data_1s5r_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 1s5r _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 ' 366' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.46 0.045 0 CA-C-O 120.793 0.33 . . . . 0.0 111.307 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 367' ' ' VAL . . . . . . . . . . . . . 16.4 m -62.63 -26.39 40.52 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.152 179.831 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 368' ' ' TYR . . . . . . . . . . . . . 42.6 t80 -73.36 -54.92 7.15 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.251 -0.432 . . . . 0.0 111.169 -179.825 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 369' ' ' VAL . . . . . 0.513 HG12 HD21 ' A' ' 370' ' ' LEU . 7.7 p -57.99 -42.22 82.13 Favored 'Isoleucine or valine' 0 C--O 1.232 0.169 0 CA-C-O 120.782 0.325 . . . . 0.0 110.799 -179.992 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 370' ' ' LEU . . . . . 0.513 HD21 HG12 ' A' ' 369' ' ' VAL . 2.7 mm? -63.16 -46.38 87.45 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 121.011 0.434 . . . . 0.0 110.124 179.093 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 371' ' ' SER . . . . . . . . . . . . . 30.6 t -64.78 -24.21 67.48 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 115.843 -0.617 . . . . 0.0 110.641 179.36 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 372' ' ' SER . . . . . . . . . . . . . 46.6 t -72.59 -50.37 25.87 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.678 -179.972 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 373' ' ' MET . . . . . . . . . . . . . 66.4 mtt -62.02 -41.08 97.7 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.75 179.652 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 374' ' ' ALA . . . . . . . . . . . . . . . -65.71 -55.77 15.59 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.089 -0.505 . . . . 0.0 112.021 -179.329 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 375' ' ' ARG . . . . . . . . . . . . . 25.3 mmm180 -60.08 -44.6 94.65 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.506 -0.315 . . . . 0.0 111.668 -179.509 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 376' ' ' GLN . . . . . . . . . . . . . 24.2 mm-40 . . . . . 0 C--N 1.328 -0.332 0 CA-C-N 116.431 -0.35 . . . . 0.0 111.812 -179.407 . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' B' B ' 302' ' ' VAL . . . . . 0.564 HG22 ' H ' ' B' ' 303' ' ' GLU . 5.1 m . . . . . 0 CA--C 1.529 0.153 0 N-CA-C 111.819 0.303 . . . . 0.0 111.819 . . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 303' ' ' GLU . . . . . 0.564 ' H ' HG22 ' B' ' 302' ' ' VAL . 10.6 pt-20 -57.33 -39.63 76.29 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 111.761 0.282 . . . . 0.0 111.761 -179.152 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 304' ' ' PHE . . . . . . . . . . . . . 81.5 m-85 -60.22 -77.08 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 112.048 0.388 . . . . 0.0 112.048 -179.217 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 305' ' ' ASN . . . . . . . . . . . . . 37.5 t30 -50.47 -45.36 56.12 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 112.779 0.659 . . . . 0.0 112.779 -178.596 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 306' ' ' HIS . . . . . 0.4 ' HB2' ' O ' ' B' ' 302' ' ' VAL . 0.4 OUTLIER -64.39 -64.87 0.77 Allowed 'General case' 0 C--N 1.33 -0.27 0 N-CA-C 112.315 0.487 . . . . 0.0 112.315 -178.418 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' B' B ' 307' ' ' ALA . . . . . . . . . . . . . . . -54.88 -48.69 72.67 Favored 'General case' 0 N--CA 1.464 0.27 0 N-CA-C 112.183 0.438 . . . . 0.0 112.183 -178.929 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 308' ' ' ILE . . . . . . . . . . . . . 97.6 mt -55.66 -54.19 28.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-O 120.707 0.289 . . . . 0.0 111.097 -179.889 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 309' ' ' ASN . . . . . 0.515 ' N ' HD21 ' B' ' 309' ' ' ASN . 0.9 OUTLIER -63.45 -22.34 66.83 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.436 -0.347 . . . . 0.0 110.99 179.985 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' B' B ' 310' ' ' TYR . . . . . 0.569 ' HH ' ' HB2' ' B' ' 376' ' ' PHE . 64.0 t80 -70.4 -61.11 1.9 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.218 -0.447 . . . . 0.0 110.826 179.887 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 311' ' ' VAL . . . . . . . . . . . . . 50.6 t -62.37 -28.39 44.55 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.771 179.823 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 312' ' ' ASN . . . . . . . . . . . . . 26.8 t-20 -69.18 -55.32 10.98 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.379 -179.873 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 313' ' ' LYS . . . . . 0.554 ' HG3' ' N ' ' B' ' 314' ' ' ILE . 40.5 pttt -58.18 -43.61 87.61 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.377 -0.374 . . . . 0.0 111.345 -179.542 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 314' ' ' ILE . . . . . 0.554 ' N ' ' HG3' ' B' ' 313' ' ' LYS . 96.0 mt -68.66 -34.97 67.86 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.437 -0.347 . . . . 0.0 111.368 -179.473 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 315' ' ' LYS . . . . . . . . . . . . . 22.4 ttmm -66.65 -37.17 84.24 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.822 0.344 . . . . 0.0 110.711 179.648 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 316' ' ' ASN . . . . . . . . . . . . . 25.4 t-20 -83.61 -21.45 32.54 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.978 -179.836 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 317' ' ' ARG . . . . . . . . . . . . . 21.9 tpt180 -75.92 -65.84 0.86 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.994 -179.998 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 318' ' ' PHE . . . . . . . . . . . . . 99.1 m-85 -91.24 35.66 0.93 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.933 179.991 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 319' ' ' GLN . . . . . . . . . . . . . 19.1 pt20 -58.34 -18.27 26.2 Favored 'General case' 0 N--CA 1.449 -0.519 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.17 179.905 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 320' ' ' GLY . . . . . . . . . . . . . . . -96.03 -22.66 19.61 Favored Glycine 0 N--CA 1.451 -0.347 0 C-N-CA 120.805 -0.712 . . . . 0.0 112.58 179.937 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 321' ' ' GLN . . . . . 0.616 HE21 ' HB2' ' B' ' 323' ' ' ASP . 48.8 tp60 -109.0 96.2 19.85 Favored Pre-proline 0 C--N 1.33 -0.26 0 CA-C-O 120.465 0.174 . . . . 0.0 110.825 -179.946 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 322' ' ' PRO . . . . . . . . . . . . . 87.8 Cg_endo -81.76 -12.25 11.11 Favored 'Trans proline' 0 C--N 1.348 0.511 0 C-N-CA 122.625 2.217 . . . . 0.0 112.847 -179.735 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 323' ' ' ASP . . . . . 0.616 ' HB2' HE21 ' B' ' 321' ' ' GLN . 9.6 m-20 -70.29 -55.69 8.59 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.517 -0.311 . . . . 0.0 111.168 -179.788 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 324' ' ' ILE . . . . . . . . . . . . . 58.8 mt -65.46 -37.37 79.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.277 -0.42 . . . . 0.0 111.065 -179.774 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 325' ' ' TYR . . . . . . . . . . . . . 28.1 t80 -64.05 -50.09 69.78 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.592 179.971 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 326' ' ' LYS . . . . . 0.4 ' O ' ' HG3' ' B' ' 330' ' ' GLU . 38.9 ttmt -61.04 -38.66 86.94 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.035 -0.529 . . . . 0.0 110.692 179.613 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 327' ' ' ALA . . . . . 0.416 ' HB3' HD23 ' B' ' 365' ' ' LEU . . . -58.87 -54.96 41.24 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.916 179.905 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 328' ' ' PHE . . . . . . . . . . . . . 90.0 t80 -53.59 -49.96 66.65 Favored 'General case' 0 C--O 1.235 0.29 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.613 179.726 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 329' ' ' LEU . . . . . . . . . . . . . 96.4 mt -58.0 -35.53 71.36 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.96 179.892 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 330' ' ' GLU . . . . . 0.4 ' HG3' ' O ' ' B' ' 326' ' ' LYS . 41.7 mt-10 -67.83 -34.84 77.52 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.617 179.652 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 331' ' ' ILE . . . . . . . . . . . . . 74.2 mt -65.65 -49.77 75.62 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.197 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.751 179.565 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 332' ' ' LEU . . . . . 0.454 ' HB3' HG11 ' A' ' 369' ' ' VAL . 5.2 mp -67.22 -30.56 70.51 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.359 -0.382 . . . . 0.0 111.104 179.939 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 333' ' ' HIS . . . . . . . . . . . . . 49.7 t-80 -65.26 -55.7 16.94 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.872 0.368 . . . . 0.0 110.279 179.565 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 334' ' ' THR . . . . . 0.418 HG23 HD12 ' B' ' 353' ' ' LEU . 77.6 m -63.18 -36.52 83.9 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.337 179.486 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 335' ' ' TYR . . . . . . . . . . . . . 87.9 t80 -66.92 -33.21 75.1 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.311 179.435 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 336' ' ' GLN . . . . . . . . . . . . . 8.1 tt0 -68.58 -49.7 57.38 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.84 -0.618 . . . . 0.0 110.66 179.815 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 337' ' ' LYS . . . . . 0.491 ' O ' ' HG2' ' B' ' 340' ' ' ARG . 39.1 ttpt -62.83 -36.89 84.69 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.068 179.955 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 338' ' ' GLU . . . . . . . . . . . . . 18.9 mm-40 -71.15 -32.53 69.07 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.974 0.416 . . . . 0.0 110.238 179.345 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 339' ' ' GLN . . . . . . . . . . . . . 58.4 tt0 -72.24 -43.3 64.59 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.798 -0.637 . . . . 0.0 110.736 179.512 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 340' ' ' ARG . . . . . 0.559 ' HG3' ' N ' ' B' ' 341' ' ' ASN . 36.3 ptt180 -63.74 -53.64 47.84 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 121.015 0.436 . . . . 0.0 110.772 179.933 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 341' ' ' ASN . . . . . 0.559 ' N ' ' HG3' ' B' ' 340' ' ' ARG . 51.1 t-20 -55.8 -51.98 65.58 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.677 -0.692 . . . . 0.0 110.837 179.502 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 342' ' ' ALA . . . . . . . . . . . . . . . -58.73 -32.76 69.51 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.015 179.897 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 343' ' ' LYS . . . . . . . . . . . . . 62.5 tttm -70.53 -38.28 74.19 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.948 179.882 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 344' ' ' GLU . . . . . . . . . . . . . 20.8 mm-40 -78.29 -22.75 47.76 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.056 -179.899 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 345' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.33 -0.274 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.095 -179.967 . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' B' B ' 351' ' ' PRO . . . . . . . . . . . . . 50.1 Cg_exo . . . . . 0 C--O 1.231 0.142 0 CA-C-O 120.744 0.227 . . . . 0.0 112.529 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' B' B ' 352' ' ' ALA . . . . . . . . . . . . . . . -68.83 -54.34 16.31 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.838 179.838 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 353' ' ' LEU . . . . . 0.418 HD12 HG23 ' B' ' 334' ' ' THR . 7.7 mp -107.42 131.23 54.5 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.989 -0.55 . . . . 0.0 111.068 179.972 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 354' ' ' THR . . . . . . . . . . . . . 71.2 p -113.64 -177.39 3.12 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.64 179.601 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 355' ' ' GLU . . . . . . . . . . . . . 48.0 mt-10 -56.53 -35.79 68.48 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.953 0.406 . . . . 0.0 110.669 179.823 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 356' ' ' GLN . . . . . . . . . . . . . 15.4 mm100 -74.28 -34.2 63.47 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.824 -0.625 . . . . 0.0 111.217 -179.907 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 357' ' ' GLU . . . . . 0.412 ' HG2' ' HG ' ' B' ' 353' ' ' LEU . 5.2 tp10 -63.71 -47.81 79.62 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.865 0.365 . . . . 0.0 110.513 -179.966 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 358' ' ' VAL . . . . . 0.428 ' O ' HG22 ' B' ' 362' ' ' VAL . 93.7 t -67.52 -55.31 17.66 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.334 -179.933 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 359' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER -53.34 -37.81 62.68 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.575 0.226 . . . . 0.0 111.29 -179.332 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 360' ' ' ALA . . . . . . . . . . . . . . . -67.12 -60.8 2.31 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.589 -0.278 . . . . 0.0 111.396 -179.784 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 361' ' ' GLN . . . . . . . . . . . . . 97.2 mt-30 -52.96 -45.44 67.76 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.341 -0.39 . . . . 0.0 110.81 179.918 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 362' ' ' VAL . . . . . 0.428 HG22 ' O ' ' B' ' 358' ' ' VAL . 99.1 t -62.02 -38.75 81.55 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.224 -0.443 . . . . 0.0 110.386 179.371 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 363' ' ' ALA . . . . . . . . . . . . . . . -65.97 -28.05 68.61 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.503 179.484 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 364' ' ' ARG . . . . . . . . . . . . . 61.1 ttp180 -84.63 -26.98 27.47 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.905 -0.588 . . . . 0.0 110.544 179.5 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 365' ' ' LEU . . . . . 0.416 HD23 ' HB3' ' B' ' 327' ' ' ALA . 1.2 mp -61.99 -37.43 84.78 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.022 -0.536 . . . . 0.0 110.675 179.758 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 366' ' ' PHE . . . . . . . . . . . . . 20.2 m-85 -117.09 156.91 26.77 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.922 -179.622 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 367' ' ' LYS . . . . . . . . . . . . . 63.4 tttp -123.36 -73.83 0.63 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.736 179.885 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 368' ' ' ASN . . . . . . . . . . . . . 27.7 t-20 -72.69 -18.05 61.58 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.554 179.789 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 369' ' ' GLN . . . . . . . . . . . . . 23.7 mp0 -94.71 86.99 4.9 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.846 179.937 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 370' ' ' GLU . . . . . . . . . . . . . 42.8 tt0 -93.69 -14.75 26.0 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.609 179.89 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 371' ' ' ASP . . . . . . . . . . . . . 18.5 t70 -55.69 -37.73 68.73 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.914 -0.585 . . . . 0.0 110.864 179.899 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 372' ' ' LEU . . . . . . . . . . . . . 6.4 mp -67.06 -38.63 86.13 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.117 179.891 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 373' ' ' LEU . . . . . . . . . . . . . 27.3 mt -64.31 -44.27 92.1 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.404 -0.362 . . . . 0.0 110.926 -179.777 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 374' ' ' SER . . . . . . . . . . . . . 59.2 m -65.79 -55.0 19.5 Favored 'General case' 0 C--O 1.236 0.352 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.507 179.649 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 375' ' ' GLU . . . . . 0.448 ' HG3' ' NZ ' ' B' ' 313' ' ' LYS . 20.6 mm-40 -52.78 -38.55 61.25 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.993 -0.548 . . . . 0.0 110.075 179.409 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 376' ' ' PHE . . . . . 0.569 ' HB2' ' HH ' ' B' ' 310' ' ' TYR . 91.0 t80 -66.42 -41.67 88.89 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.026 179.268 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 377' ' ' GLY . . . . . . . . . . . . . . . -55.62 -35.84 63.25 Favored Glycine 0 N--CA 1.448 -0.503 0 C-N-CA 120.621 -0.8 . . . . 0.0 111.269 179.103 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 378' ' ' GLN . . . . . . . . . . . . . 18.8 mm-40 -56.99 -34.84 68.52 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.928 0.394 . . . . 0.0 110.421 179.01 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 379' ' ' PHE . . . . . . . . . . . . . 89.6 m-85 -74.31 -38.49 63.31 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.031 -0.532 . . . . 0.0 110.712 179.566 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 380' ' ' LEU . . . . . . . . . . . . . 10.9 tp -45.31 115.0 2.45 Favored Pre-proline 0 C--N 1.331 -0.231 0 CA-C-N 115.861 -0.609 . . . . 0.0 111.037 -179.475 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 381' ' ' PRO . . . . . . . . . . . . . 99.1 Cg_exo . . . . . 0 C--N 1.35 0.645 0 C-N-CA 122.704 2.269 . . . . 0.0 112.628 -179.777 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 366' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.231 0.107 0 CA-C-O 120.915 0.388 . . . . 0.0 110.993 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 367' ' ' VAL . . . . . . . . . . . . . 14.8 t -65.49 -22.09 30.34 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.868 -179.89 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 368' ' ' TYR . . . . . . . . . . . . . 61.5 t80 -65.14 -53.55 43.39 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.025 179.993 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 369' ' ' VAL . . . . . . . . . . . . . 17.4 m -70.96 -45.23 74.03 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-N 116.457 -0.338 . . . . 0.0 111.093 179.881 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 370' ' ' LEU . . . . . . . . . . . . . 98.9 mt -56.43 -37.97 70.94 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.386 -0.37 . . . . 0.0 110.739 179.762 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 371' ' ' SER . . . . . . . . . . . . . 83.1 p -70.51 -60.66 2.13 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.148 -179.994 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 372' ' ' SER . . . . . . . . . . . . . 79.3 p -52.56 -33.22 44.85 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.508 -0.315 . . . . 0.0 111.814 -179.28 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 373' ' ' MET . . . . . . . . . . . . . 95.8 mtp -74.4 -45.89 43.82 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 111.701 0.26 . . . . 0.0 111.701 -179.318 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 374' ' ' ALA . . . . . . . . . . . . . . . -84.48 -6.58 59.39 Favored 'General case' 0 C--N 1.331 -0.234 0 N-CA-C 112.339 0.496 . . . . 