911 0.386 . . . . 0.0 111.102 179.723 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -59.51 107.28 0.56 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.713 179.848 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 4.2 t-20 65.95 -167.47 0.21 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.64 -179.858 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 3.6 m -62.71 169.57 3.05 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-N 116.332 -0.395 . . . . 0.0 110.835 -179.997 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . 0.456 HG23 ' N ' ' A' ' 38' ' ' ASN . 9.2 t -107.95 -47.65 3.53 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.862 179.912 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' ASN . . . . . 0.456 ' N ' HG23 ' A' ' 37' ' ' THR . 50.9 t30 64.9 -73.36 0.06 Allowed 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.148 179.927 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . 0.406 ' N ' ' O ' ' A' ' 37' ' ' THR . 0.0 OUTLIER -176.66 38.7 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.404 -0.362 . . . . 0.0 110.878 -179.967 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 7.3 m-20 -129.17 153.67 47.5 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.163 -0.472 . . . . 0.0 110.98 -179.978 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' TRP . . . . . 0.462 ' CG ' ' N ' ' A' ' 42' ' ' TRP . 18.3 p90 -58.39 -48.41 80.73 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.876 -179.982 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' TRP . . . . . 0.462 ' N ' ' CG ' ' A' ' 41' ' ' TRP . 77.7 m95 61.75 139.69 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.099 -0.501 . . . . 0.0 111.151 179.912 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . 0.415 ' O ' ' N ' ' A' ' 45' ' ' GLU . 0.1 OUTLIER -56.45 -22.12 29.99 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.361 -179.863 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . 0.907 HG11 HD22 ' A' ' 31' ' ' LEU . 49.1 t 62.7 -77.89 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.228 0 CA-C-N 116.479 -0.328 . . . . 0.0 111.135 -179.908 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . 0.618 ' O ' HG22 ' A' ' 32' ' ' THR . 24.4 mt-10 71.93 161.46 0.24 Allowed 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.053 179.998 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' VAL . . . . . 0.767 HG22 ' OD1' ' A' ' 47' ' ' ASN . 11.2 p -174.46 -47.74 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.175 179.908 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 47' ' ' ASN . . . . . 0.767 ' OD1' HG22 ' A' ' 46' ' ' VAL . 0.6 OUTLIER 169.82 148.86 0.03 OUTLIER 'General case' 0 N--CA 1.463 0.212 0 CA-C-O 120.907 0.384 . . . . 0.0 111.042 179.885 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 44.6 m-20 55.43 25.64 7.95 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.035 -0.53 . . . . 0.0 111.356 179.72 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -165.53 -81.35 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.473 -0.33 . . . . 0.0 110.85 179.865 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . 0.415 ' HA ' ' CB ' ' A' ' 45' ' ' GLU . 2.1 tt0 52.24 94.18 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.457 179.79 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 133.86 128.03 2.81 Favored Glycine 0 C--N 1.333 0.38 0 C-N-CA 120.683 -0.77 . . . . 0.0 113.107 179.642 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 52' ' ' PHE . . . . . 0.429 ' CZ ' ' HG2' ' A' ' 20' ' ' PRO . 24.1 m-85 60.75 111.97 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.977 0.417 . . . . 0.0 111.746 179.393 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 53' ' ' VAL . . . . . 0.406 HG23 ' O ' ' A' ' 52' ' ' PHE . 76.9 t -157.73 90.93 2.3 Favored Pre-proline 0 C--N 1.329 -0.3 0 CA-C-N 115.861 -0.609 . . . . 0.0 110.285 179.499 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 31.6 Cg_exo -59.41 134.23 57.27 Favored 'Trans proline' 0 C--N 1.347 0.463 0 C-N-CA 122.797 2.331 . . . . 0.0 112.414 -179.544 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -99.96 63.3 1.18 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.782 179.625 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . 0.658 ' HB3' ' CE1' ' A' ' 57' ' ' TYR . . . -47.08 -29.73 2.35 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.156 -0.474 . . . . 0.0 111.262 -179.83 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 57' ' ' TYR . . . . . 0.658 ' CE1' ' HB3' ' A' ' 56' ' ' ALA . 0.0 OUTLIER -157.41 -74.84 0.09 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.375 179.922 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . 0.629 ' HA ' HD23 ' A' ' 12' ' ' LEU . 0.2 OUTLIER 52.48 -179.51 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.079 -0.51 . . . . 0.0 111.15 179.745 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . 0.528 ' H ' HG12 ' A' ' 58' ' ' VAL . 0.0 OUTLIER -85.06 153.11 22.94 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.91 -179.959 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -62.43 -37.08 84.47 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.152 -0.477 . . . . 0.0 110.876 -179.993 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . 0.637 HD23 ' O ' ' A' ' 8' ' ' LEU . 0.6 OUTLIER 59.82 105.55 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.942 -179.988 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 2.8 p30 . . . . . 0 C--O 1.248 1.006 0 CA-C-O 118.219 -0.896 . . . . 0.0 110.94 179.976 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 2.1 tp10 . . . . . 0 C--O 1.232 0.152 0 CA-C-O 120.721 0.296 . . . . 0.0 110.816 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.555 ' N ' HD22 ' A' ' 8' ' ' LEU . 3.1 mm? -97.65 -80.24 0.45 Allowed 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.959 -179.97 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . 0.783 HG21 HD11 ' A' ' 33' ' ' LEU . 