0.0 112.339 -179.217 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 375' ' ' ARG . . . . . 0.464 ' HA ' ' HE ' ' A' ' 375' ' ' ARG . 2.6 mmp_? -106.32 -27.51 10.95 Favored 'General case' 0 C--N 1.33 -0.276 0 N-CA-C 111.64 0.237 . . . . 0.0 111.64 -179.296 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 376' ' ' GLN . . . . . . . . . . . . . 27.6 tt0 . . . . . 0 C--N 1.333 -0.14 0 CA-C-O 120.702 0.287 . . . . 0.0 111.065 -179.8 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' B' B ' 302' ' ' VAL . . . . . 0.403 HG22 ' N ' ' B' ' 303' ' ' GLU . 22.1 m . . . . . 0 C--O 1.23 0.077 0 CA-C-O 121.06 0.457 . . . . 0.0 111.29 . . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 303' ' ' GLU . . . . . 0.403 ' N ' HG22 ' B' ' 302' ' ' VAL . 0.7 OUTLIER -56.7 -68.76 0.19 Allowed 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.665 -0.698 . . . . 0.0 111.805 -178.859 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' B' B ' 304' ' ' PHE . . . . . 0.547 ' HA ' HD12 ' B' ' 308' ' ' ILE . 77.5 t80 -50.0 -63.58 1.07 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.867 -179.257 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 305' ' ' ASN . . . . . . . . . . . . . 53.9 t30 -46.57 -63.58 0.98 Allowed 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 112.355 0.502 . . . . 0.0 112.355 -178.803 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 306' ' ' HIS . . . . . . . . . . . . . 12.7 m-70 -55.23 -68.71 0.17 Allowed 'General case' 0 C--N 1.33 -0.266 0 N-CA-C 112.765 0.654 . . . . 0.0 112.765 -178.661 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 307' ' ' ALA . . . . . . . . . . . . . . . -48.68 -61.97 1.75 Allowed 'General case' 0 CA--C 1.532 0.254 0 N-CA-C 112.903 0.705 . . . . 0.0 112.903 -178.304 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 308' ' ' ILE . . . . . 0.547 HD12 ' HA ' ' B' ' 304' ' ' PHE . 1.8 mp -52.48 -61.22 0.82 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 N-CA-C 112.221 0.452 . . . . 0.0 112.221 -179.04 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 309' ' ' ASN . . . . . . . . . . . . . 3.2 t-20 -55.4 -27.24 46.47 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.725 0.298 . . . . 0.0 111.518 -179.256 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 310' ' ' TYR . . . . . . . . . . . . . 82.3 t80 -68.02 -57.25 6.46 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.369 -0.378 . . . . 0.0 111.225 -179.726 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 311' ' ' VAL . . . . . . . . . . . . . 27.8 t -58.17 -44.77 88.38 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.163 0 CA-C-N 116.367 -0.379 . . . . 0.0 110.705 -179.969 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 312' ' ' ASN . . . . . . . . . . . . . 2.7 t-20 -61.65 -37.15 82.96 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.13 -0.487 . . . . 0.0 110.628 179.722 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 313' ' ' LYS . . . . . . . . . . . . . 28.0 tttp -60.11 -57.11 14.25 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.963 179.827 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 314' ' ' ILE . . . . . . . . . . . . . 58.7 mt -67.51 -23.37 29.81 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.412 -179.619 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 315' ' ' LYS . . . . . . . . . . . . . 1.3 tmmt? -73.24 -36.58 66.45 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.318 -0.401 . . . . 0.0 111.142 -179.727 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 316' ' ' ASN . . . . . . . . . . . . . 24.0 t-20 -86.59 -43.19 12.87 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.412 -0.358 . . . . 0.0 111.469 -179.547 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 317' ' ' ARG . . . . . 0.41 ' HE ' ' HA ' ' B' ' 317' ' ' ARG . 5.7 tpm_? -64.02 -65.82 0.63 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.383 -0.371 . . . . 0.0 111.188 -179.779 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 318' ' ' PHE . . . . . . . . . . . . . 68.1 m-85 -81.62 31.59 0.35 Allowed 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.433 -179.639 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 319' ' ' GLN . . . . . . . . . . . . . 50.1 tt0 -68.69 -15.6 63.57 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.7 179.886 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 320' ' ' GLY . . . . . . . . . . . . . . . -74.53 -48.25 13.98 Favored Glycine 0 N--CA 1.452 -0.297 0 C-N-CA 120.888 -0.672 . . . . 0.0 112.604 179.964 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 321' ' ' GLN . . . . . . . . . . . . . 20.3 tp60 -100.92 100.94 14.06 Favored Pre-proline 0 C--N 1.33 -0.242 0 CA-C-N 116.579 0.19 . . . . 0.0 110.754 179.878 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 322' ' ' PRO . . . . . . . . . . . . . 33.6 Cg_endo -64.58 -24.71 62.83 Favored 'Trans proline' 0 C--N 1.349 0.6 0 C-N-CA 122.495 2.13 . . . . 0.0 112.525 -179.914 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 323' ' ' ASP . . . . . . . . . . . . . 8.0 m-20 -62.79 -37.07 85.23 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.059 -179.741 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 324' ' ' ILE . . . . . . . . . . . . . 48.8 mm -68.85 -61.0 1.87 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.374 -0.376 . . . . 0.0 111.039 -179.882 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 325' ' ' TYR . . . . . . . . . . . . . 23.2 t80 -51.75 -51.86 53.08 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.911 -0.586 . . . . 0.0 111.013 -179.938 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 326' ' ' LYS . . . . . . . . . . . . . 63.0 tttm -58.3 -46.02 86.89 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.145 -179.844 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 327' ' ' ALA . . . . . . . . . . . . . . . -52.23 -55.28 22.26 Favored 'General case' 0 C--O 1.233 0.237 0 CA-C-O 120.875 0.369 . . . . 0.0 111.078 -179.986 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 328' ' ' PHE . . . . . . . . . . . . . 60.6 t80 -54.05 -45.17 71.59 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.473 179.77 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 329' ' ' LEU . . . . . . . . . . . . . 73.4 mt -59.44 -35.16 73.51 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.737 179.569 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 330' ' ' GLU . . . . . . . . . . . . . 47.1 mt-10 -67.69 -37.1 81.82 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.446 179.653 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 331' ' ' ILE . . . . . . . . . . . . . 70.8 mt -63.69 -53.5 43.97 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.596 179.376 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 332' ' ' LEU . . . . . . . . . . . . . 8.4 mp -63.02 -35.42 80.17 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.838 179.732 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 333' ' ' HIS . . . . . . . . . . . . . 45.6 t60 -62.27 -52.9 61.89 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.905 0.384 . . . . 0.0 110.005 179.442 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 334' ' ' THR . . . . . 0.431 HG22 HD11 ' B' ' 353' ' ' LEU . 58.8 m -60.1 -32.07 70.64 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.984 -0.553 . . . . 0.0 109.886 179.004 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 335' ' ' TYR . . . . . . . . . . . . . 57.3 t80 -63.88 -38.66 91.9 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.641 -0.709 . . . . 0.0 109.879 179.273 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 336' ' ' GLN . . . . . . . . . . . . . 3.4 tt0 -66.35 -48.99 68.44 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.689 -0.687 . . . . 0.0 110.42 179.529 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 337' ' ' LYS . . . . . . . . . . . . . 38.6 ttpt -56.09 -50.62 70.52 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.807 -0.633 . . . . 0.0 111.018 179.987 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 338' ' ' GLU . . . . . . . . . . . . . 38.3 mm-40 -63.36 -35.67 81.16 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.139 -179.819 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 339' ' ' GLN . . . . . . . . . . . . . 23.3 tp60 -65.38 -45.65 83.22 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.719 179.936 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 340' ' ' ARG . . . . . . . . . . . . . 80.3 mtp180 -60.84 -50.53 73.07 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.604 179.705 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 341' ' ' ASN . . . . . . . . . . . . . 81.8 m-20 -54.9 -44.13 73.86 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.7 179.685 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 342' ' ' ALA . . . . . . . . . . . . . . . -64.76 -33.04 75.04 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.815 179.704 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 343' ' ' LYS . . . . . . . . . . . . . 39.5 ttpt -71.52 -40.07 70.33 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.862 179.799 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 344' ' ' GLU . . . . . . . . . . . . . 13.3 mm-40 -69.29 -33.56 73.38 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.906 179.993 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 345' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.286 0 CA-C-N 116.165 -0.471 . . . . 0.0 111.021 179.922 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' B' B ' 351' ' ' PRO . . . . . . . . . . . . . 57.7 Cg_exo . . . . . 0 CA--C 1.526 0.084 0 CA-C-O 120.814 0.256 . . . . 0.0 112.258 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' B' B ' 352' ' ' ALA . . . . . . . . . . . . . . . -59.78 -44.05 94.09 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.256 -179.796 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 353' ' ' LEU . . . . . 0.431 HD11 HG22 ' B' ' 334' ' ' THR . 6.3 mp -112.02 120.16 40.92 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 120.998 0.428 . . . . 0.0 111.28 179.879 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 354' ' ' THR . . . . . . . . . . . . . 56.2 p -113.06 -164.18 0.9 Allowed 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.802 -0.635 . . . . 0.0 110.369 179.422 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 355' ' ' GLU . . . . . . . . . . . . . 2.0 mp0 -61.29 -38.09 85.53 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 121.025 0.441 . . . . 0.0 110.368 179.681 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 356' ' ' GLN . . . . . . . . . . . . . 24.5 mt-30 -72.75 -40.91 65.65 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 115.868 -0.605 . . . . 0.0 111.317 -179.852 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 357' ' ' GLU . . . . . . . . . . . . . 4.8 tp10 -59.49 -53.1 62.02 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-O 120.785 0.326 . . . . 0.0 110.702 -179.793 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 358' ' ' VAL . . . . . 0.421 ' O ' HG22 ' B' ' 362' ' ' VAL . 49.9 t -61.82 -54.87 28.81 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.205 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.973 179.928 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 359' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER -52.28 -37.25 55.06 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.566 -0.288 . . . . 0.0 110.938 -179.524 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 360' ' ' ALA . . . . . . . . . . . . . . . -65.08 -58.64 5.53 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.43 -0.35 . . . . 0.0 111.411 -179.826 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 361' ' ' GLN . . . . . . . . . . . . . 47.8 mt-30 -55.83 -38.71 70.38 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.897 -179.889 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 362' ' ' VAL . . . . . 0.421 HG22 ' O ' ' B' ' 358' ' ' VAL . 60.4 t -71.01 -34.01 53.82 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.291 179.581 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 363' ' ' ALA . . . . . 0.516 ' HA ' HD13 ' B' ' 373' ' ' LEU . . . -64.2 -36.23 83.38 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.266 179.356 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 364' ' ' ARG . . . . . . . . . . . . . 58.9 mtp180 -87.18 -20.32 27.16 Favored 'General case' 0 N--CA 1.453 -0.286 0 CA-C-N 115.806 -0.634 . . . . 0.0 110.2 179.251 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 365' ' ' LEU . . . . . . . . . . . . . 23.6 tp -60.3 -21.11 61.58 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 115.824 -0.626 . . . . 0.0 109.916 179.239 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 366' ' ' PHE . . . . . . . . . . . . . 44.8 m-85 -131.13 -174.54 3.42 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.527 -0.76 . . . . 0.0 109.925 179.391 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 367' ' ' LYS . . . . . . . . . . . . . 66.5 mttm -133.89 -80.37 0.46 Allowed 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.745 0.307 . . . . 0.0 111.214 -179.943 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 368' ' ' ASN . . . . . . . . . . . . . 3.0 p-10 -90.18 8.83 30.98 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.955 -179.854 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 369' ' ' GLN . . . . . 0.402 ' HB3' HD12 ' B' ' 372' ' ' LEU . 13.4 mm100 -91.49 84.51 5.55 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.869 179.832 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 370' ' ' GLU . . . . . . . . . . . . . 2.2 mp0 -89.92 -11.43 41.82 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.535 -0.302 . . . . 0.0 110.653 179.749 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 371' ' ' ASP . . . . . . . . . . . . . 5.3 m-20 -63.67 -46.89 83.49 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.468 179.629 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 372' ' ' LEU . . . . . 0.402 HD12 ' HB3' ' B' ' 369' ' ' GLN . 6.3 mp -68.17 -45.81 72.44 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.553 179.477 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 373' ' ' LEU . . . . . 0.516 HD13 ' HA ' ' B' ' 363' ' ' ALA . 1.1 mp -59.08 -33.58 70.98 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.739 -0.664 . . . . 0.0 111.046 -179.898 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 374' ' ' SER . . . . . . . . . . . . . 47.7 t -74.16 -57.51 3.91 Favored 'General case' 0 C--O 1.236 0.344 0 CA-C-O 120.949 0.404 . . . . 0.0 110.673 179.794 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 375' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -54.35 -32.81 57.71 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.133 179.505 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 376' ' ' PHE . . . . . 0.456 ' O ' ' HB2' ' B' ' 379' ' ' PHE . 66.9 t80 -79.6 -31.36 41.71 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.02 179.196 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 377' ' ' GLY . . . . . . . . . . . . . . . -61.71 -33.17 84.2 Favored Glycine 0 N--CA 1.448 -0.532 0 C-N-CA 120.593 -0.813 . . . . 0.0 111.236 179.12 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 378' ' ' GLN . . . . . . . . . . . . . 23.8 mt-30 -69.53 -26.73 64.66 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.753 0.311 . . . . 0.0 110.884 179.303 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 379' ' ' PHE . . . . . 0.456 ' HB2' ' O ' ' B' ' 376' ' ' PHE . 12.9 m-85 -61.67 -38.22 86.95 Favored 'General case' 0 C--N 1.333 -0.14 0 CA-C-N 116.277 -0.419 . . . . 0.0 111.298 -179.9 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 380' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -53.22 141.43 41.09 Favored Pre-proline 0 C--N 1.331 -0.213 0 CA-C-N 116.523 -0.308 . . . . 0.0 110.62 -179.966 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 381' ' ' PRO . . . . . . . . . . . . . 39.6 Cg_endo . . . . . 0 C--N 1.346 0.405 0 C-N-CA 122.404 2.069 . . . . 0.0 112.164 -179.817 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 366' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.235 0.305 0 CA-C-O 121.326 0.584 . . . . 0.0 110.355 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 367' ' ' VAL . . . . . . . . . . . . . 35.2 m -62.16 -16.59 16.32 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 115.608 -0.724 . . . . 0.0 110.414 179.376 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 368' ' ' TYR . . . . . . . . . . . . . 66.9 t80 -71.39 -56.84 5.17 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.54 179.743 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 369' ' ' VAL . . . . . 0.555 HG11 ' HB3' ' B' ' 332' ' ' LEU . 3.4 p -61.21 -44.53 98.54 Favored 'Isoleucine or valine' 0 C--O 1.232 0.147 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.455 179.533 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 370' ' ' LEU . . . . . . . . . . . . . 91.9 mt -64.0 -36.49 84.16 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.71 179.821 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 371' ' ' SER . . . . . 0.538 ' HA ' ' HB3' ' B' ' 303' ' ' GLU . 29.9 t -60.85 -61.44 2.58 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.896 179.772 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 372' ' ' SER . . . . . 0.41 ' O ' ' HG3' ' A' ' 376' ' ' GLN . 79.3 p -57.43 -33.07 67.53 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.991 -179.783 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 373' ' ' MET . . . . . . . . . . . . . 52.3 ttm -58.93 -56.96 15.5 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.365 -179.804 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 374' ' ' ALA . . . . . 0.486 ' HB2' ' OE1' ' B' ' 303' ' ' GLU . . . -84.23 -6.92 59.46 Favored 'General case' 0 C--N 1.33 -0.246 0 N-CA-C 112.016 0.376 . . . . 0.0 112.016 -179.379 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 375' ' ' ARG . . . . . . . . . . . . . 21.2 tpp180 -80.97 -40.86 23.72 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.734 0.302 . . . . 0.0 110.753 179.94 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 376' ' ' GLN . . . . . 0.41 ' HG3' ' O ' ' A' ' 372' ' ' SER . 56.6 mt-30 . . . . . 0 C--N 1.331 -0.196 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.882 179.843 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 302' ' ' VAL . . . . . 0.428 HG13 ' N ' ' B' ' 303' ' ' GLU . 4.2 p . . . . . 0 C--O 1.231 0.122 0 CA-C-O 120.84 0.352 . . . . 0.0 111.278 . . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 303' ' ' GLU . . . . . 0.538 ' HB3' ' HA ' ' A' ' 371' ' ' SER . 72.7 mm-40 -67.32 -40.17 85.94 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.092 -0.504 . . . . 0.0 111.815 -179.314 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 304' ' ' PHE . . . . . . . . . . . . . 83.8 m-85 -58.85 -62.06 2.16 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.416 -179.482 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 305' ' ' ASN . . . . . . . . . . . . . 47.4 t-20 -59.59 -43.14 93.78 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.845 -179.228 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 306' ' ' HIS . . . . . . . . . . . . . 7.0 t-160 -61.29 -65.4 0.7 Allowed 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 111.881 0.326 . . . . 0.0 111.881 -179.063 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 307' ' ' ALA . . . . . . . . . . . . . . . -54.23 -43.86 71.23 Favored 'General case' 0 C--N 1.33 -0.242 0 N-CA-C 112.147 0.425 . . . . 0.0 112.147 -179.036 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 308' ' ' ILE . . . . . . . . . . . . . 62.7 mt -58.87 -54.75 29.48 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-O 120.676 0.274 . . . . 0.0 111.393 -179.735 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 309' ' ' ASN . . . . . 0.533 HD21 ' N ' ' B' ' 309' ' ' ASN . 0.9 OUTLIER -58.47 -30.88 67.32 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.835 0.35 . . . . 0.0 111.041 -179.962 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' B' B ' 310' ' ' TYR . . . . . 0.414 ' O ' ' HG3' ' B' ' 313' ' ' LYS . 24.0 t80 -65.38 -62.3 1.61 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.83 179.967 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 311' ' ' VAL . . . . . . . . . . . . . 56.4 t -61.3 -23.37 30.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.975 179.94 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 312' ' ' ASN . . . . . . . . . . . . . 27.2 t-20 -69.45 -56.72 6.6 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.486 -179.6 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 313' ' ' LYS . . . . . 0.414 ' HG3' ' O ' ' B' ' 310' ' ' TYR . 0.0 OUTLIER -64.69 -33.45 75.97 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.362 -0.381 . . . . 0.0 111.372 -179.381 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' B' B ' 314' ' ' ILE . . . . . . . . . . . . . 79.3 mt -72.22 -36.92 57.49 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-O 120.755 0.312 . . . . 0.0 111.278 179.774 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 315' ' ' LYS . . . . . . . . . . . . . 25.8 ttpp -67.93 -45.76 73.38 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.37 -0.377 . . . . 0.0 111.095 -179.761 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 316' ' ' ASN . . . . . . . . . . . . . 52.1 t-20 -68.58 -48.74 63.43 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.187 -0.461 . . . . 0.0 111.317 -179.625 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 317' ' ' ARG . . . . . . . . . . . . . 49.5 ttt180 -59.48 -64.2 1.03 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.481 -179.474 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 318' ' ' PHE . . . . . . . . . . . . . 96.8 m-85 -84.38 33.08 0.5 Allowed 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.323 -179.59 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 319' ' ' GLN . . . . . . . . . . . . . 7.1 tp60 -64.87 -20.16 66.28 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.416 -0.356 . . . . 0.0 110.702 179.795 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 320' ' ' GLY . . . . . . . . . . . . . . . -85.72 -21.15 54.45 Favored Glycine 0 C--N 1.33 0.213 0 C-N-CA 120.858 -0.687 . . . . 0.0 112.626 179.936 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 321' ' ' GLN . . . . . . . . . . . . . 29.6 mm-40 -106.87 96.45 14.71 Favored Pre-proline 0 C--N 1.33 -0.261 0 CA-C-O 120.539 0.209 . . . . 0.0 110.809 179.91 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 322' ' ' PRO . . . . . . . . . . . . . 86.7 Cg_endo -78.4 -28.46 4.51 Favored 'Trans proline' 0 C--N 1.348 0.537 0 C-N-CA 122.417 2.078 . . . . 0.0 112.72 -179.817 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 323' ' ' ASP . . . . . . . . . . . . . 31.3 m-20 -65.29 -48.01 74.64 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.354 -0.384 . . . . 0.0 111.103 -179.725 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 324' ' ' ILE . . . . . . . . . . . . . 71.6 mt -66.2 -47.25 85.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.236 -179.962 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 325' ' ' TYR . . . . . . . . . . . . . 41.1 t80 -55.82 -57.73 10.8 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.982 -179.989 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 326' ' ' LYS . . . . . 0.466 ' O ' ' HG3' ' B' ' 330' ' ' GLU . 98.5 mttt -55.53 -48.85 74.04 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.046 -0.524 . . . . 0.0 111.259 -179.898 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 327' ' ' ALA . . . . . . . . . . . . . . . -49.08 -51.67 30.22 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.372 -0.377 . . . . 0.0 111.231 -179.922 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 328' ' ' PHE . . . . . . . . . . . . . 84.1 t80 -56.33 -46.03 80.07 Favored 'General case' 0 C--O 1.235 0.324 0 CA-C-N 116.191 -0.459 . . . . 0.0 109.975 179.316 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 329' ' ' LEU . . . . . . . . . . . . . 83.5 mt -58.71 -31.22 68.06 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 115.711 -0.677 . . . . 0.0 110.186 179.042 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 330' ' ' GLU . . . . . 0.466 ' HG3' ' O ' ' B' ' 326' ' ' LYS . 38.8 mt-10 -71.73 -36.05 70.36 Favored 'General case' 0 C--N 1.333 -0.13 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.679 179.65 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 331' ' ' ILE . . . . . . . . . . . . . 61.5 mt -65.48 -47.8 85.32 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.152 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.872 179.881 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 332' ' ' LEU . . . . . 0.555 ' HB3' HG11 ' A' ' 369' ' ' VAL . 14.0 mt -67.36 -37.82 83.8 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.412 -0.358 . . . . 0.0 110.899 179.97 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 333' ' ' HIS . . . . . . . . . . . . . 48.4 t-80 -61.29 -57.89 10.52 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.649 179.635 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 334' ' ' THR . . . . . 0.454 HG23 HD12 ' B' ' 353' ' ' LEU . 86.3 m -59.56 -35.17 73.73 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.915 -0.584 . . . . 0.0 111.005 179.842 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 335' ' ' TYR . . . . . . . . . . . . . 83.4 t80 -61.1 -60.35 3.9 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.902 -179.935 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 336' ' ' GLN . . . . . 0.609 ' HA ' HE21 ' B' ' 336' ' ' GLN . 0.0 OUTLIER -56.98 -33.62 67.28 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.715 -179.856 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' B' B ' 337' ' ' LYS . . . . . . . . . . . . . 23.9 ttmm -59.02 -54.27 48.97 Favored 'General case' 0 C--O 1.234 0.251 0 CA-C-O 120.971 0.415 . . . . 0.0 110.528 179.296 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 338' ' ' GLU . . . . . . . . . . . . . 26.2 mm-40 -60.05 -33.69 72.39 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.296 179.468 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 339' ' ' GLN . . . . . . . . . . . . . 57.7 tp60 -64.1 -43.5 95.17 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.464 179.549 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 340' ' ' ARG . . . . . . . . . . . . . 94.7 mtt180 -61.83 -53.89 49.67 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.597 179.68 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 341' ' ' ASN . . . . . . . . . . . . . 47.9 t-20 -57.6 -33.05 67.8 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.507 179.696 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 342' ' ' ALA . . . . . . . . . . . . . . . -65.91 -43.28 88.62 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.937 -0.574 . . . . 0.0 111.023 179.917 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 343' ' ' LYS . . . . . . . . . . . . . 88.2 tttt -66.93 -39.79 87.42 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.839 179.965 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 344' ' ' GLU . . . . . . . . . . . . . 12.6 mm-40 -69.54 -31.79 70.21 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.898 -179.978 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 345' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.285 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.243 -179.878 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' B' B ' 351' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_exo . . . . . 0 C--O 1.231 0.161 0 CA-C-O 120.902 0.293 . . . . 0.0 112.057 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' B' B ' 352' ' ' ALA . . . . . . . . . . . . . . . -64.32 -58.99 4.92 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.11 -0.495 . . . . 0.0 111.562 -179.485 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 353' ' ' LEU . . . . . 0.454 HD12 HG23 ' B' ' 334' ' ' THR . 6.7 mp -101.12 128.93 46.97 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.923 0.392 . . . . 0.0 111.535 -179.536 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 354' ' ' THR . . . . . . . . . . . . . 61.6 p -113.1 -173.9 2.35 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.528 179.429 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 355' ' ' GLU . . . . . . . . . . . . . 31.2 mt-10 -58.59 -35.2 72.04 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.992 0.425 . . . . 0.0 110.578 179.783 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 356' ' ' GLN . . . . . . . . . . . . . 8.6 tt0 -73.86 -37.91 64.63 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.887 -0.597 . . . . 0.0 111.01 -179.881 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 357' ' ' GLU . . . . . 0.4 ' HG2' ' HG ' ' B' ' 353' ' ' LEU . 6.9 tp10 -62.5 -45.83 91.23 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-O 120.925 0.393 . . . . 0.0 110.575 179.998 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 358' ' ' VAL . . . . . 0.441 ' O ' HG21 ' B' ' 362' ' ' VAL . 70.5 t -66.76 -58.19 7.36 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.02 -0.536 . . . . 0.0 111.114 179.933 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 359' ' ' TYR . . . . . . . . . . . . . 40.3 t80 -52.09 -32.43 34.9 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.611 -0.268 . . . . 0.0 111.087 -179.626 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 360' ' ' ALA . . . . . . . . . . . . . . . -68.91 -56.51 7.66 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.412 -0.358 . . . . 0.0 111.043 179.868 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 361' ' ' GLN . . . . . . . . . . . . . 53.4 mt-30 -57.01 -44.35 82.74 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.73 179.872 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 362' ' ' VAL . . . . . 0.441 HG21 ' O ' ' B' ' 358' ' ' VAL . 45.2 t -65.56 -32.96 60.49 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.524 179.84 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 363' ' ' ALA . . . . . 0.59 ' HA ' HD22 ' B' ' 373' ' ' LEU . . . -62.48 -51.67 66.53 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.722 179.645 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 364' ' ' ARG . . . . . . . . . . . . . 96.7 mtt180 -75.1 -18.38 60.27 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.625 179.58 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 365' ' ' LEU . . . . . . . . . . . . . 7.2 tp -59.66 -31.91 69.98 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.731 179.894 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 366' ' ' PHE . . . . . . . . . . . . . 58.4 m-85 -118.16 173.32 6.86 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.57 179.8 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 367' ' ' LYS . . . . . . . . . . . . . 47.3 mmtm -129.25 -78.16 0.55 Allowed 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.754 0.312 . . . . 0.0 111.373 -179.775 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 368' ' ' ASN . . . . . . . . . . . . . 7.5 t30 -82.95 -10.17 58.93 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.142 -179.65 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 369' ' ' GLN . . . . . . . . . . . . . 19.5 mp0 -94.2 87.59 5.31 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.411 -0.359 . . . . 0.0 111.143 -179.784 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 370' ' ' GLU . . . . . . . . . . . . . 44.0 mt-10 -94.45 -10.59 31.89 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.726 179.516 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 371' ' ' ASP . . . . . . . . . . . . . 13.8 t70 -58.48 -38.05 76.81 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.429 179.674 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 372' ' ' LEU . . . . . . . . . . . . . 6.0 mp -70.12 -39.2 75.6 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.905 -0.588 . . . . 0.0 110.49 179.316 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 373' ' ' LEU . . . . . 0.59 HD22 ' HA ' ' B' ' 363' ' ' ALA . 1.4 mp -65.73 -36.27 83.12 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.582 -0.735 . . . . 0.0 111.305 -179.702 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 374' ' ' SER . . . . . . . . . . . . . 87.8 p -71.72 -51.18 24.16 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.883 0.373 . . . . 0.0 110.287 179.663 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 375' ' ' GLU . . . . . . . . . . . . . 11.1 mm-40 -58.33 -33.38 69.45 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.263 179.347 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 376' ' ' PHE . . . . . 0.424 ' HA ' ' HB2' ' B' ' 379' ' ' PHE . 64.6 t80 -80.8 -29.7 36.0 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.151 179.373 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 377' ' ' GLY . . . . . . . . . . . . . . . -62.84 -40.13 98.87 Favored Glycine 0 N--CA 1.45 -0.412 0 C-N-CA 120.715 -0.755 . . . . 0.0 111.388 179.267 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 378' ' ' GLN . . . . . . . . . . . . . 12.9 mm100 -78.04 -16.89 57.68 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.053 0.454 . . . . 0.0 110.093 179.074 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 379' ' ' PHE . . . . . 0.424 ' HB2' ' HA ' ' B' ' 376' ' ' PHE . 0.2 OUTLIER -68.31 -42.3 79.61 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.714 -0.675 . . . . 0.0 110.622 179.803 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' B' B ' 380' ' ' LEU . . . . . . . . . . . . . 64.0 mt -56.82 147.32 53.74 Favored Pre-proline 0 C--N 1.33 -0.247 0 CA-C-N 116.013 -0.54 . . . . 0.0 110.866 -179.932 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 381' ' ' PRO . . . . . . . . . . . . . 70.9 Cg_exo . . . . . 0 C--N 1.347 0.497 0 C-N-CA 122.68 2.253 . . . . 0.0 112.554 -179.989 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 366' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.233 0.209 0 CA-C-O 120.786 0.327 . . . . 0.0 111.418 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 367' ' ' VAL . . . . . . . . . . . . . 20.6 m -60.36 -30.29 45.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.232 179.911 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 368' ' ' TYR . . . . . 0.402 ' HA ' ' HG ' ' A' ' 371' ' ' SER . 37.1 t80 -75.87 -40.54 54.35 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.991 -179.76 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 369' ' ' VAL . . . . . 0.42 HG21 ' HB2' ' B' ' 336' ' ' GLN . 20.1 t -63.31 -43.56 98.69 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.162 -179.923 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 370' ' ' LEU . . . . . . . . . . . . . 96.5 mt -71.37 -47.14 58.14 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.018 179.93 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 371' ' ' SER . . . . . 0.453 ' HA ' ' HB2' ' B' ' 303' ' ' GLU . 79.7 p -58.92 -33.0 70.07 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.219 -179.859 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 372' ' ' SER . . . . . . . . . . . . . 79.1 p -76.82 -58.01 3.52 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.417 -0.356 . . . . 0.0 111.409 -179.475 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 373' ' ' MET . . . . . . . . . . . . . 20.4 ptm -55.59 -26.81 45.84 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.382 -0.372 . . . . 0.0 111.605 -179.451 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 374' ' ' ALA . . . . . . . . . . . . . . . -87.04 -44.04 11.87 Favored 'General case' 0 C--N 1.33 -0.271 0 N-CA-C 111.692 0.256 . . . . 0.0 111.692 -179.722 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 375' ' ' ARG . . . . . 0.644 ' HB2' ' HG2' ' B' ' 303' ' ' GLU . 21.4 tpp180 -64.89 -26.67 68.42 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.83 0.348 . . . . 0.0 110.753 -179.969 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 376' ' ' GLN . . . . . . . . . . . . . 15.1 mm100 . . . . . 0 C--N 1.329 -0.288 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.045 179.852 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' B' B ' 302' ' ' VAL . . . . . 0.459 HG21 ' H ' ' B' ' 303' ' ' GLU . 8.8 m . . . . . 0 C--O 1.231 0.12 0 CA-C-O 120.794 0.33 . . . . 0.0 111.752 . . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 303' ' ' GLU . . . . . 0.644 ' HG2' ' HB2' ' A' ' 375' ' ' ARG . 0.0 OUTLIER -72.26 -30.92 65.31 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.266 -0.425 . . . . 0.0 111.72 -179.273 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' B' B ' 304' ' ' PHE . . . . . 0.406 ' O ' HG12 ' B' ' 308' ' ' ILE . 84.7 t80 -72.65 -51.05 21.14 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.678 0.275 . . . . 0.0 110.915 -179.663 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 305' ' ' ASN . . . . . 0.437 HD21 HD13 ' B' ' 308' ' ' ILE . 3.0 t-20 -64.46 -40.39 95.62 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.858 -179.975 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 306' ' ' HIS . . . . . . . . . . . . . 15.6 t-160 -66.8 -39.48 87.75 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.344 -0.389 . . . . 0.0 111.011 179.954 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 307' ' ' ALA . . . . . . . . . . . . . . . -67.09 -49.93 63.31 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.39 -0.368 . . . . 0.0 111.58 -179.712 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 308' ' ' ILE . . . . . 0.437 HD13 HD21 ' B' ' 305' ' ' ASN . 47.6 pt -62.38 -38.41 81.16 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.221 0 CA-C-O 120.682 0.277 . . . . 0.0 111.204 -179.681 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 309' ' ' ASN . . . . . 0.407 ' N ' HG13 ' B' ' 308' ' ' ILE . 95.9 m-20 -70.41 -32.64 70.34 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.404 -0.362 . . . . 0.0 110.605 179.681 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 310' ' ' TYR . . . . . . . . . . . . . 49.3 t80 -67.07 -51.63 52.07 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.607 179.808 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 311' ' ' VAL . . . . . . . . . . . . . 97.8 t -60.27 -43.8 94.25 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.212 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.605 179.338 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 312' ' ' ASN . . . . . . . . . . . . . 2.9 t-20 -64.37 -31.69 72.99 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.513 179.578 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 313' ' ' LYS . . . . . . . . . . . . . 20.6 tttp -65.04 -56.8 10.95 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.912 -0.586 . . . . 0.0 110.672 179.648 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 314' ' ' ILE . . . . . . . . . . . . . 30.3 mt -62.61 -28.87 45.65 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.777 -179.912 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 315' ' ' LYS . . . . . . . . . . . . . 22.1 ttmm -70.47 -36.75 74.07 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.74 179.726 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 316' ' ' ASN . . . . . . . . . . . . . 66.5 m-20 -82.23 -58.78 2.8 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.942 -0.572 . . . . 0.0 111.445 -179.8 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 317' ' ' ARG . . . . . . . . . . . . . 25.4 tpp180 -54.13 -64.4 0.84 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.096 179.988 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 318' ' ' PHE . . . . . . . . . . . . . 91.6 m-85 -86.71 42.8 1.03 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.97 179.896 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 319' ' ' GLN . . . . . . . . . . . . . 