23.4 m -151.93 -148.14 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.45 -0.454 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.595 -179.651 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . 0.692 HD22 ' CE ' ' A' ' 59' ' ' LYS . 0.9 OUTLIER -169.07 31.41 0.02 OUTLIER 'General case' 0 C--N 1.334 -0.082 0 CA-C-O 120.808 0.337 . . . . 0.0 111.173 -179.993 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . 61.07 -81.55 0.02 OUTLIER 'General case' 0 CA--C 1.529 0.15 0 CA-C-N 116.22 -0.446 . . . . 0.0 111.261 179.817 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.746 HD12 ' HA ' ' A' ' 58' ' ' VAL . 1.0 OUTLIER 64.81 -77.29 0.04 OUTLIER 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 116.387 -0.37 . . . . 0.0 110.853 -179.786 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . 0.465 ' HB2' ' HB3' ' A' ' 56' ' ' ALA . 1.2 m-85 -103.72 62.88 0.77 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 121.083 0.468 . . . . 0.0 110.606 179.775 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . 0.612 ' OD2' HD21 ' A' ' 31' ' ' LEU . 14.0 m-20 -126.38 70.23 1.24 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.042 -0.527 . . . . 0.0 111.075 -179.948 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' TYR . . . . . 0.415 ' CD2' ' O ' ' A' ' 15' ' ' TYR . 84.0 t80 -145.5 63.41 1.27 Allowed 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.893 -179.973 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER 179.15 170.86 0.92 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.924 179.926 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 27.8 tp10 -177.42 -73.57 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.727 179.967 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -125.03 -176.92 3.69 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.895 179.876 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . 0.42 ' CB ' ' CD ' ' A' ' 20' ' ' PRO . 2.2 t -60.8 -62.49 5.87 Favored Pre-proline 0 C--N 1.33 -0.257 0 CA-C-N 116.332 -0.395 . . . . 0.0 110.952 179.994 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' PRO . . . . . 0.42 ' CD ' ' CB ' ' A' ' 19' ' ' SER . 20.4 Cg_endo -62.38 -75.36 0.02 OUTLIER 'Trans proline' 0 C--N 1.347 0.463 0 C-N-CA 122.388 2.059 . . . . 0.0 112.323 -179.917 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER 177.61 160.83 0.49 Allowed 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.515 -0.311 . . . . 0.0 110.782 179.993 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 49.0 tt0 -176.72 -71.51 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.956 179.923 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . 0.415 HG13 ' CG ' ' A' ' 47' ' ' ASN . 21.5 t -106.74 147.17 12.34 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.262 -0.427 . . . . 0.0 111.114 -179.971 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -178.76 107.54 0.04 OUTLIER 'General case' 0 C--N 1.333 -0.11 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.023 179.927 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -160.98 125.91 3.65 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.873 179.875 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 1.8 mmmm -128.89 -160.73 1.05 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.956 -179.675 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 5.0 tttm 78.89 -179.67 0.11 Allowed 'General case' 0 N--CA 1.464 0.229 0 CA-C-O 120.864 0.364 . . . . 0.0 110.953 -179.883 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -57.03 -20.12 33.18 Favored Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.934 -0.65 . . . . 0.0 112.896 -179.768 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -47.91 134.66 13.21 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.762 0.315 . . . . 0.0 111.202 -179.85 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . 0.608 HG23 ' C ' ' A' ' 9' ' ' VAL . 0.3 OUTLIER -104.92 -168.55 0.25 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.88 179.989 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 1.027 HD22 HG11 ' A' ' 44' ' ' VAL . 0.0 OUTLIER -146.04 -82.26 0.14 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.917 -179.808 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . 0.509 HG23 ' H ' ' A' ' 33' ' ' LEU . 0.7 OUTLIER 165.97 -56.67 0.0 OUTLIER 'General case' 0 N--CA 1.466 0.33 0 CA-C-O 120.893 0.378 . . . . 0.0 110.692 -179.939 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.783 HD11 HG21 ' A' ' 9' ' ' VAL . 0.3 OUTLIER 58.91 98.89 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.965 179.91 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.457 HD22 ' HD2' ' A' ' 43' ' ' LYS . 1.2 pt? -57.47 -167.19 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.977 179.929 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 7.0 p-10 -59.08 88.58 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.897 179.988 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 11.0 t -59.68 159.97 7.93 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.956 179.908 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 1.4 t -140.29 117.68 11.4 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.832 -179.986 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 16.4 m-80 -60.76 89.91 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.877 179.987 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -177.41 -39.78 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.835 179.953 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 9.1 p-10 -130.79 -175.4 3.65 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.958 -179.918 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' TRP . . . . . 0.479 ' O ' ' CG ' ' A' ' 42' ' ' TRP . 0.1 OUTLIER -80.88 -0.9 41.13 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.381 -179.988 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' TRP . . . . . 0.479 ' CG ' ' O ' ' A' ' 41' ' ' TRP . 32.2 p90 45.79 -172.92 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.247 0 CA-C-O 120.853 0.358 . . . . 0.0 111.34 -179.971 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . 0.457 ' HD2' HD22 ' A' ' 34' ' ' LEU . 0.0 OUTLIER -126.36 162.92 24.42 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.003 -179.773 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . 1.027 HG11 HD22 ' A' ' 31' ' ' LEU . 11.1 t -144.23 157.69 15.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.061 -0.518 . . . . 0.0 111.105 179.99 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . 0.569 ' O ' HG12 ' A' ' 46' ' ' VAL . 5.5 mm-40 -101.68 -165.29 1.18 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.827 -179.91 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' VAL . . . . . 0.586 ' O ' HG13 ' A' ' 46' ' ' VAL . 0.4 OUTLIER 80.07 7.81 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.532 0.265 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.43 179.983 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 47' ' ' ASN . . . . . 0.415 ' CG ' HG13 ' A' ' 23' ' ' VAL . 3.0 t-20 -113.8 -36.22 4.9 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.852 0.358 . . . . 0.0 110.953 179.921 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER 73.55 7.03 5.09 Favored 'General case' 0 CA--C 1.532 0.285 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.328 -179.966 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -87.77 -70.24 0.64 Allowed 'General case' 0 C--O 1.231 0.122 0 CA-C-O 120.881 0.372 . . . . 0.0 110.826 179.851 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 2.4 tt0 -164.31 -68.89 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.9 -179.926 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 171.22 -153.25 20.08 Favored Glycine 0 C--N 1.332 0.341 0 C-N-CA 120.857 -0.687 . . . . 0.0 112.523 -179.982 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 10.8 m-85 60.62 113.41 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.773 0.32 . . . . 0.0 110.956 -179.976 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 53' ' ' VAL . . . . . 0.806 HG21 ' HB ' ' A' ' 44' ' ' VAL . 21.4 t -141.64 136.96 15.85 Favored Pre-proline 0 C--N 1.329 -0.311 0 CA-C-N 116.382 -0.372 . . . . 0.0 111.282 -179.96 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 54' ' ' PRO . . . . . 0.474 ' O ' ' HB3' ' A' ' 55' ' ' ALA . 47.5 Cg_exo -55.73 -55.08 3.28 Favored 'Trans proline' 0 C--N 1.347 0.498 0 C-N-CA 122.586 2.191 . . . . 0.0 112.294 179.93 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . 0.474 ' HB3' ' O ' ' A' ' 54' ' ' PRO . . . 71.96 -62.3 0.47 Allowed 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.375 -179.982 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . 0.468 ' HB3' ' O ' ' A' ' 55' ' ' ALA . . . 70.76 -70.89 0.14 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.132 -179.822 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 57' ' ' TYR . . . . . 0.456 ' CD1' ' N ' ' A' ' 57' ' ' TYR . 0.8 OUTLIER -149.25 -62.87 0.23 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.999 179.766 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . 0.746 ' HA ' HD12 ' A' ' 12' ' ' LEU . 7.7 p 39.8 49.56 0.31 Allowed 'Isoleucine or valine' 0 CA--C 1.53 0.206 0 CA-C-N 116.218 -0.446 . . . . 0.0 112.113 179.861 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . 0.692 ' CE ' HD22 ' A' ' 10' ' ' LEU . 15.5 mttm 74.8 30.64 0.96 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.76 -179.688 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 62.77 -79.97 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.895 -179.757 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 13.1 tp -178.62 78.99 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.834 179.857 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 39.8 m-20 . . . . . 0 C--O 1.249 1.077 0 CA-C-O 118.29 -0.862 . . . . 0.0 110.916 179.938 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 4.5 pm0 . . . . . 0 N--CA 1.462 0.156 0 CA-C-O 120.923 0.392 . . . . 0.0 111.481 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 1.8 mt 56.66 -160.65 0.21 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.992 -179.864 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . 0.591 HG21 HD21 ' A' ' 33' ' ' LEU . 22.3 t -144.28 -38.63 0.14 Allowed 'Isoleucine or valine' 0 N--CA 1.454 -0.242 0 CA-C-N 115.91 -0.586 . . . . 0.0 111.381 179.849 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . 0.436 ' HA ' HD13 ' A' ' 30' ' ' ILE . 3.2 mt 67.79 159.45 0.15 Allowed 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.365 -0.38 . . . . 0.0 110.546 -179.618 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . 0.737 ' HB3' ' O ' ' A' ' 26' ' ' LYS . . . -108.79 -24.59 11.22 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.931 179.702 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.819 HD12 ' HA ' ' A' ' 58' ' ' VAL . 27.4 mt 52.54 50.17 18.82 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-N 116.196 -0.457 . . . . 0.0 111.003 179.997 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . 0.407 ' CD2' ' HG2' ' A' ' 27' ' ' LYS . 3.6 t80 75.65 152.31 0.13 Allowed 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 115.907 -0.588 . . . . 0.0 111.09 -179.989 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . 0.413 ' OD1' ' N ' ' A' ' 14' ' ' ASP . 0.4 OUTLIER -45.81 155.32 0.18 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.921 -0.581 . . . . 0.0 111.374 179.837 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' TYR . . . . . 0.605 ' HE1' ' HB3' ' A' ' 56' ' ' ALA . 42.5 t80 -71.17 -66.57 0.6 Allowed 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.787 -179.966 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . 0.405 ' O ' ' CB ' ' A' ' 17' ' ' GLU . 18.5 tt0 -177.46 -34.51 0.01 OUTLIER 'General case' 0 CA--C 1.53 0.201 0 CA-C-N 116.306 -0.406 . . . . 