6.6 tp-100 -68.39 -22.57 64.63 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.821 179.904 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 320' ' ' GLY . . . . . . . . . . . . . . . -89.02 -15.77 58.76 Favored Glycine 0 N--CA 1.452 -0.291 0 C-N-CA 120.761 -0.733 . . . . 0.0 112.507 179.969 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 321' ' ' GLN . . . . . . . . . . . . . 2.2 mp0 -111.24 91.89 14.56 Favored Pre-proline 0 C--N 1.33 -0.267 0 CA-C-O 120.586 0.231 . . . . 0.0 110.958 -179.975 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 322' ' ' PRO . . . . . . . . . . . . . 96.7 Cg_endo -82.24 -18.28 7.37 Favored 'Trans proline' 0 C--N 1.348 0.513 0 C-N-CA 122.625 2.217 . . . . 0.0 112.392 179.875 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 323' ' ' ASP . . . . . . . . . . . . . 18.0 t70 -69.65 -50.58 42.76 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.701 -179.907 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 324' ' ' ILE . . . . . . . . . . . . . 56.3 mt -64.58 -43.86 96.76 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-N 116.081 -0.508 . . . . 0.0 110.85 179.857 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 325' ' ' TYR . . . . . . . . . . . . . 25.8 t80 -59.61 -48.18 82.67 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.647 179.822 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 326' ' ' LYS . . . . . . . . . . . . . 60.6 tttm -60.05 -45.51 92.63 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.937 -179.972 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 327' ' ' ALA . . . . . . . . . . . . . . . -55.08 -50.47 69.08 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.123 179.944 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 328' ' ' PHE . . . . . . . . . . . . . 66.3 t80 -55.78 -49.33 73.45 Favored 'General case' 0 C--O 1.234 0.273 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.53 179.781 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 329' ' ' LEU . . . . . . . . . . . . . 93.1 mt -56.26 -34.3 66.28 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.53 179.541 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 330' ' ' GLU . . . . . . . . . . . . . 19.4 mm-40 -69.56 -37.45 77.02 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.869 179.85 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 331' ' ' ILE . . . . . 0.422 HG22 HG21 ' B' ' 358' ' ' VAL . 71.0 mt -62.48 -48.21 89.36 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-N 116.391 -0.368 . . . . 0.0 110.433 179.358 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 332' ' ' LEU . . . . . . . . . . . . . 10.7 mp -68.53 -31.03 69.97 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.97 179.786 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 333' ' ' HIS . . . . . . . . . . . . . 40.4 t60 -63.97 -59.52 4.39 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.93 0.395 . . . . 0.0 110.231 179.532 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 334' ' ' THR . . . . . 0.419 HG23 HD13 ' B' ' 353' ' ' LEU . 94.6 m -58.03 -38.97 77.22 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.87 -0.604 . . . . 0.0 110.471 179.366 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 335' ' ' TYR . . . . . . . . . . . . . 75.2 t80 -58.14 -43.85 87.51 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.744 -0.662 . . . . 0.0 110.306 179.509 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 336' ' ' GLN . . . . . 0.42 ' HB2' HG21 ' A' ' 369' ' ' VAL . 8.1 tt0 -64.57 -42.57 95.55 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.769 -0.651 . . . . 0.0 110.802 179.974 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 337' ' ' LYS . . . . . . . . . . . . . 28.2 ttpp -58.3 -41.38 84.35 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.734 179.82 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 338' ' ' GLU . . . . . . . . . . . . . 24.9 mm-40 -66.13 -42.23 89.43 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.884 179.661 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 339' ' ' GLN . . . . . 0.418 HE21 ' HB3' ' B' ' 339' ' ' GLN . 1.0 OUTLIER -59.97 -49.29 78.24 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.13 -0.487 . . . . 0.0 110.593 179.668 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' B' B ' 340' ' ' ARG . . . . . . . . . . . . . 99.6 mtt180 -57.0 -53.82 53.7 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.896 179.867 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 341' ' ' ASN . . . . . . . . . . . . . 14.6 m120 -53.63 -38.47 64.1 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.936 179.923 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 342' ' ' ALA . . . . . . . . . . . . . . . -68.41 -32.95 73.36 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.92 179.875 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 343' ' ' LYS . . . . . . . . . . . . . 61.2 tttp -68.94 -49.23 59.85 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.092 -0.504 . . . . 0.0 111.006 179.822 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 344' ' ' GLU . . . . . . . . . . . . . 14.8 mm-40 -65.15 -36.03 82.97 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.236 -179.817 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 345' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.31 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.253 -179.965 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' B' B ' 351' ' ' PRO . . . . . . . . . . . . . 46.2 Cg_exo . . . . . 0 C--O 1.231 0.147 0 CA-C-O 120.77 0.237 . . . . 0.0 112.126 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' B' B ' 352' ' ' ALA . . . . . . . . . . . . . . . -98.41 -69.44 0.76 Allowed 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.378 -0.374 . . . . 0.0 111.458 -179.858 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 353' ' ' LEU . . . . . 0.419 HD13 HG23 ' B' ' 334' ' ' THR . 6.2 mp -87.62 119.68 28.16 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.308 -0.405 . . . . 0.0 111.205 -179.777 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 354' ' ' THR . . . . . . . . . . . . . 81.7 p -107.42 -175.16 2.71 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.978 -0.556 . . . . 0.0 110.368 179.342 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 355' ' ' GLU . . . . . . . . . . . . . 39.9 mt-10 -54.36 -35.93 63.29 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.056 0.455 . . . . 0.0 110.484 179.718 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 356' ' ' GLN . . . . . . . . . . . . . 22.6 mt-30 -72.93 -41.22 64.75 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.928 -179.998 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 357' ' ' GLU . . . . . 0.412 ' HG2' ' HG ' ' B' ' 353' ' ' LEU . 5.3 tp10 -57.52 -50.72 72.14 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.933 0.397 . . . . 0.0 110.58 -179.914 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 358' ' ' VAL . . . . . 0.44 ' O ' HG21 ' B' ' 362' ' ' VAL . 55.0 t -64.33 -58.88 5.38 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 115.982 -0.554 . . . . 0.0 111.013 179.887 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 359' ' ' TYR . . . . . . . . . . . . . 39.0 t80 -51.14 -27.16 7.87 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.491 -0.322 . . . . 0.0 111.279 -179.452 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 360' ' ' ALA . . . . . . . . . . . . . . . -74.09 -54.21 8.31 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.77 0.319 . . . . 0.0 110.838 179.59 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 361' ' ' GLN . . . . . . . . . . . . . 77.2 mt-30 -60.54 -36.01 77.39 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.527 179.705 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 362' ' ' VAL . . . . . 0.44 HG21 ' O ' ' B' ' 358' ' ' VAL . 51.2 t -70.02 -40.31 78.38 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.214 0 CA-C-N 116.013 -0.54 . . . . 0.0 110.347 179.538 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 363' ' ' ALA . . . . . 0.584 ' HA ' HD21 ' B' ' 373' ' ' LEU . . . -61.82 -38.09 86.86 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.346 179.414 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 364' ' ' ARG . . . . . . . . . . . . . 38.3 ttm180 -80.08 -23.84 41.02 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.783 -0.644 . . . . 0.0 110.146 179.317 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 365' ' ' LEU . . . . . . . . . . . . . 2.5 tp -60.64 -29.03 69.0 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.487 179.627 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 366' ' ' PHE . . . . . . . . . . . . . 25.0 m-85 -125.55 -177.98 4.09 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.38 179.747 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 367' ' ' LYS . . . . . . . . . . . . . 68.4 mttm -137.4 -82.87 0.34 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.399 -0.364 . . . . 0.0 111.164 179.919 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 368' ' ' ASN . . . . . . . . . . . . . 27.6 p-10 -82.65 1.03 40.39 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.802 0.334 . . . . 0.0 110.918 179.995 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 369' ' ' GLN . . . . . . . . . . . . . 21.2 mp0 -98.32 58.14 1.26 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.6 179.842 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 370' ' ' GLU . . . . . . . . . . . . . 41.2 mt-10 -69.78 -13.0 62.06 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.852 -179.928 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 371' ' ' ASP . . . . . . . . . . . . . 11.6 m-20 -55.58 -39.69 71.03 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.459 179.809 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 372' ' ' LEU . . . . . . . . . . . . . 6.2 mp -69.97 -37.99 75.95 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.567 179.649 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 373' ' ' LEU . . . . . 0.584 HD21 ' HA ' ' B' ' 363' ' ' ALA . 2.7 mp -62.19 -34.65 76.85 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.844 179.828 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 374' ' ' SER . . . . . . . . . . . . . 51.0 m -73.44 -55.66 6.07 Favored 'General case' 0 C--O 1.234 0.28 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.261 179.335 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 375' ' ' GLU . . . . . . . . . . . . . 43.0 mt-10 -54.91 -33.25 61.89 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-N 115.934 -0.576 . . . . 0.0 110.26 179.357 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 376' ' ' PHE . . . . . 0.415 ' O ' ' HB2' ' B' ' 379' ' ' PHE . 87.3 t80 -82.27 -30.21 30.77 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.025 179.333 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 377' ' ' GLY . . . . . . . . . . . . . . . -61.93 -33.51 85.74 Favored Glycine 0 N--CA 1.448 -0.564 0 C-N-CA 120.474 -0.87 . . . . 0.0 111.207 179.114 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 378' ' ' GLN . . . . . . . . . . . . . 98.1 mt-30 -69.75 -29.25 66.56 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.798 0.332 . . . . 0.0 110.56 179.155 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 379' ' ' PHE . . . . . 0.415 ' HB2' ' O ' ' B' ' 376' ' ' PHE . 10.2 m-85 -61.15 -40.35 93.51 Favored 'General case' 0 C--N 1.333 -0.123 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.639 179.541 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 380' ' ' LEU . . . . . . . . . . . . . 95.3 mt -58.19 136.26 84.65 Favored Pre-proline 0 C--N 1.33 -0.265 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.526 179.848 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 381' ' ' PRO . . . . . . . . . . . . . 51.5 Cg_exo . . . . . 0 C--N 1.348 0.508 0 C-N-CA 122.377 2.051 . . . . 0.0 112.251 -179.574 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 366' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.232 0.152 0 CA-C-O 120.871 0.367 . . . . 0.0 111.353 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 367' ' ' VAL . . . . . . . . . . . . . 28.0 m -68.3 -29.51 44.54 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.354 -179.925 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 368' ' ' TYR . . . . . . . . . . . . . 71.3 t80 -72.1 -47.65 49.7 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.47 -0.332 . . . . 0.0 111.252 -179.749 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 369' ' ' VAL . . . . . . . . . . . . . 13.3 m -64.58 -48.37 85.13 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.487 -0.324 . . . . 0.0 111.273 -179.846 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 370' ' ' LEU . . . . . 0.553 HD21 ' HA ' ' B' ' 307' ' ' ALA . 8.3 mp -62.97 -42.92 99.97 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.645 -0.252 . . . . 0.0 111.362 179.997 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 371' ' ' SER . . . . . 0.409 ' O ' ' HB2' ' A' ' 375' ' ' ARG . 88.7 p -57.46 -60.3 3.86 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.481 -0.327 . . . . 0.0 110.942 179.957 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 372' ' ' SER . . . . . . . . . . . . . 44.1 t -62.96 -24.2 67.77 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.31 -0.405 . . . . 0.0 111.15 -179.783 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 373' ' ' MET . . . . . . . . . . . . . 50.6 tpp -65.11 -49.16 71.06 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.797 0.332 . . . . 0.0 111.196 -179.939 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 374' ' ' ALA . . . . . . . . . . . . . . . -85.32 -17.37 37.03 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.818 -179.391 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 375' ' ' ARG . . . . . 0.409 ' HB2' ' O ' ' A' ' 371' ' ' SER . 0.0 OUTLIER -88.3 -22.21 24.01 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.712 0.291 . . . . 0.0 111.083 -179.68 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 376' ' ' GLN . . . . . . . . . . . . . 57.6 tp60 . . . . . 0 C--N 1.331 -0.198 0 CA-C-N 116.429 -0.35 . . . . 0.0 110.749 -179.937 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' B' B ' 302' ' ' VAL . . . . . 0.501 ' HA ' HD22 ' B' ' 305' ' ' ASN . 7.7 p . . . . . 0 C--O 1.234 0.265 0 CA-C-O 120.976 0.417 . . . . 0.0 111.03 . . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 303' ' ' GLU . . . . . . . . . . . . . 29.1 mt-10 -58.15 -33.83 69.63 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.888 -179.958 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 304' ' ' PHE . . . . . . . . . . . . . 76.5 t80 -58.05 -76.94 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.895 -0.593 . . . . 0.0 111.225 -179.612 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 305' ' ' ASN . . . . . 0.501 HD22 ' HA ' ' B' ' 302' ' ' VAL . 9.5 p30 -49.36 -38.8 29.55 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.757 -179.507 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 306' ' ' HIS . . . . . . . . . . . . . 2.0 m-70 -59.24 -74.63 0.07 Allowed 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 112.301 0.482 . . . . 0.0 112.301 -179.391 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 307' ' ' ALA . . . . . 0.553 ' HA ' HD21 ' A' ' 370' ' ' LEU . . . -56.48 -44.75 80.93 Favored 'General case' 0 C--N 1.33 -0.26 0 N-CA-C 112.455 0.539 . . . . 0.0 112.455 -178.542 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 308' ' ' ILE . . . . . . . . . . . . . 46.4 mm -58.11 -64.24 0.57 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 N-CA-C 111.737 0.273 . . . . 0.0 111.737 -179.51 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 309' ' ' ASN . . . . . . . . . . . . . 49.9 t30 -50.77 -37.29 41.32 Favored 'General case' 0 N--CA 1.463 0.196 0 CA-C-O 120.735 0.303 . . . . 0.0 110.972 -179.692 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 310' ' ' TYR . . . . . 0.506 ' O ' HG12 ' B' ' 314' ' ' ILE . 90.9 t80 -58.32 -65.92 0.57 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.731 179.705 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 311' ' ' VAL . . . . . . . . . . . . . 59.6 t -51.23 -29.39 8.57 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.378 -0.374 . . . . 0.0 111.163 -179.759 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 312' ' ' ASN . . . . . . . . . . . . . 27.0 t-20 -65.04 -57.09 9.56 Favored 'General case' 0 C--O 1.234 0.262 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.596 -179.832 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 313' ' ' LYS . . . . . 0.437 ' HZ2' ' HG2' ' B' ' 375' ' ' GLU . 0.1 OUTLIER -65.62 -28.95 69.49 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 120.587 0.232 . . . . 0.0 111.623 -179.371 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' B' B ' 314' ' ' ILE . . . . . 0.506 HG12 ' O ' ' B' ' 310' ' ' TYR . 20.3 mm -67.7 -44.98 85.57 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-O 120.879 0.371 . . . . 0.0 110.841 179.791 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 315' ' ' LYS . . . . . 0.439 ' HE3' ' HB3' ' B' ' 315' ' ' LYS . 1.2 tmmt? -67.34 -42.37 83.66 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.897 -179.988 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 316' ' ' ASN . . . . . . . . . . . . . 6.0 t30 -61.14 -54.39 45.1 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.398 -0.364 . . . . 0.0 111.326 -179.73 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 317' ' ' ARG . . . . . . . . . . . . . 27.9 mmm180 -59.68 -24.33 63.84 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.831 0.348 . . . . 0.0 111.123 -179.875 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 318' ' ' PHE . . . . . . . . . . . . . 34.9 m-85 -114.46 36.76 3.63 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.809 179.837 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 319' ' ' GLN . . . . . . . . . . . . . 32.1 tt0 -64.84 -18.15 64.89 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.903 -0.589 . . . . 0.0 110.893 -179.996 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 320' ' ' GLY . . . . . . . . . . . . . . . -115.64 27.03 8.6 Favored Glycine 0 N--CA 1.452 -0.269 0 C-N-CA 120.851 -0.69 . . . . 0.0 112.591 -179.956 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 321' ' ' GLN . . . . . 0.554 ' HA ' HE21 ' B' ' 321' ' ' GLN . 0.1 OUTLIER -148.74 89.32 5.03 Favored Pre-proline 0 C--N 1.329 -0.302 0 CA-C-O 120.517 0.199 . . . . 0.0 110.717 179.946 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' B' B ' 322' ' ' PRO . . . . . . . . . . . . . 87.8 Cg_endo -81.27 -22.04 6.09 Favored 'Trans proline' 0 C--N 1.347 0.459 0 C-N-CA 122.608 2.205 . . . . 0.0 112.827 -179.764 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 323' ' ' ASP . . . . . . . . . . . . . 6.4 p-10 -68.37 -53.92 20.75 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.495 -0.321 . . . . 0.0 111.219 -179.667 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 324' ' ' ILE . . . . . . . . . . . . . 56.1 mt -64.89 -44.41 96.22 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-O 120.786 0.326 . . . . 0.0 111.007 179.958 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 325' ' ' TYR . . . . . . . . . . . . . 37.3 t80 -58.72 -43.39 90.14 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.599 179.89 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 326' ' ' LYS . . . . . . . . . . . . . 63.3 tttm -62.85 -43.82 97.76 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.449 179.54 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 327' ' ' ALA . . . . . . . . . . . . . . . -55.9 -44.27 78.05 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.78 179.547 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 328' ' ' PHE . . . . . . . . . . . . . 71.5 t80 -60.67 -50.63 72.72 Favored 'General case' 0 C--O 1.233 0.223 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.484 179.732 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 329' ' ' LEU . . . . . . . . . . . . . 