0.0 111.469 -179.75 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . 0.652 ' CG ' HG21 ' A' ' 24' ' ' THR . 34.3 mt-10 82.27 161.82 0.14 Allowed 'General case' 0 N--CA 1.467 0.408 0 CA-C-N 116.277 -0.419 . . . . 0.0 110.753 -179.618 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -101.68 -68.84 0.8 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.028 -179.838 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . 0.484 ' N ' ' HD2' ' A' ' 20' ' ' PRO . 3.6 t 174.98 -60.73 0.0 OUTLIER Pre-proline 0 C--N 1.332 -0.168 0 CA-C-N 116.423 -0.353 . . . . 0.0 111.308 -179.832 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' PRO . . . . . 0.484 ' HD2' ' N ' ' A' ' 19' ' ' SER . 9.7 Cg_endo -51.96 -76.31 0.02 OUTLIER 'Trans proline' 0 C--N 1.349 0.567 0 C-N-CA 122.655 2.237 . . . . 0.0 112.568 -179.593 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -95.3 -82.45 0.38 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.631 -0.259 . . . . 0.0 110.999 -179.72 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 13.9 tt0 -178.06 -75.96 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.667 0.27 . . . . 0.0 111.054 -179.981 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . 0.765 HG22 ' HB3' ' A' ' 49' ' ' ARG . 35.4 t 59.7 78.92 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.243 0 CA-C-N 116.504 -0.317 . . . . 0.0 111.007 -179.883 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . 0.652 HG21 ' CG ' ' A' ' 17' ' ' GLU . 41.7 p -158.87 177.11 11.52 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-O 121.022 0.439 . . . . 0.0 111.496 -179.657 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' MET . . . . . 0.719 ' CE ' HG21 ' A' ' 44' ' ' VAL . 0.1 OUTLIER -98.87 -161.45 0.88 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.684 -0.689 . . . . 0.0 110.329 179.541 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . 0.737 ' O ' ' HB3' ' A' ' 11' ' ' ALA . 3.2 mmtp -147.88 174.35 11.94 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.84 0.353 . . . . 0.0 111.124 179.516 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . 0.407 ' HG2' ' CD2' ' A' ' 13' ' ' TYR . 21.7 mtmm -57.37 102.14 0.08 Allowed 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.453 -179.854 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 45.5 37.05 6.33 Favored Glycine 0 C--N 1.332 0.32 0 C-N-CA 121.065 -0.588 . . . . 0.0 113.032 179.766 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 33.5 t0 -90.24 15.6 10.12 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.742 0.306 . . . . 0.0 111.396 179.817 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . 0.707 HG22 ' H ' ' A' ' 31' ' ' LEU . 2.4 mm 54.45 174.91 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.2 0 CA-C-O 120.943 0.401 . . . . 0.0 111.378 179.908 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.707 ' H ' HG22 ' A' ' 30' ' ' ILE . 0.0 OUTLIER -177.84 -170.85 0.27 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.383 -179.313 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . 0.595 ' N ' HD22 ' A' ' 31' ' ' LEU . 86.8 m -122.94 163.06 21.09 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-O 121.12 0.486 . . . . 0.0 111.159 179.924 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.73 HD22 ' N ' ' A' ' 33' ' ' LEU . 0.6 OUTLIER -120.93 -61.06 1.6 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.881 -0.599 . . . . 0.0 110.955 -179.762 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER 61.88 115.84 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.92 179.978 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 92.9 m-20 60.77 87.59 0.09 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.926 179.965 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 9.2 m -163.36 166.1 23.31 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.807 -179.988 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 4.2 m -145.87 -65.18 0.31 Allowed 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.015 179.975 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 18.9 p-10 -142.56 -49.14 0.35 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.907 -179.953 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -123.56 92.83 3.77 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.861 -179.915 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . 0.44 ' HB2' ' CE3' ' A' ' 42' ' ' TRP . 5.1 p30 -177.68 165.81 2.11 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.174 -0.467 . . . . 0.0 110.915 179.854 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' TRP . . . . . . . . . . . . . 10.2 p90 -134.54 -47.61 0.76 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.875 179.931 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' TRP . . . . . 0.44 ' CE3' ' HB2' ' A' ' 40' ' ' ASP . 1.0 OUTLIER 62.17 -81.24 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.99 179.987 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 5.2 pttt -178.32 103.1 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.811 179.915 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . 0.719 HG21 ' CE ' ' A' ' 25' ' ' MET . 11.7 t -49.31 -41.89 15.31 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.899 179.816 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 3.8 tt0 58.28 41.35 23.5 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.112 -0.495 . . . . 0.0 111.238 179.689 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' VAL . . . . . 0.4 HG12 ' CG1' ' A' ' 44' ' ' VAL . 14.4 p -102.77 -24.09 4.16 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-O 120.92 0.39 . . . . 0.0 110.959 179.599 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 5.6 p30 -100.08 -171.23 2.0 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.617 179.664 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 23.2 t0 -109.91 63.26 0.6 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.811 0.339 . . . . 0.0 111.037 -179.879 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . 0.765 ' HB3' HG22 ' A' ' 23' ' ' VAL . 54.6 ttt-85 -177.14 104.81 0.05 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.073 179.883 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 24.2 tp60 61.94 -81.57 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.121 -0.49 . . . . 0.0 111.043 179.763 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 127.75 -2.02 6.92 Favored Glycine 0 C--N 1.334 0.448 0 C-N-CA 120.795 -0.717 . . . . 0.0 112.962 -179.869 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 2.2 m-85 -44.66 -82.0 0.01 OUTLIER 'General case' 0 CA--C 1.53 0.178 0 CA-C-N 116.825 0.313 . . . . 0.0 111.395 -179.816 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 53' ' ' VAL . . . . . 0.663 HG11 ' SD ' ' A' ' 25' ' ' MET . 2.8 t 49.47 84.62 0.2 Allowed Pre-proline 0 C--N 1.332 -0.186 0 CA-C-N 116.467 -0.333 . . . . 0.0 111.308 179.912 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 54' ' ' PRO . . . . . 0.449 ' HB2' ' CZ ' ' A' ' 15' ' ' TYR . 56.1 Cg_exo -51.29 139.94 43.44 Favored 'Trans proline' 0 C--N 1.345 0.393 0 C-N-CA 122.54 2.16 . . . . 0.0 112.177 179.886 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -86.95 55.81 3.73 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.336 -179.757 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . 0.605 ' HB3' ' HE1' ' A' ' 15' ' ' TYR . . . -94.62 36.91 1.14 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.433 179.209 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -175.79 -168.68 0.3 Allowed 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.655 -179.239 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . 0.819 ' HA ' HD12 ' A' ' 12' ' ' LEU . 48.3 t 63.37 157.13 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.575 178.868 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . 0.748 ' HD3' HD21 ' A' ' 61' ' ' LEU . 10.0 ptpt -55.92 120.5 7.51 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.945 179.952 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -71.7 96.73 1.63 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.866 -179.9 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . 0.748 HD21 ' HD3' ' A' ' 59' ' ' LYS . 1.4 pp -177.07 173.5 1.81 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.913 179.941 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 14.7 t0 . . . . . 0 C--O 1.249 1.058 0 CA-C-O 118.243 -0.885 . . . . 0.0 110.863 179.957 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . 0.686 ' C ' HD13 ' A' ' 8' ' ' LEU . 0.3 OUTLIER . . . . . 0 C--O 1.231 0.129 0 CA-C-O 120.816 0.341 . . . . 0.0 110.923 . . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.687 ' N ' HD13 ' A' ' 8' ' ' LEU . 0.0 OUTLIER -156.34 150.85 25.68 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.869 -179.989 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . 0.822 HG12 HG11 ' A' ' 58' ' ' VAL . 98.9 t -111.99 -95.32 0.1 OUTLIER 'Isoleucine or valine' 0 CA--C 1.534 0.362 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.167 -179.965 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . 0.681 HD12 ' HD3' ' A' ' 59' ' ' LYS . 2.0 mt 166.49 -54.56 0.0 OUTLIER 'General case' 0 N--CA 1.464 0.233 0 CA-C-O 120.882 0.372 . . . . 0.0 110.92 179.953 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . 0.576 ' HB1' ' CE ' ' A' ' 25' ' ' MET . . . 64.66 43.79 4.12 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.942 -179.473 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.676 HD13 ' H ' ' A' ' 12' ' ' LEU . 0.0 OUTLIER -56.99 155.98 7.44 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.086 -179.999 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . 0.4 ' CD2' ' OH ' ' A' ' 57' ' ' TYR . 0.1 OUTLIER 77.88 -5.16 2.14 Favored 'General case' 0 N--CA 1.463 0.218 0 CA-C-N 116.005 -0.543 . . . . 0.0 111.777 -179.907 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . 0.44 ' HB3' ' HA ' ' A' ' 26' ' ' LYS . 5.8 p-10 43.47 95.77 0.01 OUTLIER 'General case' 0 N--CA 1.462 0.146 0 CA-C-O 120.893 0.378 . . . . 0.0 111.657 179.799 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' TYR . . . . . 0.425 ' CZ ' ' HG2' ' A' ' 54' ' ' PRO . 10.3 t80 -74.44 116.11 14.75 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.069 -179.915 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 5.6 pt20 -88.04 -166.0 1.47 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.679 179.867 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . 0.441 ' HB3' ' HA ' ' A' ' 22' ' ' GLU . 1.6 pt-20 -101.3 111.08 23.2 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.897 -179.94 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -154.19 23.8 0.49 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.345 -0.389 . . . . 0.0 111.253 -179.999 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . 0.411 ' CB ' ' CD ' ' A' ' 20' ' ' PRO . 2.2 t 172.98 -62.73 0.0 OUTLIER Pre-proline 0 C--N 1.332 -0.19 0 CA-C-N 116.475 -0.33 . . . . 0.0 110.949 179.735 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' PRO . . . . . 0.411 ' CD ' ' CB ' ' A' ' 19' ' ' SER . 19.1 Cg_endo -61.53 -66.79 0.05 OUTLIER 'Trans proline' 0 C--N 1.348 0.5 0 C-N-CA 122.451 2.101 . . . . 0.0 112.376 -179.972 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 1.8 ttt180 -179.87 -166.63 0.08 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.889 179.998 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . 0.441 ' HA ' ' HB3' ' A' ' 17' ' ' GLU . 2.2 mp0 -79.28 81.76 5.51 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.93 -179.98 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . 0.516 HG11 ' O ' ' A' ' 51' ' ' GLY . 27.2 m -134.93 134.82 53.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.399 179.951 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 18.0 m -130.83 154.29 48.2 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.76 179.928 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' MET . . . . . 