95.6 mt -58.3 -28.85 65.38 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 115.816 -0.629 . . . . 0.0 110.863 179.662 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 330' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 -73.07 -41.23 64.33 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.894 179.845 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 331' ' ' ILE . . . . . 0.444 HG21 HG22 ' B' ' 358' ' ' VAL . 78.8 mt -62.01 -44.51 99.05 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.199 0 CA-C-O 120.852 0.358 . . . . 0.0 110.357 179.227 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 332' ' ' LEU . . . . . . . . . . . . . 9.6 mp -69.37 -34.98 75.36 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.619 179.603 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 333' ' ' HIS . . . . . . . . . . . . . 49.4 t-80 -62.59 -53.87 48.12 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.297 179.428 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 334' ' ' THR . . . . . . . . . . . . . 86.0 m -59.87 -38.94 83.59 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.306 179.303 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 335' ' ' TYR . . . . . . . . . . . . . 55.6 t80 -62.04 -37.83 86.42 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.211 179.396 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 336' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -64.85 -47.98 75.95 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 115.76 -0.654 . . . . 0.0 110.372 179.806 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 337' ' ' LYS . . . . . . . . . . . . . 39.5 ttpt -55.17 -48.11 74.22 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.66 179.575 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 338' ' ' GLU . . . . . 0.4 ' HB3' ' HB3' ' B' ' 351' ' ' PRO . 13.6 mm-40 -60.37 -40.36 90.55 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.71 179.685 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 339' ' ' GLN . . . . . . . . . . . . . 8.6 tp-100 -58.27 -44.9 88.63 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.741 179.883 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 340' ' ' ARG . . . . . . . . . . . . . 59.1 mtp180 -62.02 -53.28 57.77 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.433 179.755 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 341' ' ' ASN . . . . . . . . . . . . . 86.6 m-20 -53.37 -31.87 46.67 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.846 -0.616 . . . . 0.0 110.577 179.341 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 342' ' ' ALA . . . . . . . . . . . . . . . -74.28 -43.15 58.06 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.97 -0.559 . . . . 0.0 111.13 179.932 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 343' ' ' LYS . . . . . . . . . . . . . 64.0 tttm -75.6 -11.8 60.09 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.709 -179.966 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 344' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -92.41 -40.48 10.85 Favored 'General case' 0 N--CA 1.453 -0.298 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.478 179.786 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 345' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.331 -0.222 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.985 179.926 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' B' B ' 351' ' ' PRO . . . . . 0.4 ' HB3' ' HB3' ' B' ' 338' ' ' GLU . 47.0 Cg_exo . . . . . 0 C--O 1.232 0.214 0 CA-C-O 120.798 0.249 . . . . 0.0 112.43 . . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 352' ' ' ALA . . . . . . . . . . . . . . . -83.08 -63.15 1.42 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.041 179.868 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 353' ' ' LEU . . . . . . . . . . . . . 6.3 mp -88.12 116.51 26.36 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.137 -179.99 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 354' ' ' THR . . . . . . . . . . . . . 61.3 p -111.25 -166.06 1.04 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.269 179.397 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 355' ' ' GLU . . . . . . . . . . . . . 8.1 pt-20 -56.8 -42.29 79.27 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.912 0.387 . . . . 0.0 110.638 179.616 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 356' ' ' GLN . . . . . . . . . . . . . 15.0 mm100 -68.07 -42.6 80.2 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.875 -0.602 . . . . 0.0 111.42 -179.888 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 357' ' ' GLU . . . . . . . . . . . . . 5.0 tp10 -60.31 -51.45 69.49 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.515 -0.311 . . . . 0.0 111.082 -179.584 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 358' ' ' VAL . . . . . 0.474 ' O ' HG21 ' B' ' 362' ' ' VAL . 4.4 t -60.41 -59.84 3.5 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.352 -0.386 . . . . 0.0 111.24 179.941 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 359' ' ' TYR . . . . . . . . . . . . . 4.4 t80 -51.97 -31.65 30.09 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.616 -0.266 . . . . 0.0 111.05 -179.285 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 360' ' ' ALA . . . . . . . . . . . . . . . -67.99 -59.71 3.06 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.527 -0.306 . . . . 0.0 110.954 179.659 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 361' ' ' GLN . . . . . . . . . . . . . 14.7 mm100 -53.43 -40.49 65.2 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.264 -0.426 . . . . 0.0 110.722 179.7 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 362' ' ' VAL . . . . . 0.474 HG21 ' O ' ' B' ' 358' ' ' VAL . 60.2 t -68.81 -37.03 76.88 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.366 179.502 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 363' ' ' ALA . . . . . 0.571 ' HA ' HD13 ' B' ' 373' ' ' LEU . . . -60.54 -35.72 76.69 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 121.042 0.449 . . . . 0.0 110.003 179.136 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 364' ' ' ARG . . . . . . . . . . . . . 77.3 ttt180 -86.16 -20.02 29.24 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.673 -0.694 . . . . 0.0 109.799 179.048 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 365' ' ' LEU . . . . . . . . . . . . . 24.8 tp -65.6 -42.33 91.75 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 115.594 -0.73 . . . . 0.0 110.393 179.497 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 366' ' ' PHE . . . . . . . . . . . . . 25.4 m-85 -112.83 144.5 42.27 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.289 179.358 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 367' ' ' LYS . . . . . . . . . . . . . 37.4 mtmm -120.76 -79.73 0.61 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.691 0.281 . . . . 0.0 111.358 -179.754 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 368' ' ' ASN . . . . . . . . . . . . . 33.6 m-80 -70.99 -14.83 62.49 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.341 -0.39 . . . . 0.0 110.938 -179.842 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 369' ' ' GLN . . . . . 0.411 HE21 ' HB2' ' B' ' 369' ' ' GLN . 17.4 mt-30 -107.7 94.03 4.86 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.0 179.932 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 370' ' ' GLU . . . . . . . . . . . . . 45.1 mt-10 -93.56 -5.06 49.79 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.996 -179.982 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 371' ' ' ASP . . . . . . . . . . . . . 8.9 m-20 -47.29 -63.78 0.95 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.322 -179.856 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 372' ' ' LEU . . . . . 0.525 ' N ' HD12 ' B' ' 372' ' ' LEU . 0.0 OUTLIER -58.6 -33.34 69.88 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.37 -0.377 . . . . 0.0 111.172 -179.906 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' B' B ' 373' ' ' LEU . . . . . 0.571 HD13 ' HA ' ' B' ' 363' ' ' ALA . 5.4 tp -58.54 -52.93 63.59 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.112 -0.494 . . . . 0.0 111.236 -179.399 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 374' ' ' SER . . . . . . . . . . . . . 46.7 t -64.95 -46.21 82.54 Favored 'General case' 0 C--O 1.233 0.23 0 CA-C-O 120.942 0.401 . . . . 0.0 110.536 179.788 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 375' ' ' GLU . . . . . 0.437 ' HG2' ' HZ2' ' B' ' 313' ' ' LYS . 10.5 tp10 -54.36 -35.11 62.43 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.792 -0.64 . . . . 0.0 110.441 179.647 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 376' ' ' PHE . . . . . 0.433 ' HB2' ' HH ' ' B' ' 310' ' ' TYR . 85.9 t80 -78.31 -32.77 49.46 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.089 179.49 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 377' ' ' GLY . . . . . . . . . . . . . . . -60.99 -36.0 91.57 Favored Glycine 0 N--CA 1.449 -0.481 0 C-N-CA 120.805 -0.712 . . . . 0.0 111.977 179.581 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 378' ' ' GLN . . . . . . . . . . . . . 88.5 mt-30 -55.49 -28.33 53.96 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-O 120.826 0.346 . . . . 0.0 110.67 179.497 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 379' ' ' PHE . . . . . 0.447 ' HB3' ' H ' ' B' ' 380' ' ' LEU . 67.0 m-85 -72.69 -146.2 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.399 179.39 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 380' ' ' LEU . . . . . 0.447 ' H ' ' HB3' ' B' ' 379' ' ' PHE . 40.4 mt 67.13 143.18 0.08 OUTLIER Pre-proline 0 N--CA 1.462 0.173 0 CA-C-N 116.492 -0.322 . . . . 0.0 110.871 -179.874 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 381' ' ' PRO . . . . . . . . . . . . . 52.2 Cg_exo . . . . . 0 C--N 1.347 0.456 0 C-N-CA 122.563 2.176 . . . . 0.0 112.398 -179.988 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 366' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.237 0.418 0 CA-C-O 121.229 0.538 . . . . 0.0 110.333 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 367' ' ' VAL . . . . . . . . . . . . . 32.7 m -59.66 -29.05 41.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 115.441 -0.799 . . . . 0.0 110.52 179.533 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 368' ' ' TYR . . . . . . . . . . . . . 91.6 t80 -62.43 -42.27 99.33 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.35 179.452 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 369' ' ' VAL . . . . . . . . . . . . . 18.6 t -68.29 -52.76 34.25 Favored 'Isoleucine or valine' 0 C--O 1.234 0.285 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.635 179.641 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 370' ' ' LEU . . . . . . . . . . . . . 97.0 mt -57.16 -36.07 70.31 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.995 179.923 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 371' ' ' SER . . . . . . . . . . . . . 67.7 m -69.49 -41.69 75.8 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.587 179.773 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 372' ' ' SER . . . . . . . . . . . . . 64.4 m -61.31 -35.14 76.54 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.642 179.746 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 373' ' ' MET . . . . . . . . . . . . . 65.4 mtt -70.44 -48.54 55.5 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.313 179.728 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 374' ' ' ALA . . . . . . . . . . . . . . . -72.92 -19.2 61.31 Favored 'General case' 0 C--N 1.331 -0.239 0 N-CA-C 112.054 0.39 . . . . 0.0 112.054 -179.283 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 375' ' ' ARG . . . . . . . . . . . . . 28.9 mmt180 -90.84 -32.67 15.97 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 111.582 0.216 . . . . 0.0 111.582 -179.584 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 376' ' ' GLN . . . . . . . . . . . . . 6.3 tp-100 . . . . . 0 C--N 1.329 -0.304 0 CA-C-O 120.677 0.275 . . . . 0.0 110.814 -179.996 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' B' B ' 302' ' ' VAL . . . . . . . . . . . . . 35.9 m . . . . . 0 C--O 1.232 0.151 0 CA-C-O 120.771 0.32 . . . . 0.0 111.093 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' B' B ' 303' ' ' GLU . . . . . . . . . . . . . 46.5 mt-10 -58.04 -83.25 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.0 -0.545 . . . . 0.0 111.422 -179.724 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 304' ' ' PHE . . . . . . . . . . . . . 99.6 m-85 -59.97 -30.46 69.13 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.339 -179.583 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 305' ' ' ASN . . . . . . . . . . . . . 27.3 t-20 -58.21 -69.69 0.17 Allowed 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.402 -0.363 . . . . 0.0 111.45 -179.599 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 306' ' ' HIS . . . . . . . . . . . . . 20.5 m-70 -62.57 -47.16 85.04 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.123 -0.489 . . . . 0.0 112.147 -179.152 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 307' ' ' ALA . . . . . . . . . . . . . . . -56.61 -62.45 1.72 Allowed 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 112.361 0.504 . . . . 0.0 112.361 -178.921 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 308' ' ' ILE . . . . . . . . . . . . . 85.1 mt -56.56 -49.41 77.75 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.247 0 N-CA-C 111.644 0.239 . . . . 0.0 111.644 -179.335 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 309' ' ' ASN . . . . . . . . . . . . . 36.7 t30 -54.21 -42.73 70.12 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.885 0.374 . . . . 0.0 111.011 -179.82 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 310' ' ' TYR . . . . . 0.518 ' HH ' ' HB2' ' B' ' 376' ' ' PHE . 84.5 t80 -61.94 -62.78 1.54 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.949 -179.808 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 311' ' ' VAL . . . . . . . . . . . . . 43.6 t -54.24 -25.61 13.81 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-O 120.859 0.361 . . . . 0.0 110.978 -179.833 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 312' ' ' ASN . . . . . . . . . . . . . 2.8 t-20 -67.9 -56.71 8.03 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.026 -179.924 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 313' ' ' LYS . . . . . 0.446 ' HD3' ' N ' ' B' ' 314' ' ' ILE . 0.1 OUTLIER -65.32 -30.53 71.38 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.519 -0.309 . . . . 0.0 111.514 -179.592 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' B' B ' 314' ' ' ILE . . . . . 0.456 HG12 ' O ' ' B' ' 310' ' ' TYR . 25.9 mm -70.06 -40.55 78.55 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.197 0 CA-C-O 120.945 0.402 . . . . 0.0 110.744 179.578 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 315' ' ' LYS . . . . . 0.613 ' HZ2' ' HB2' ' B' ' 315' ' ' LYS . 4.3 ttmp? -66.92 -42.42 85.4 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.936 -0.574 . . . . 0.0 110.911 -179.899 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 316' ' ' ASN . . . . . . . . . . . . . 27.6 t-20 -64.19 -52.61 58.05 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.333 -179.713 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 317' ' ' ARG . . . . . 0.442 ' HA ' ' NE ' ' B' ' 317' ' ' ARG . 4.7 mmp_? -59.38 -60.75 3.36 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.904 0.383 . . . . 0.0 111.197 -179.873 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 318' ' ' PHE . . . . . . . . . . . . . 65.4 m-85 -85.23 38.14 0.71 Allowed 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.093 -0.503 . . . . 0.0 111.379 -179.559 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 319' ' ' GLN . . . . . . . . . . . . . 22.6 tt0 -65.28 -26.17 67.96 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.706 179.863 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 320' ' ' GLY . . . . . . . . . . . . . . . -96.9 -5.43 58.49 Favored Glycine 0 N--CA 1.451 -0.301 0 C-N-CA 120.804 -0.712 . . . . 0.0 112.624 -179.845 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 321' ' ' GLN . . . . . . . . . . . . . 27.8 mm-40 -108.33 94.04 12.65 Favored Pre-proline 0 C--N 1.329 -0.298 0 CA-C-O 120.45 0.167 . . . . 0.0 110.945 -179.962 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 322' ' ' PRO . . . . . . . . . . . . . 97.1 Cg_endo -79.69 -33.78 1.16 Allowed 'Trans proline' 0 C--N 1.348 0.531 0 C-N-CA 122.459 2.106 . . . . 0.0 112.458 -179.911 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 323' ' ' ASP . . . . . . . . . . . . . 20.8 m-20 -63.86 -51.7 63.44 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.146 -179.682 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 324' ' ' ILE . . . . . . . . . . . . . 57.1 mt -65.12 -46.24 91.73 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.424 -179.696 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 325' ' ' TYR . . . . . 0.41 ' O ' HD22 ' B' ' 329' ' ' LEU . 35.0 t80 -57.57 -58.43 8.34 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.996 -179.624 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 326' ' ' LYS . . . . . . . . . . . . . 14.2 mptt -54.03 -44.73 71.23 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.017 179.916 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 327' ' ' ALA . . . . . . . . . . . . . . . -53.59 -45.64 70.09 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 121.055 0.455 . . . . 0.0 110.916 179.802 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 328' ' ' PHE . . . . . . . . . . . . . 54.9 t80 -60.54 -54.92 39.7 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.857 -0.611 . . . . 0.0 110.822 179.961 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 329' ' ' LEU . . . . . 0.41 HD22 ' O ' ' B' ' 325' ' ' TYR . 4.0 mm? -59.76 -25.63 65.03 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.652 179.815 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 330' ' ' GLU . . . . . . . . . . . . . 10.2 mm-40 -69.76 -41.97 74.48 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.39 -0.368 . . . . 0.0 110.037 179.107 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 331' ' ' ILE . . . . . . . . . . . . . 84.8 mt -63.88 -42.41 95.71 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.038 178.814 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 332' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -64.48 -44.42 91.09 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.655 -0.702 . . . . 0.0 110.671 179.532 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 333' ' ' HIS . . . . . . . . . . . . . 54.1 t-80 -61.95 -56.27 20.9 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.777 -179.99 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 334' ' ' THR . . . . . . . . . . . . . 70.9 m -54.16 -37.51 64.52 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.338 179.486 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 335' ' ' TYR . . . . . . . . . . . . . 60.7 t80 -63.27 -38.56 91.66 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.069 179.299 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 336' ' ' GLN . . . . . . . . . . . . . 23.8 tt0 -64.68 -43.83 92.27 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.729 179.454 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 337' ' ' LYS . . . . . . . . . . . . . 26.9 ttpp -59.16 -52.24 66.57 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.821 -179.849 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 338' ' ' GLU . . . . . . . . . . . . . 35.5 mm-40 -58.29 -42.84 87.48 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.797 179.706 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 339' ' ' GLN . . . . . . . . . . . . . 8.7 tt0 -59.36 -41.1 88.46 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.755 -179.963 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 340' ' ' ARG . . . . . . . . . . . . . 