0.576 ' CE ' ' HB1' ' A' ' 11' ' ' ALA . 31.2 mtm -150.09 57.49 0.96 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.959 0.409 . . . . 0.0 110.959 -179.94 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . 0.44 ' HA ' ' HB3' ' A' ' 14' ' ' ASP . 2.4 tppt? -40.44 120.77 1.29 Allowed 'General case' 0 N--CA 1.465 0.312 0 CA-C-N 115.899 -0.591 . . . . 0.0 111.908 -179.789 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 4.6 mptt 53.61 174.15 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.011 -0.54 . . . . 0.0 111.44 179.624 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . 0.646 ' HA3' HD22 ' A' ' 10' ' ' LEU . . . -82.34 61.45 4.71 Favored Glycine 0 N--CA 1.452 -0.299 0 C-N-CA 120.904 -0.665 . . . . 0.0 112.241 179.786 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -96.87 29.86 2.89 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.909 0.385 . . . . 0.0 110.883 179.91 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . 0.58 HD13 ' N ' ' A' ' 30' ' ' ILE . 0.4 OUTLIER 51.97 178.08 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.238 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.187 -179.939 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.897 ' HB2' HG22 ' A' ' 46' ' ' VAL . 0.0 OUTLIER -164.69 18.82 0.05 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.893 -179.057 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . 0.566 HG22 ' H ' ' A' ' 33' ' ' LEU . 0.6 OUTLIER 52.02 178.2 0.02 OUTLIER 'General case' 0 N--CA 1.465 0.275 0 CA-C-O 120.858 0.361 . . . . 0.0 111.165 179.924 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.615 HD21 HG23 ' A' ' 9' ' ' VAL . 1.0 OUTLIER -179.85 163.99 1.16 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.927 0.394 . . . . 0.0 111.102 -179.981 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.519 ' N ' HD12 ' A' ' 34' ' ' LEU . 4.1 mp -102.16 35.38 2.41 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.938 -0.574 . . . . 0.0 110.798 179.935 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 1.7 m-20 64.68 134.76 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.919 -179.961 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . 0.697 ' O ' HG23 ' A' ' 37' ' ' THR . 4.6 m -103.4 -172.73 2.16 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.905 179.918 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . 0.697 HG23 ' O ' ' A' ' 36' ' ' SER . 0.3 OUTLIER -177.22 67.89 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.984 179.971 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 35.7 t-20 -172.81 -94.01 0.01 OUTLIER 'General case' 0 CA--C 1.532 0.27 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.773 179.789 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER 173.58 38.4 0.0 OUTLIER 'General case' 0 C--O 1.232 0.179 0 CA-C-O 120.672 0.272 . . . . 0.0 111.071 179.904 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . 0.479 ' O ' ' CG ' ' A' ' 41' ' ' TRP . 2.4 p-10 176.26 87.22 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.571 -0.286 . . . . 0.0 111.088 179.881 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 41' ' ' TRP . . . . . 0.49 ' CH2' ' CD2' ' A' ' 52' ' ' PHE . 66.8 p-90 45.69 -174.89 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.285 0 CA-C-N 116.07 -0.514 . . . . 0.0 111.603 179.833 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 42' ' ' TRP . . . . . . . . . . . . . 1.3 m95 175.82 86.38 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.833 -179.989 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 9.7 mttp 59.16 61.61 2.04 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.878 179.842 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . 0.856 HG13 HD23 ' A' ' 31' ' ' LEU . 82.0 t -77.72 83.36 0.88 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.942 179.827 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 6.3 mp0 -101.75 101.72 12.25 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.939 -179.89 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 46' ' ' VAL . . . . . 0.897 HG22 ' HB2' ' A' ' 31' ' ' LEU . 11.7 t -58.85 -30.47 42.82 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.047 179.858 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 63.4 m-20 -150.97 -57.36 0.16 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.773 179.888 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 48' ' ' ASP . . . . . 0.402 ' O ' ' HD2' ' A' ' 49' ' ' ARG . 8.9 p-10 -179.2 149.2 0.4 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.055 -0.521 . . . . 0.0 110.878 179.902 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . 0.466 ' HG2' ' O ' ' A' ' 49' ' ' ARG . 0.0 OUTLIER 76.21 -9.33 1.48 Allowed 'General case' 0 CA--C 1.536 0.405 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.629 179.901 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 24.0 mm-40 -94.37 -168.73 1.9 Allowed 'General case' 0 C--N 1.332 -0.17 0 CA-C-O 120.786 0.327 . . . . 0.0 110.835 179.636 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . 0.516 ' O ' HG11 ' A' ' 23' ' ' VAL . . . 134.65 166.76 11.26 Favored Glycine 0 C--N 1.334 0.442 0 C-N-CA 120.812 -0.708 . . . . 0.0 112.693 179.877 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 52' ' ' PHE . . . . . 0.49 ' CD2' ' CH2' ' A' ' 41' ' ' TRP . 5.2 m-85 62.86 107.9 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.839 0.352 . . . . 0.0 111.161 179.855 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 53' ' ' VAL . . . . . 0.819 ' CG2' HG21 ' A' ' 44' ' ' VAL . 30.2 m -155.88 105.0 2.12 Favored Pre-proline 0 CA--C 1.531 0.242 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.146 179.752 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 54' ' ' PRO . . . . . 0.425 ' HG2' ' CZ ' ' A' ' 15' ' ' TYR . 32.1 Cg_exo -59.02 93.97 0.08 OUTLIER 'Trans proline' 0 C--N 1.346 0.446 0 C-N-CA 122.539 2.16 . . . . 0.0 112.368 -179.775 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -61.47 89.94 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.912 179.826 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -53.04 -80.26 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.209 -0.451 . . . . 0.0 111.174 -179.793 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 57' ' ' TYR . . . . . 0.553 ' O ' HD11 ' A' ' 12' ' ' LEU . 20.2 p90 -133.57 98.09 4.11 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.39 -0.368 . . . . 0.0 110.729 179.802 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . 0.822 HG11 HG12 ' A' ' 9' ' ' VAL . 1.8 t -133.11 167.97 25.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.371 -179.709 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . 0.681 ' HD3' HD12 ' A' ' 10' ' ' LEU . 0.0 OUTLIER -79.74 148.21 31.59 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.862 179.817 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 64.41 -75.77 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.049 -179.971 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . 0.613 HD23 ' O ' ' A' ' 61' ' ' LEU . 1.1 tt 60.49 33.37 20.58 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.377 -0.374 . . . . 0.0 110.946 179.885 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 6.5 t0 . . . . . 0 C--O 1.249 1.058 0 CA-C-O 118.27 -0.871 . . . . 0.0 110.894 179.984 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 2.4 tt0 . . . . . 0 C--O 1.231 0.104 0 CA-C-O 120.832 0.348 . . . . 0.0 110.828 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.677 ' O ' HG13 ' A' ' 9' ' ' VAL . 0.1 OUTLIER -145.3 -46.09 0.22 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.977 -179.999 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . 0.925 HG21 HD11 ' A' ' 33' ' ' LEU . 0.7 OUTLIER -164.36 172.64 0.22 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.195 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.074 -179.93 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . 0.571 HD11 ' CD ' ' A' ' 59' ' ' LYS . 0.4 OUTLIER -132.36 -37.94 1.07 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.51 -179.785 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . 0.794 ' HB1' ' CZ ' ' A' ' 13' ' ' TYR . . . 73.52 67.39 0.1 Allowed 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 121.018 0.437 . . . . 0.0 110.123 -178.972 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.496 ' H ' HG23 ' A' ' 58' ' ' VAL . 1.2 mp -80.55 12.15 3.27 Favored 'General case' 0 CA--C 1.531 0.213 0 CA-C-N 115.938 -0.574 . . . . 0.0 111.707 -179.639 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . 0.805 ' CD2' HG21 ' A' ' 44' ' ' VAL . 0.0 OUTLIER -50.8 177.61 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.171 0 CA-C-O 120.903 0.382 . . . . 0.0 111.175 179.983 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 9.7 p30 -173.14 36.85 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.755 179.859 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' TYR . . . . . 0.4 ' CD1' ' N ' ' A' ' 16' ' ' GLN . 7.1 t80 -83.73 153.49 24.13 Favored 'General case' 0 C--N 1.333 -0.15 0 CA-C-N 116.086 -0.506 . . . . 0.0 111.1 -179.849 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . 0.4 ' N ' ' CD1' ' A' ' 15' ' ' TYR . 10.0 mp0 -145.87 90.16 1.96 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.865 179.908 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 4.4 tt0 -98.33 27.66 4.56 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.35 -0.387 . . . . 0.0 111.146 -179.76 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 55.61 -163.89 0.14 Allowed 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.395 -0.366 . . . . 0.0 110.897 179.828 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER 65.33 149.89 0.12 Allowed Pre-proline 0 C--N 1.331 -0.202 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.992 -179.936 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 52.4 Cg_endo -69.25 -46.41 1.44 Allowed 'Trans proline' 0 C--N 1.345 0.393 0 C-N-CA 122.647 2.231 . . . . 0.0 112.418 -179.965 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 4.8 ptt85 -130.41 108.31 9.89 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.921 -179.968 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -176.92 -79.56 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.868 179.946 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . 0.63 HG13 ' O ' ' A' ' 52' ' ' PHE . 38.8 t -148.02 110.64 0.68 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.078 -179.978 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 2.7 t -179.17 104.52 0.03 OUTLIER 'General case' 0 N--CA 1.462 0.16 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.954 179.941 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' MET . . . . . 0.425 ' HG2' ' CE2' ' A' ' 13' ' ' TYR . 2.2 mpp? -140.03 170.44 15.85 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.98 179.888 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -176.07 -179.37 1.12 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.876 179.979 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 13.1 mmmt 71.18 -169.75 0.15 Allowed 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.938 -179.994 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -116.06 25.04 9.64 Favored Glycine 0 C--N 1.332 0.337 0 C-N-CA 120.815 -0.707 . . . . 0.0 112.622 -179.842 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . 0.471 ' O ' ' HB3' ' A' ' 11' ' ' ALA . 56.4 t0 -65.3 120.97 13.75 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.841 0.353 . . . . 0.0 110.582 179.769 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . 0.643 HG23 ' O ' ' A' ' 9' ' ' VAL . 5.2 mt -59.71 166.49 0.62 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.114 -179.684 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.781 HD13 HD21 ' A' ' 33' ' ' LEU . 