99.1 mtt180 -62.41 -52.03 65.2 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.753 179.772 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 341' ' ' ASN . . . . . . . . . . . . . 18.9 m120 -60.96 -27.2 68.09 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.872 179.881 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 342' ' ' ALA . . . . . . . . . . . . . . . -73.8 -42.22 61.26 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.21 179.973 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 343' ' ' LYS . . . . . . . . . . . . . 98.6 mttt -76.61 -24.66 53.41 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.99 -179.95 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 344' ' ' GLU . . . . . . . . . . . . . 15.6 mm-40 -82.43 -34.01 28.35 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.264 -0.426 . . . . 0.0 110.861 179.814 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 345' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.295 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.066 179.911 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' B' B ' 351' ' ' PRO . . . . . . . . . . . . . 51.8 Cg_exo . . . . . 0 C--O 1.231 0.138 0 CA-C-O 120.88 0.283 . . . . 0.0 112.288 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' B' B ' 352' ' ' ALA . . . . . . . . . . . . . . . -62.75 -57.27 11.52 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.066 -0.516 . . . . 0.0 111.401 -179.739 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 353' ' ' LEU . . . . . 0.424 ' HG ' ' HG2' ' B' ' 357' ' ' GLU . 5.9 mp -101.33 121.97 42.86 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 120.924 0.392 . . . . 0.0 111.375 -179.846 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 354' ' ' THR . . . . . . . . . . . . . 79.9 p -112.35 -170.76 1.72 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.389 179.158 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 355' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -57.57 -37.45 73.17 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.997 0.427 . . . . 0.0 110.28 179.654 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 356' ' ' GLN . . . . . . . . . . . . . 93.5 mt-30 -71.21 -40.71 70.96 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.807 -0.633 . . . . 0.0 111.029 -179.857 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 357' ' ' GLU . . . . . 0.424 ' HG2' ' HG ' ' B' ' 353' ' ' LEU . 6.6 tp10 -59.34 -52.74 64.32 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 116.345 -0.389 . . . . 0.0 110.908 -179.62 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 358' ' ' VAL . . . . . 0.421 ' O ' HG21 ' B' ' 362' ' ' VAL . 76.3 t -61.51 -54.66 31.87 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.942 179.842 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 359' ' ' TYR . . . . . . . . . . . . . 38.4 t80 -54.57 -28.66 47.59 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.689 0.281 . . . . 0.0 111.196 -179.444 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 360' ' ' ALA . . . . . . . . . . . . . . . -72.09 -60.66 2.12 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.867 0.365 . . . . 0.0 110.981 179.768 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 361' ' ' GLN . . . . . . . . . . . . . 24.2 mm-40 -55.0 -40.33 69.99 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.593 179.788 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 362' ' ' VAL . . . . . 0.421 HG21 ' O ' ' B' ' 358' ' ' VAL . 90.5 t -66.25 -39.87 85.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.304 179.338 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 363' ' ' ALA . . . . . 0.536 ' HA ' HD23 ' B' ' 373' ' ' LEU . . . -58.98 -36.93 75.7 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.139 179.227 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 364' ' ' ARG . . . . . . . . . . . . . 98.2 mtt180 -80.74 -25.29 38.13 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.729 -0.669 . . . . 0.0 110.41 179.387 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 365' ' ' LEU . . . . . . . . . . . . . 14.6 tp -61.14 -29.67 69.93 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.456 179.843 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 366' ' ' PHE . . . . . . . . . . . . . 43.9 m-85 -120.09 -170.2 1.92 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.855 -0.611 . . . . 0.0 110.164 179.545 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 367' ' ' LYS . . . . . . . . . . . . . 61.0 tttp -158.32 -84.24 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.663 0.268 . . . . 0.0 111.38 179.944 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 368' ' ' ASN . . . . . . . . . . . . . 80.6 m-20 -70.0 -7.87 44.41 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.378 -0.373 . . . . 0.0 110.948 -179.83 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 369' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -110.57 86.83 2.39 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.888 179.999 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 370' ' ' GLU . . . . . . . . . . . . . 42.8 mt-10 -91.36 -12.55 34.57 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.396 -0.365 . . . . 0.0 110.553 179.837 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 371' ' ' ASP . . . . . . . . . . . . . 19.2 t70 -55.1 -34.11 63.4 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 116.158 -0.473 . . . . 0.0 110.155 179.476 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 372' ' ' LEU . . . . . . . . . . . . . 6.0 mp -69.97 -38.16 76.0 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.662 -0.699 . . . . 0.0 110.211 179.15 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 373' ' ' LEU . . . . . 0.536 HD23 ' HA ' ' B' ' 363' ' ' ALA . 1.7 mp -63.26 -37.31 86.75 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.733 -0.667 . . . . 0.0 110.783 179.793 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 374' ' ' SER . . . . . . . . . . . . . 61.6 m -72.67 -57.14 4.35 Favored 'General case' 0 C--O 1.235 0.339 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.462 179.532 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 375' ' ' GLU . . . . . . . . . . . . . 17.2 mm-40 -52.56 -40.58 62.72 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.565 179.503 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 376' ' ' PHE . . . . . 0.518 ' HB2' ' HH ' ' B' ' 310' ' ' TYR . 81.5 t80 -72.8 -34.47 66.92 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.13 -0.487 . . . . 0.0 109.99 179.442 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 377' ' ' GLY . . . . . . . . . . . . . . . -58.97 -32.74 71.36 Favored Glycine 0 N--CA 1.449 -0.485 0 C-N-CA 120.583 -0.818 . . . . 0.0 111.373 179.091 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 378' ' ' GLN . . . . . . . . . . . . . 15.8 mm100 -56.98 -36.31 70.18 Favored 'General case' 0 C--N 1.333 -0.142 0 CA-C-O 120.929 0.395 . . . . 0.0 110.09 178.829 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 379' ' ' PHE . . . . . . . . . . . . . 70.3 m-85 -68.14 -42.06 80.68 Favored 'General case' 0 C--N 1.333 -0.144 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.243 179.339 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 380' ' ' LEU . . . . . . . . . . . . . 5.8 tp -51.38 121.27 16.62 Favored Pre-proline 0 C--N 1.329 -0.306 0 CA-C-N 115.554 -0.748 . . . . 0.0 110.667 -179.829 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 381' ' ' PRO . . . . . . . . . . . . . 84.9 Cg_exo . . . . . 0 C--N 1.351 0.677 0 C-N-CA 122.413 2.075 . . . . 0.0 112.462 -179.984 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 366' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.234 0.253 0 CA-C-O 120.906 0.384 . . . . 0.0 110.643 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 367' ' ' VAL . . . . . . . . . . . . . 21.4 t -53.28 -32.65 19.74 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 115.892 -0.595 . . . . 0.0 110.986 179.969 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 368' ' ' TYR . . . . . . . . . . . . . 66.3 t80 -68.02 -36.78 80.52 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.675 179.785 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 369' ' ' VAL . . . . . . . . . . . . . 6.0 t -67.26 -52.97 36.99 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.238 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.728 179.85 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 370' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -62.32 -32.36 73.1 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.766 179.801 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 371' ' ' SER . . . . . . . . . . . . . 27.2 t -64.12 -58.34 6.94 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.045 179.878 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 372' ' ' SER . . . . . . . . . . . . . 41.7 t -59.68 -32.5 70.54 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.09 -179.86 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 373' ' ' MET . . . . . . . . . . . . . 55.6 ttm -63.99 -47.24 81.09 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.402 -0.363 . . . . 0.0 111.174 179.935 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 374' ' ' ALA . . . . . . . . . . . . . . . -83.17 -13.79 54.77 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.363 -0.38 . . . . 0.0 111.686 -179.715 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 375' ' ' ARG . . . . . 0.49 ' HG2' ' HG2' ' B' ' 303' ' ' GLU . 7.0 mmt180 -86.07 -30.73 22.38 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.487 -0.324 . . . . 0.0 111.25 -179.844 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 376' ' ' GLN . . . . . 0.459 ' HB3' ' HG3' ' B' ' 381' ' ' PRO . 52.6 tt0 . . . . . 0 C--N 1.329 -0.322 0 CA-C-N 116.255 -0.429 . . . . 0.0 111.179 -179.617 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 302' ' ' VAL . . . . . . . . . . . . . 15.0 p . . . . . 0 C--O 1.232 0.137 0 CA-C-O 120.89 0.376 . . . . 0.0 110.805 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' B' B ' 303' ' ' GLU . . . . . 0.49 ' HG2' ' HG2' ' A' ' 375' ' ' ARG . 35.5 mt-10 -51.64 -80.75 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.77 -0.65 . . . . 0.0 111.879 -179.34 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 304' ' ' PHE . . . . . 0.487 ' O ' HG12 ' B' ' 308' ' ' ILE . 81.0 m-85 -54.79 -55.0 34.78 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.918 -0.583 . . . . 0.0 112.043 -179.023 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 305' ' ' ASN . . . . . . . . . . . . . 2.8 t-20 -47.58 -68.89 0.15 Allowed 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 112.87 0.693 . . . . 0.0 112.87 -178.668 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 306' ' ' HIS . . . . . . . . . . . . . 2.5 t-160 -54.98 -46.33 75.1 Favored 'General case' 0 C--N 1.33 -0.266 0 N-CA-C 112.417 0.525 . . . . 0.0 112.417 -178.244 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 307' ' ' ALA . . . . . . . . . . . . . . . -58.6 -62.19 2.04 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 112.37 0.507 . . . . 0.0 112.37 -178.89 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 308' ' ' ILE . . . . . 0.487 HG12 ' O ' ' B' ' 304' ' ' PHE . 30.9 pt -54.68 -37.74 40.72 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.208 0 N-CA-C 111.825 0.306 . . . . 0.0 111.825 -179.173 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 309' ' ' ASN . . . . . 0.411 ' N ' HG13 ' B' ' 308' ' ' ILE . 5.3 m-20 -61.58 -45.27 94.85 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.896 0.379 . . . . 0.0 110.804 179.987 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 310' ' ' TYR . . . . . 0.481 ' O ' HG12 ' B' ' 314' ' ' ILE . 81.4 t80 -61.54 -60.13 4.16 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.847 179.869 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 311' ' ' VAL . . . . . . . . . . . . . 47.5 t -54.13 -31.26 21.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-O 120.896 0.379 . . . . 0.0 111.178 -179.572 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 312' ' ' ASN . . . . . . . . . . . . . 3.2 t-20 -65.11 -56.52 12.48 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.361 -179.668 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 313' ' ' LYS . . . . . 0.56 ' HZ1' ' HB2' ' B' ' 313' ' ' LYS . 0.0 OUTLIER -65.31 -23.52 67.04 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 116.493 -0.321 . . . . 0.0 111.595 -179.555 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' B' B ' 314' ' ' ILE . . . . . 0.481 HG12 ' O ' ' B' ' 310' ' ' TYR . 24.6 mm -76.68 -36.61 27.45 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-O 120.814 0.34 . . . . 0.0 111.087 179.723 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 315' ' ' LYS . . . . . . . . . . . . . 1.2 tmmt? -75.84 -35.94 59.8 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.404 -0.362 . . . . 0.0 110.858 -179.982 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 316' ' ' ASN . . . . . . . . . . . . . 27.0 t-20 -74.4 -46.0 43.11 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.045 -0.525 . . . . 0.0 111.525 -179.47 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 317' ' ' ARG . . . . . . . . . . . . . 19.1 tpt180 -68.61 -25.55 64.91 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.448 -0.342 . . . . 0.0 111.177 -179.644 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 318' ' ' PHE . . . . . . . . . . . . . 95.7 m-85 -117.31 37.51 3.85 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.172 -179.837 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 319' ' ' GLN . . . . . . . . . . . . . 3.0 pt20 -63.4 -15.15 56.7 Favored 'General case' 0 N--CA 1.447 -0.586 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.925 179.591 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 320' ' ' GLY . . . . . . . . . . . . . . . -104.98 -7.22 38.79 Favored Glycine 0 C--N 1.331 0.284 0 C-N-CA 120.837 -0.697 . . . . 0.0 112.697 -179.85 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 321' ' ' GLN . . . . . . . . . . . . . 23.5 mp0 -113.05 88.32 11.92 Favored Pre-proline 0 C--N 1.33 -0.281 0 CA-C-O 120.549 0.214 . . . . 0.0 111.004 -179.991 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 322' ' ' PRO . . . . . . . . . . . . . 90.2 Cg_endo -80.87 -26.5 3.6 Favored 'Trans proline' 0 C--N 1.348 0.507 0 C-N-CA 122.474 2.116 . . . . 0.0 112.689 179.778 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 323' ' ' ASP . . . . . . . . . . . . . 12.4 m-20 -67.05 -56.82 8.41 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.383 -179.542 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 324' ' ' ILE . . . . . . . . . . . . . 57.1 mt -64.3 -43.39 97.17 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 CA-C-N 116.299 -0.41 . . . . 0.0 111.195 -179.784 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 325' ' ' TYR . . . . . . . . . . . . . 55.1 t80 -57.12 -58.23 9.09 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.714 179.957 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 326' ' ' LYS . . . . . 0.432 ' O ' ' HG2' ' B' ' 330' ' ' GLU . 58.6 mtpt -52.2 -50.02 62.72 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.012 179.833 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 327' ' ' ALA . . . . . 0.431 ' O ' ' HB2' ' B' ' 330' ' ' GLU . . . -50.35 -46.46 55.76 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 116.369 -0.378 . . . . 0.0 111.207 179.997 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 328' ' ' PHE . . . . . . . . . . . . . 71.3 t80 -58.01 -53.5 57.49 Favored 'General case' 0 C--O 1.237 0.44 0 CA-C-O 121.062 0.458 . . . . 0.0 109.985 179.293 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 329' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -58.73 -27.73 65.19 Favored 'General case' 0 N--CA 1.452 -0.327 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.372 179.082 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 330' ' ' GLU . . . . . 0.432 ' HG2' ' O ' ' B' ' 326' ' ' LYS . 27.4 mm-40 -69.23 -39.22 78.66 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.035 179.464 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 331' ' ' ILE . . . . . 0.485 HG21 HG23 ' B' ' 358' ' ' VAL . 68.2 mt -63.8 -50.51 77.39 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.23 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.254 179.204 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 332' ' ' LEU . . . . . . . . . . . . . 11.0 mp -66.48 -28.92 68.96 Favored 'General case' 0 C--O 1.233 0.2 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.796 179.643 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 333' ' ' HIS . . . . . . . . . . . . . 34.4 t-80 -66.88 -61.05 2.14 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.401 179.348 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 334' ' ' THR . . . . . . . . . . . . . 95.3 m -56.1 -34.29 65.89 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.925 -0.579 . . . . 0.0 110.242 179.286 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 335' ' ' TYR . . . . . . . . . . . . . 52.4 t80 -63.79 -41.73 97.88 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.809 -0.632 . . . . 0.0 110.245 179.31 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 336' ' ' GLN . . . . . . . . . . . . . 44.4 tt0 -62.77 -47.07 85.08 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.773 179.665 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 337' ' ' LYS . . . . . . . . . . . . . 28.7 ttpp -56.72 -54.32 47.52 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.177 -179.914 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 338' ' ' GLU . . . . . . . . . . . . . 19.7 mm-40 -60.94 -33.34 73.03 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.272 -179.916 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 339' ' ' GLN . . . . . . . . . . . . . 60.5 tt0 -63.14 -61.22 2.52 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.854 -179.949 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 340' ' ' ARG . . . . . . . . . . . . . 95.4 mtt180 -52.54 -52.67 53.68 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.011 -0.54 . . . . 0.0 111.084 -179.99 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 341' ' ' ASN . . . . . . . . . . . . . 80.2 m-20 -54.32 -40.66 68.2 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.952 179.906 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 342' ' ' ALA . . . . . . . . . . . . . . . -66.89 -31.25 71.72 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.119 179.961 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 343' ' ' LYS . . . . . . . . . . . . . 14.0 mmmm -72.35 -46.64 54.61 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.112 -0.494 . . . . 0.0 111.195 -179.885 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 344' ' ' GLU . . . . . . . . . . . . . 14.1 mm-40 -69.7 -29.23 66.59 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.17 -179.706 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 345' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.297 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.215 -179.898 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' B' B ' 351' ' ' PRO . . . . . . . . . . . . . 52.5 Cg_exo . . . . . 0 C--O 1.232 0.176 0 CA-C-O 120.843 0.268 . . . . 0.0 112.459 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' B' B ' 352' ' ' ALA . . . . . . . . . . . . . . . -77.26 -41.71 39.94 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.058 179.947 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 353' ' ' LEU . . . . . 0.421 ' HG ' ' HG2' ' B' ' 357' ' ' GLU . 7.1 mp -114.74 130.32 56.82 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.01 179.969 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 354' ' ' THR . . . . . . . . . . . . . 81.0 p -112.36 -174.86 2.55 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.055 -0.521 . . . . 0.0 110.805 179.769 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 355' ' ' GLU . . . . . . . . . . . . . 8.5 pt-20 -56.54 -42.14 77.97 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 121.209 0.528 . . . . 0.0 110.573 179.985 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 356' ' ' GLN . . . . . . . . . . . . . 15.8 mm100 -65.95 -38.92 89.85 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.5 -0.773 . . . . 0.0 111.055 179.789 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 357' ' ' GLU . . . . . 0.421 ' HG2' ' HG ' ' B' ' 353' ' ' LEU . 5.5 tp10 -61.33 -46.48 90.09 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 120.856 0.36 . . . . 0.0 110.707 -179.833 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 358' ' ' VAL . . . . . 0.485 HG23 HG21 ' B' ' 331' ' ' ILE . 71.5 t -63.5 -59.92 3.57 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-N 116.101 -0.499 . . . . 0.0 111.173 179.889 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 359' ' ' TYR . . . . . . . . . . . . . 46.5 t80 -52.36 -32.47 38.6 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.375 -0.375 . . . . 0.0 111.569 -179.335 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 360' ' ' ALA . . . . . . . . . . . . . . . -68.42 -60.54 2.36 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.77 0.319 . . . . 0.0 111.075 -179.95 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 361' ' ' GLN . . . . . . . . . . . . . 25.0 mt-30 -55.44 -45.5 76.82 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.68 179.939 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 362' ' ' VAL . . . . . 0.431 HG21 ' O ' ' B' ' 358' ' ' VAL . 57.5 t -61.61 -36.96 76.66 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.217 0 CA-C-N 116.152 -0.477 . . . . 0.0 110.305 179.399 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 363' ' ' ALA . . . . . 0.415 ' HA ' HD13 ' B' ' 373' ' ' LEU . . . -63.84 -34.69 78.49 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.104 179.133 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 364' ' ' ARG . . . . . . . . . . . . . 59.2 ttt180 -75.83 -26.93 57.64 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.821 -0.627 . . . . 0.0 110.085 179.197 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 365' ' ' LEU . . . . . . . . . . . . . 2.5 mp -60.04 -57.97 10.53 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.792 179.333 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 366' ' ' PHE . . . . . . . . . . . . . 4.9 m-85 -104.97 133.72 49.29 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.609 179.937 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 367' ' ' LYS . . . . . . . . . . . . . 96.7 mttt -105.23 -78.0 0.58 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.844 0.354 . . . . 0.0 111.15 -179.636 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 368' ' ' ASN . . . . . . . . . . . . . 14.8 m120 -66.88 -16.59 64.41 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.935 -179.982 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 369' ' ' GLN . . . . . . . . . . . . . 22.7 mt-30 -97.02 85.75 3.81 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.947 179.964 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 370' ' ' GLU . . . . . . . . . . . . . 10.5 mm-40 -94.06 -6.03 46.09 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.068 -0.515 . . . . 0.0 111.095 179.847 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 371' ' ' ASP . . . . . . . . . . . . . 20.2 t70 -58.67 -62.77 1.62 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.009 -179.976 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 372' ' ' LEU . . . . . 0.496 HD12 ' H ' ' B' ' 373' ' ' LEU . 0.3 OUTLIER -62.25 -22.52 66.04 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.077 179.927 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' B' B ' 373' ' ' LEU . . . . . 0.496 ' H ' HD12 ' B' ' 372' ' ' LEU . 6.1 tp -70.18 -39.82 75.04 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.25 -179.997 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 374' ' ' SER . . . . . . . . . . . . . 54.7 m -71.98 -48.82 42.24 Favored 'General case' 0 C--O 1.234 0.274 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.065 179.247 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 375' ' ' GLU . . . . . . . . . . . . . 15.3 mm-40 -54.43 -44.79 72.75 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-N 116.009 -0.542 . . . . 0.0 110.057 179.361 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 376' ' ' PHE . . . . . . . . . . . . . 82.3 t80 -65.54 -38.52 89.85 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.015 -0.538 . . . . 0.0 109.934 179.206 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 377' ' ' GLY . . . . . . . . . . . . . . . -58.05 -34.27 72.12 Favored Glycine 0 N--CA 1.449 -0.451 0 C-N-CA 120.683 -0.77 . . . . 0.0 111.721 179.332 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 378' ' ' GLN . . . . . . . . . . . . . 98.1 mt-30 -60.99 -34.73 75.24 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.68 0.276 . . . . 0.0 110.711 179.381 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 379' ' ' PHE . . . . . . . . . . . . . 56.6 m-85 -59.57 -36.5 76.34 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.57 179.656 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 380' ' ' LEU . . . . . . . . . . . . . 93.5 mt -54.22 145.49 35.44 Favored Pre-proline 0 C--N 1.331 -0.204 0 CA-C-N 115.921 -0.581 . . . . 0.0 110.644 179.834 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 381' ' ' PRO . . . . . 0.459 ' HG3' ' HB3' ' A' ' 376' ' ' GLN . 76.6 Cg_exo . . . . . 0 C--N 1.346 0.428 0 C-N-CA 122.408 2.072 . . . . 0.0 112.226 179.929 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 366' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.232 0.132 0 CA-C-O 120.973 0.416 . . . . 0.0 110.762 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 367' ' ' VAL . . . . . . . . . . . . . 21.9 t -59.64 -19.4 16.81 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.744 179.918 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 368' ' ' TYR . . . . . . . . . . . . . 84.7 t80 -65.91 -60.03 3.26 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.061 -179.993 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 369' ' ' VAL . . . . . 0.442 HG23 ' HB3' ' B' ' 332' ' ' LEU . 20.8 m -67.82 -36.82 77.14 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.19 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.555 -179.697 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 370' ' ' LEU . . . . . . . . . . . . . 97.5 mt -62.4 -58.46 7.56 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.958 0.409 . . . . 0.0 110.94 179.88 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 371' ' ' SER . . . . . . . . . . . . . 36.6 t -58.87 -51.4 70.17 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.045 -0.525 . . . . 0.0 111.037 179.8 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 372' ' ' SER . . . . . . . . . . . . . 93.0 p -55.17 -41.32 71.72 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.338 -179.503 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 373' ' ' MET . . . . . 0.492 ' HG2' ' H ' ' B' ' 380' ' ' LEU . 54.3 ttm -62.97 -41.49 99.56 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.458 -0.337 . . . . 0.0 111.186 -179.724 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 374' ' ' ALA . . . . . . . . . . . . . . . -87.03 -6.68 58.65 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.357 -0.383 . . . . 0.0 111.922 -179.595 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 375' ' ' ARG . . . . . . . . . . . . . 22.1 mmm180 -107.81 -12.64 15.16 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.591 0.234 . . . . 0.0 111.603 -179.804 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 376' ' ' GLN . . . . . 0.553 ' HB3' ' HG3' ' B' ' 381' ' ' PRO . 54.0 tt0 . . . . . 0 C--N 1.33 -0.244 0 CA-C-O 121.039 0.447 . . . . 0.0 110.892 -179.727 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 302' ' ' VAL . . . . . . . . . . . . . 8.2 p . . . . . 0 C--O 1.232 0.182 0 CA-C-O 121.071 0.463 . . . . 0.0 110.912 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' B' B ' 303' ' ' GLU . . . . . . . . . . . . . 18.7 mt-10 -54.48 -81.18 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.629 -0.714 . . . . 0.0 111.709 -179.244 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 304' ' ' PHE . . . . . 0.542 ' HA ' HD13 ' B' ' 308' ' ' ILE . 80.8 t80 -51.07 -50.15 59.25 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.871 -179.199 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 305' ' ' ASN . . . . . . . . . . . . . 27.7 t-20 -50.43 -72.76 0.05 OUTLIER 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 112.634 0.605 . . . . 0.0 112.634 -178.817 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 306' ' ' HIS . . . . . . . . . . . . . 20.1 m-70 -58.95 -55.27 37.33 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 113.024 0.75 . . . . 0.0 113.024 -177.994 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 307' ' ' ALA . . . . . . . . . . . . . . . -50.66 -62.37 1.64 Allowed 'General case' 0 CA--C 1.532 0.277 0 N-CA-C 112.554 0.576 . . . . 0.0 112.554 -178.678 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 308' ' ' ILE . . . . . 0.542 HD13 ' HA ' ' B' ' 304' ' ' PHE . 1.8 mp -57.91 -52.79 53.78 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.219 0 N-CA-C 112.024 0.379 . . . . 0.0 112.024 -179.071 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 309' ' ' ASN . . . . . . . . . . . . . 12.3 m120 -54.33 -28.97 46.24 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.643 0.258 . . . . 0.0 111.427 -179.473 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 310' ' ' TYR . . . . . 0.542 ' O ' ' HG3' ' B' ' 313' ' ' LYS . 43.7 t80 -74.09 -61.26 1.92 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.948 0.404 . . . . 0.0 111.059 -179.674 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 311' ' ' VAL . . . . . . . . . . . . . 58.5 t -58.64 -27.73 35.01 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.428 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.673 179.949 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 312' ' ' ASN . . . . . . . . . . . . . 7.5 t30 -72.49 -56.69 5.01 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.71 -179.148 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 313' ' ' LYS . . . . . 0.542 ' HG3' ' O ' ' B' ' 310' ' ' TYR . 0.0 OUTLIER -56.56 -38.09 71.45 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.648 0.261 . . . . 0.0 111.465 -179.359 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' B' B ' 314' ' ' ILE . . . . . 0.419 HG13 ' O ' ' B' ' 310' ' ' TYR . 11.0 mt -78.08 -31.14 16.4 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.22 0 N-CA-C 111.958 0.355 . . . . 0.0 111.958 -179.409 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 315' ' ' LYS . . . . . 0.406 ' HE3' ' HB3' ' B' ' 315' ' ' LYS . 1.4 tmmt? -70.54 -34.92 72.81 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.61 0.243 . . . . 0.0 111.281 -179.983 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 316' ' ' ASN . . . . . . . . . . . . . 61.5 t30 -86.01 -38.55 17.78 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.478 -0.328 . . . . 0.0 111.746 -179.087 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 317' ' ' ARG . . . . . . . . . . . . . 32.6 tpt180 -75.58 -44.13 44.71 Favored 'General case' 0 C--N 1.327 -0.374 0 N-CA-C 111.733 0.272 . . . . 0.0 111.733 -179.29 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 318' ' ' PHE . . . . . . . . . . . . . 62.9 m-85 -98.0 34.63 1.88 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.537 -0.302 . . . . 0.0 111.394 -179.455 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 319' ' ' GLN . . . . . . . . . . . . . 3.8 pt20 -67.97 -9.13 42.97 Favored 'General case' 0 N--CA 1.447 -0.602 0 CA-C-N 116.443 -0.344 . . . . 0.0 111.068 179.658 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 320' ' ' GLY . . . . . . . . . . . . . . . -96.05 -19.11 29.56 Favored Glycine 0 N--CA 1.451 -0.347 0 C-N-CA 120.845 -0.693 . . . . 0.0 112.711 -179.857 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 321' ' ' GLN . . . . . . . . . . . . . 58.9 mt-30 -108.07 92.27 9.1 Favored Pre-proline 0 C--N 1.33 -0.274 0 CA-C-O 120.473 0.178 . . . . 0.0 111.139 179.935 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 322' ' ' PRO . . . . . . . . . . . . . 93.0 Cg_endo -79.03 -23.57 7.67 Favored 'Trans proline' 0 C--N 1.349 0.601 0 C-N-CA 122.502 2.135 . . . . 0.0 112.355 179.75 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 323' ' ' ASP . . . . . . . . . . . . . 10.0 m-20 -69.36 -52.69 24.67 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.824 179.949 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 324' ' ' ILE . . . . . . . . . . . . . 64.4 mt -69.12 -42.54 81.85 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.98 179.929 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 325' ' ' TYR . . . . . . . . . . . . . 40.3 t80 -58.21 -57.17 14.03 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.697 179.874 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 326' ' ' LYS . . . . . 0.457 ' O ' ' HG2' ' B' ' 330' ' ' GLU . 28.6 mtpp -57.84 -46.8 84.22 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.938 179.789 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 327' ' ' ALA . . . . . . . . . . . . . . . -48.19 -54.14 14.51 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 116.308 -0.405 . . . . 0.0 111.193 -179.916 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 328' ' ' PHE . . . . . . . . . . . . . 84.0 t80 -56.12 -47.29 78.41 Favored 'General case' 0 C--O 1.237 0.405 0 CA-C-O 121.14 0.495 . . . . 0.0 109.903 179.283 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 329' ' ' LEU . . . . . . . . . . . . . 91.7 mt -61.36 -26.19 67.66 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.614 -0.721 . . . . 0.0 110.636 179.496 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 330' ' ' GLU . . . . . 0.457 ' HG2' ' O ' ' B' ' 326' ' ' LYS . 16.1 mm-40 -75.63 -32.89 60.42 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.151 -0.477 . . . . 0.0 109.983 179.454 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 331' ' ' ILE . . . . . . . . . . . . . 74.4 mt -67.22 -47.53 81.2 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.191 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.343 179.063 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 332' ' ' LEU . . . . . 0.442 ' HB3' HG23 ' A' ' 369' ' ' VAL . 9.3 mp -69.21 -35.87 76.66 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.755 179.426 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 333' ' ' HIS . . . . . . . . . . . . . 17.0 t-80 -64.05 -52.94 57.03 Favored 'General case' 0 C--O 1.232 0.182 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.37 179.608 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 334' ' ' THR . . . . . . . . . . . . . 84.4 m -60.44 -36.78 79.02 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.036 -0.529 . . . . 0.0 109.838 179.094 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 335' ' ' TYR . . . . . . . . . . . . . 50.9 t80 -61.36 -37.1 82.13 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.516 -0.765 . . . . 0.0 109.933 179.249 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 336' ' ' GLN . . . . . . . . . . . . . 9.8 tt0 -66.01 -51.6 56.87 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 115.798 -0.637 . . . . 0.0 110.492 179.315 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 337' ' ' LYS . . . . . . . . . . . . . 27.1 ttpp -55.36 -39.21 69.8 Favored 'General case' 0 C--O 1.233 0.195 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.936 179.853 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 338' ' ' GLU . . . . . . . . . . . . . 15.6 mm-40 -66.47 -42.29 87.75 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.94 179.881 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 339' ' ' GLN . . . . . . . . . . . . . 74.0 mt-30 -61.45 -42.4 98.71 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.323 -0.398 . . . . 0.0 110.957 179.608 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 340' ' ' ARG . . . . . . . . . . . . . 73.6 mtp180 -62.39 -55.27 29.52 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.901 -179.875 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 341' ' ' ASN . . . . . . . . . . . . . 82.7 m-20 -57.17 -35.01 69.04 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.874 179.912 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 342' ' ' ALA . . . . . . . . . . . . . . . -66.31 -43.24 86.79 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.061 -0.518 . . . . 0.0 111.102 179.92 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 343' ' ' LYS . . . . . . . . . . . . . 14.4 tmtt? -65.03 -46.64 80.44 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.634 -179.979 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 344' ' ' GLU . . . . . . . . . . . . . 12.5 mm-40 -63.98 -32.44 73.98 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.886 -179.999 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 345' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.33 -0.265 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.029 179.938 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' B' B ' 351' ' ' PRO . . . . . . . . . . . . . 54.7 Cg_exo . . . . . 0 C--O 1.231 0.152 0 CA-C-O 120.758 0.232 . . . . 0.0 112.497 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' B' B ' 352' ' ' ALA . . . . . . . . . . . . . . . -61.04 -59.43 5.38 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.028 179.936 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 353' ' ' LEU . . . . . 0.414 ' HG ' ' HG2' ' B' ' 357' ' ' GLU . 5.9 mp -89.88 117.6 28.82 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.856 0.36 . . . . 0.0 111.137 179.921 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 354' ' ' THR . . . . . . . . . . . . . 73.1 p -110.62 -171.19 1.78 Allowed 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.088 -0.506 . . . . 0.0 110.551 179.427 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 355' ' ' GLU . . . . . . . . . . . . . 34.8 mt-10 -54.9 -42.55 72.29 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 121.065 0.46 . . . . 0.0 110.406 179.671 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 356' ' ' GLN . . . . . . . . . . . . . 96.5 mt-30 -67.2 -35.86 80.5 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.667 -0.697 . . . . 0.0 111.054 -179.936 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 357' ' ' GLU . . . . . 0.414 ' HG2' ' HG ' ' B' ' 353' ' ' LEU . 5.7 tp10 -62.41 -53.85 48.95 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.528 -0.306 . . . . 0.0 110.877 -179.703 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 358' ' ' VAL . . . . . 0.431 ' O ' HG22 ' B' ' 362' ' ' VAL . 72.6 t -59.83 -57.03 13.49 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.413 -0.358 . . . . 0.0 111.042 179.984 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 359' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -51.85 -35.19 43.9 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.806 0.336 . . . . 0.0 110.932 -179.527 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 360' ' ' ALA . . . . . . . . . . . . . . . -68.38 -59.21 3.34 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.501 -0.318 . . . . 0.0 111.451 -179.904 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 361' ' ' GLN . . . . . . . . . . . . . 13.3 mm100 -53.66 -42.68 68.11 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.993 -179.991 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 362' ' ' VAL . . . . . 0.431 HG22 ' O ' ' B' ' 358' ' ' VAL . 49.0 t -68.96 -37.66 77.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.732 179.82 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 363' ' ' ALA . . . . . 