0.0 OUTLIER -148.22 -167.37 2.79 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.132 -178.928 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . 0.493 HG23 ' N ' ' A' ' 33' ' ' LEU . 14.8 t -102.36 -47.94 4.33 Favored 'General case' 0 C--N 1.333 -0.127 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.849 179.964 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.925 HD11 HG21 ' A' ' 9' ' ' VAL . 0.2 OUTLIER 64.99 170.86 0.2 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.844 179.81 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.419 HD23 ' N ' ' A' ' 35' ' ' ASN . 0.8 OUTLIER -93.05 -77.43 0.44 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.985 179.984 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 35' ' ' ASN . . . . . 0.419 ' N ' HD23 ' A' ' 34' ' ' LEU . 20.0 t-20 -138.03 -44.24 0.52 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.952 -179.936 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 3.1 t 69.02 112.25 0.05 OUTLIER 'General case' 0 N--CA 1.462 0.168 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.866 179.991 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 8.9 t -177.5 160.8 1.66 Allowed 'General case' 0 C--O 1.231 0.124 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.815 179.873 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 8.7 m120 60.41 172.82 0.09 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.888 -179.913 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -114.83 107.63 15.67 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.986 -180.0 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . 0.46 ' O ' ' N ' ' A' ' 42' ' ' TRP . 1.5 m-20 -178.63 81.44 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.081 -0.508 . . . . 0.0 110.893 179.944 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 41' ' ' TRP . . . . . 0.576 ' CG ' ' N ' ' A' ' 42' ' ' TRP . 0.0 OUTLIER 65.18 -65.05 0.16 Allowed 'General case' 0 CA--C 1.532 0.258 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.931 -179.906 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 42' ' ' TRP . . . . . 0.576 ' N ' ' CG ' ' A' ' 41' ' ' TRP . 3.8 t-105 57.89 115.93 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.189 -0.46 . . . . 0.0 111.402 -179.869 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . 0.445 ' HG3' ' CZ3' ' A' ' 42' ' ' TRP . 2.5 ptpp? -71.95 -177.21 1.94 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.373 179.417 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . 0.805 HG21 ' CD2' ' A' ' 13' ' ' TYR . 0.3 OUTLIER -118.53 -40.87 2.28 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-O 120.868 0.366 . . . . 0.0 111.131 179.975 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER 61.49 114.1 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.022 -179.964 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 46' ' ' VAL . . . . . 0.638 HG22 HD23 ' A' ' 31' ' ' LEU . 21.4 t -141.04 -57.31 0.25 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.048 179.88 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 7.9 m-80 -129.81 -174.82 3.41 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.752 179.93 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 16.6 m-20 -68.44 73.22 0.22 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.886 179.984 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -156.01 26.94 0.37 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.959 -179.954 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER 56.94 -167.61 0.12 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.393 -0.367 . . . . 0.0 110.943 179.919 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -91.18 -108.58 1.5 Allowed Glycine 0 C--N 1.332 0.349 0 C-N-CA 120.958 -0.639 . . . . 0.0 112.538 179.993 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 52' ' ' PHE . . . . . 0.63 ' O ' HG13 ' A' ' 23' ' ' VAL . 19.6 m-85 55.41 79.53 0.15 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.86 0.362 . . . . 0.0 110.562 -179.941 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 53' ' ' VAL . . . . . 0.492 HG13 ' HB ' ' A' ' 44' ' ' VAL . 1.5 p 179.0 92.73 0.17 Allowed Pre-proline 0 C--N 1.327 -0.377 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.708 -179.498 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_exo -52.56 130.85 38.41 Favored 'Trans proline' 0 C--N 1.346 0.424 0 C-N-CA 122.535 2.156 . . . . 0.0 112.295 -179.878 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -64.15 -52.37 59.37 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.057 -0.519 . . . . 0.0 110.969 -179.979 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . 0.439 ' O ' ' HD1' ' A' ' 57' ' ' TYR . . . 58.61 47.12 13.67 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.058 179.987 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 57' ' ' TYR . . . . . 0.476 ' CD1' ' C ' ' A' ' 57' ' ' TYR . 0.0 OUTLIER 81.56 147.15 0.09 Allowed 'General case' 0 N--CA 1.464 0.271 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.688 -179.827 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . 0.515 HG13 ' N ' ' A' ' 59' ' ' LYS . 8.2 p -178.49 -47.69 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.365 -179.788 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . 0.571 ' CD ' HD11 ' A' ' 10' ' ' LEU . 0.4 OUTLIER 178.79 -167.87 0.08 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.361 -0.382 . . . . 0.0 110.788 -179.91 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -130.57 88.25 2.6 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.815 179.925 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . 0.534 HD23 HG13 ' A' ' 9' ' ' VAL . 0.6 OUTLIER -59.89 -65.44 0.68 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.924 179.912 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 . . . . . 0 C--O 1.25 1.107 0 CA-C-O 118.251 -0.88 . . . . 0.0 110.896 179.989 . . . . . . . . 0 0 . 1 stop_ save_