0.608 ' HA ' HD11 ' B' ' 373' ' ' LEU . . . -59.62 -38.25 80.82 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.736 179.687 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 364' ' ' ARG . . . . . . . . . . . . . 77.6 ttt180 -90.33 -18.79 24.92 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.826 -0.624 . . . . 0.0 110.723 179.964 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 365' ' ' LEU . . . . . . . . . . . . . 25.2 tp -55.7 -30.82 61.77 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.531 179.749 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 366' ' ' PHE . . . . . . . . . . . . . 69.3 m-85 -112.63 159.89 18.43 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.31 179.724 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 367' ' ' LYS . . . . . . . . . . . . . 34.5 mmtp -89.34 -75.67 0.43 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.407 -0.36 . . . . 0.0 111.551 -179.31 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 368' ' ' ASN . . . . . . . . . . . . . 29.4 m-80 -115.48 14.95 16.74 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.406 -0.361 . . . . 0.0 111.136 -179.59 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 369' ' ' GLN . . . . . . . . . . . . . 70.9 mt-30 -89.61 90.3 8.19 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.891 179.989 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 370' ' ' GLU . . . . . . . . . . . . . 34.3 mt-10 -91.8 -11.44 36.59 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.755 179.986 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 371' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -58.4 -57.58 12.27 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.83 179.947 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 372' ' ' LEU . . . . . . . . . . . . . 23.1 mt -61.74 -38.59 88.51 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.491 179.75 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 373' ' ' LEU . . . . . 0.608 HD11 ' HA ' ' B' ' 363' ' ' ALA . 1.0 OUTLIER -56.71 -38.93 73.02 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.567 179.866 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' B' B ' 374' ' ' SER . . . . . . . . . . . . . 70.8 m -73.25 -44.87 58.64 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.046 -0.524 . . . . 0.0 110.296 179.417 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 375' ' ' GLU . . . . . . . . . . . . . 28.1 mm-40 -56.76 -34.34 67.49 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.347 179.437 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 376' ' ' PHE . . . . . . . . . . . . . 66.8 t80 -82.58 -30.12 29.8 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.878 -0.601 . . . . 0.0 109.854 179.266 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 377' ' ' GLY . . . . . . . . . . . . . . . -64.59 -31.37 80.67 Favored Glycine 0 N--CA 1.45 -0.389 0 C-N-CA 120.837 -0.697 . . . . 0.0 111.909 179.326 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 378' ' ' GLN . . . . . . . . . . . . . 30.1 mm-40 -56.8 -26.76 58.58 Favored 'General case' 0 C--N 1.333 -0.139 0 CA-C-O 120.953 0.406 . . . . 0.0 110.477 179.553 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 379' ' ' PHE . . . . . 0.414 ' HB3' ' H ' ' B' ' 380' ' ' LEU . 63.6 m-85 -73.12 -148.19 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.627 179.527 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 380' ' ' LEU . . . . . 0.492 ' H ' ' HG2' ' A' ' 373' ' ' MET . 32.7 mt 66.81 131.13 0.03 OUTLIER Pre-proline 0 CA--C 1.531 0.226 0 CA-C-N 116.482 -0.326 . . . . 0.0 110.789 179.991 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 381' ' ' PRO . . . . . 0.553 ' HG3' ' HB3' ' A' ' 376' ' ' GLN . 62.8 Cg_exo . . . . . 0 C--N 1.349 0.582 0 C-N-CA 122.28 1.986 . . . . 0.0 112.486 179.989 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 366' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.231 0.114 0 CA-C-O 120.853 0.359 . . . . 0.0 111.09 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 367' ' ' VAL . . . . . . . . . . . . . 39.9 t -73.22 -31.39 34.21 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.051 -179.995 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 368' ' ' TYR . . . . . . . . . . . . . 49.1 t80 -70.42 -42.77 71.17 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.932 -179.885 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 369' ' ' VAL . . . . . . . . . . . . . 5.7 p -70.56 -46.88 68.05 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.216 0 CA-C-N 116.242 -0.436 . . . . 0.0 111.157 -179.923 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 370' ' ' LEU . . . . . 0.459 HD13 ' HA ' ' B' ' 307' ' ' ALA . 89.8 mt -60.18 -43.85 95.53 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.816 0.341 . . . . 0.0 110.868 179.808 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 371' ' ' SER . . . . . . . . . . . . . 45.2 t -62.01 -57.28 12.25 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.967 179.89 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 372' ' ' SER . . . . . . . . . . . . . 47.3 t -51.59 -50.85 59.36 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.224 -179.77 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 373' ' ' MET . . . . . . . . . . . . . 94.2 mtp -54.18 -45.54 72.14 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.353 -179.768 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 374' ' ' ALA . . . . . . . . . . . . . . . -79.81 -9.81 59.71 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.583 -0.28 . . . . 0.0 111.635 -179.832 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 375' ' ' ARG . . . . . . . . . . . . . 22.3 mmm180 -100.68 -12.13 19.41 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.558 -0.292 . . . . 0.0 111.363 179.871 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 376' ' ' GLN . . . . . 0.537 ' HB2' ' HG3' ' B' ' 381' ' ' PRO . 18.1 mm-40 . . . . . 0 C--N 1.329 -0.322 0 CA-C-N 116.511 -0.313 . . . . 0.0 111.084 179.952 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 302' ' ' VAL . . . . . . . . . . . . . 10.3 p . . . . . 0 C--O 1.231 0.127 0 CA-C-O 120.787 0.327 . . . . 0.0 111.147 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' B' B ' 303' ' ' GLU . . . . . . . . . . . . . 27.7 mt-10 -52.12 -74.08 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.859 -0.609 . . . . 0.0 112.016 -179.407 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 304' ' ' PHE . . . . . . . . . . . . . 90.3 m-85 -50.07 -66.52 0.38 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.968 -0.56 . . . . 0.0 112.291 -178.96 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 305' ' ' ASN . . . . . . . . . . . . . 16.8 m120 -41.77 -61.91 1.01 Allowed 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 112.798 0.666 . . . . 0.0 112.798 -178.704 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 306' ' ' HIS . . . . . . . . . . . . . 11.2 m170 -60.46 -67.52 0.39 Allowed 'General case' 0 C--N 1.33 -0.246 0 N-CA-C 112.703 0.631 . . . . 0.0 112.703 -178.519 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 307' ' ' ALA . . . . . 0.459 ' HA ' HD13 ' A' ' 370' ' ' LEU . . . -48.64 -58.11 5.23 Favored 'General case' 0 C--N 1.33 -0.27 0 N-CA-C 112.388 0.514 . . . . 0.0 112.388 -178.542 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 308' ' ' ILE . . . . . . . . . . . . . 42.8 mm -53.37 -60.0 1.51 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 N-CA-C 112.001 0.371 . . . . 0.0 112.001 -179.247 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 309' ' ' ASN . . . . . . . . . . . . . 14.0 m120 -57.82 -25.02 60.05 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 120.594 0.235 . . . . 0.0 111.615 -179.298 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 310' ' ' TYR . . . . . . . . . . . . . 36.3 t80 -69.87 -56.27 7.53 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.506 -0.315 . . . . 0.0 111.128 -179.541 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 311' ' ' VAL . . . . . . . . . . . . . 40.7 t -59.29 -44.05 91.33 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.719 179.976 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 312' ' ' ASN . . . . . . . . . . . . . 7.2 t30 -62.01 -39.94 93.98 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.925 179.914 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 313' ' ' LYS . . . . . . . . . . . . . 4.5 ttmm -60.62 -60.17 4.22 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.985 -179.924 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 314' ' ' ILE . . . . . . . . . . . . . 32.3 mt -59.48 -27.71 37.94 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.129 -179.5 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 315' ' ' LYS . . . . . 0.451 ' HB2' ' HH ' ' B' ' 325' ' ' TYR . 23.3 ttmm -70.18 -40.86 74.41 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.534 -0.303 . . . . 0.0 111.031 179.649 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 316' ' ' ASN . . . . . . . . . . . . . 60.3 t30 -88.89 -8.53 54.08 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.352 -0.386 . . . . 0.0 110.976 -179.716 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 317' ' ' ARG . . . . . . . . . . . . . 20.7 tpp180 -95.34 -61.8 1.41 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.084 -179.933 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 318' ' ' PHE . . . . . . . . . . . . . 73.6 m-85 -94.37 34.73 1.26 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.333 -179.767 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 319' ' ' GLN . . . . . . . . . . . . . 20.9 tm0? -61.62 -31.01 71.07 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.37 179.557 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 320' ' ' GLY . . . . . . . . . . . . . . . -60.33 -62.51 5.94 Favored Glycine 0 C--N 1.332 0.312 0 C-N-CA 120.986 -0.626 . . . . 0.0 112.704 -179.858 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 321' ' ' GLN . . . . . . . . . . . . . 15.0 mm100 -79.36 111.75 23.08 Favored Pre-proline 0 CA--C 1.531 0.22 0 CA-C-N 116.513 0.157 . . . . 0.0 110.989 -179.865 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 322' ' ' PRO . . . . . . . . . . . . . 97.1 Cg_endo -83.96 -22.81 3.36 Favored 'Trans proline' 0 C--N 1.349 0.582 0 C-N-CA 122.547 2.165 . . . . 0.0 112.619 179.989 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 323' ' ' ASP . . . . . . . . . . . . . 6.7 m-20 -70.12 -49.06 54.5 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.268 -0.423 . . . . 0.0 111.155 -179.725 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 324' ' ' ILE . . . . . . . . . . . . . 51.5 mt -64.7 -47.58 88.2 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.205 -179.825 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 325' ' ' TYR . . . . . 0.451 ' HH ' ' HB2' ' B' ' 315' ' ' LYS . 23.5 t80 -60.09 -52.4 65.52 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.078 -179.767 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 326' ' ' LYS . . . . . 0.409 ' O ' ' HG3' ' B' ' 330' ' ' GLU . 87.8 tttt -59.36 -36.24 75.38 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.726 179.879 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 327' ' ' ALA . . . . . . . . . . . . . . . -59.9 -52.81 63.82 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.722 179.644 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 328' ' ' PHE . . . . . . . . . . . . . 81.2 t80 -55.51 -49.58 72.21 Favored 'General case' 0 C--O 1.236 0.346 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.74 179.818 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 329' ' ' LEU . . . . . . . . . . . . . 89.4 mt -57.54 -38.47 74.77 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.931 -0.577 . . . . 0.0 111.023 179.89 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 330' ' ' GLU . . . . . 0.409 ' HG3' ' O ' ' B' ' 326' ' ' LYS . 44.7 mt-10 -67.08 -35.35 79.62 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.361 -0.381 . . . . 0.0 111.086 -179.845 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 331' ' ' ILE . . . . . . . . . . . . . 94.4 mt -64.67 -50.91 73.45 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-O 120.855 0.359 . . . . 0.0 110.442 179.348 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 332' ' ' LEU . . . . . . . . . . . . . 4.8 mp -65.97 -31.64 72.67 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.769 179.709 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 333' ' ' HIS . . . . . . . . . . . . . 52.9 t-80 -64.28 -58.06 7.63 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.025 179.34 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 334' ' ' THR . . . . . . . . . . . . . 96.7 m -58.22 -32.44 68.3 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.78 -0.645 . . . . 0.0 110.232 179.139 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 335' ' ' TYR . . . . . . . . . . . . . 74.9 t80 -63.04 -44.43 95.9 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 115.701 -0.681 . . . . 0.0 110.062 179.239 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 336' ' ' GLN . . . . . . . . . . . . . 54.0 tt0 -63.35 -39.47 94.63 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.739 -0.664 . . . . 0.0 110.33 179.488 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 337' ' ' LYS . . . . . . . . . . . . . 14.6 tppt? -58.68 -59.5 5.3 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.929 179.544 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 338' ' ' GLU . . . . . . . . . . . . . 13.6 mm-40 -60.67 -31.08 70.34 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.969 -0.56 . . . . 0.0 111.086 -179.819 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 339' ' ' GLN . . . . . . . . . . . . . 53.5 tt0 -64.47 -45.64 86.51 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.896 0.379 . . . . 0.0 110.793 179.895 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 340' ' ' ARG . . . . . . . . . . . . . 65.7 mtt180 -65.42 -51.61 59.04 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.003 -0.544 . . . . 0.0 111.049 -179.979 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 341' ' ' ASN . . . . . . . . . . . . . 25.8 t-20 -56.43 -39.0 72.36 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.11 -0.496 . . . . 0.0 111.032 -179.8 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 342' ' ' ALA . . . . . . . . . . . . . . . -69.62 -38.64 77.32 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.297 -0.41 . . . . 0.0 111.146 -179.905 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 343' ' ' LYS . . . . . . . . . . . . . 62.8 tttm -65.02 -43.63 91.82 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.262 -0.427 . . . . 0.0 110.888 -179.997 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 344' ' ' GLU . . . . . . . . . . . . . 18.3 mm-40 -70.02 -35.92 74.7 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.041 -179.963 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 345' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.328 -0.336 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.188 -179.893 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' B' B ' 351' ' ' PRO . . . . . . . . . . . . . 48.8 Cg_exo . . . . . 0 C--O 1.231 0.165 0 CA-C-O 120.797 0.249 . . . . 0.0 112.284 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' B' B ' 352' ' ' ALA . . . . . . . . . . . . . . . -86.82 -43.11 12.74 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.177 179.978 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 353' ' ' LEU . . . . . 0.401 ' HG ' ' HG2' ' B' ' 357' ' ' GLU . 6.6 mp -115.64 125.78 53.32 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.954 0.407 . . . . 0.0 111.182 -179.99 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 354' ' ' THR . . . . . . . . . . . . . 74.0 p -114.19 -170.23 1.68 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.509 179.329 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 355' ' ' GLU . . . . . . . . . . . . . 2.8 mp0 -59.81 -33.69 72.07 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.926 0.393 . . . . 0.0 110.511 179.744 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 356' ' ' GLN . . . . . . . . . . . . . 95.8 mt-30 -74.21 -43.93 55.21 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.006 -0.543 . . . . 0.0 111.331 -179.796 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 357' ' ' GLU . . . . . 0.401 ' HG2' ' HG ' ' B' ' 353' ' ' LEU . 6.2 tp10 -57.23 -48.95 77.53 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 120.992 0.425 . . . . 0.0 110.552 -179.981 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 358' ' ' VAL . . . . . . . . . . . . . 73.7 t -64.43 -58.41 7.34 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 115.853 -0.612 . . . . 0.0 111.277 -179.941 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 359' ' ' TYR . . . . . . . . . . . . . 50.1 t80 -53.93 -26.62 26.24 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.598 -0.274 . . . . 0.0 111.159 -179.48 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 360' ' ' ALA . . . . . . . . . . . . . . . -72.48 -60.36 2.27 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.773 0.321 . . . . 0.0 111.147 179.855 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 361' ' ' GLN . . . . . . . . . . . . . 72.7 mt-30 -57.3 -39.44 75.77 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.922 179.886 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 362' ' ' VAL . . . . . . . . . . . . . 58.1 t -68.39 -38.59 79.58 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.638 179.637 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 363' ' ' ALA . . . . . 0.494 ' HA ' HD13 ' B' ' 373' ' ' LEU . . . -59.21 -43.76 92.29 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.457 179.43 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 364' ' ' ARG . . . . . . . . . . . . . 41.8 ttm180 -79.99 -21.62 43.43 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.859 -0.61 . . . . 0.0 110.484 179.742 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 365' ' ' LEU . . . . . . . . . . . . . 7.5 tp -58.73 -25.9 63.41 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.44 179.657 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 366' ' ' PHE . . . . . . . . . . . . . 47.2 m-85 -129.05 169.12 15.11 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.757 -0.656 . . . . 0.0 110.38 179.818 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 367' ' ' LYS . . . . . . . . . . . . . 55.9 mtmt -132.2 -79.58 0.5 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.786 0.327 . . . . 0.0 111.131 179.974 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 368' ' ' ASN . . . . . . . . . . . . . 22.3 t-20 -73.5 -12.44 60.78 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.827 -179.859 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 369' ' ' GLN . . . . . . . . . . . . . 26.8 mm-40 -96.54 84.12 3.62 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.104 -179.941 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 370' ' ' GLU . . . . . . . . . . . . . 17.4 mm-40 -94.13 -8.9 38.19 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.67 179.438 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 371' ' ' ASP . . . . . . . . . . . . . 7.4 m-20 -57.64 -63.65 1.17 Allowed 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.911 -179.984 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 372' ' ' LEU . . . . . 0.464 HD11 ' H ' ' B' ' 373' ' ' LEU . 0.4 OUTLIER -57.87 -23.14 51.72 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.994 179.872 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' B' B ' 373' ' ' LEU . . . . . 0.494 HD13 ' HA ' ' B' ' 363' ' ' ALA . 4.6 tp -72.69 -39.91 66.66 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.253 179.869 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 374' ' ' SER . . . . . . . . . . . . . 47.4 t -69.16 -51.79 34.6 Favored 'General case' 0 C--O 1.235 0.315 0 CA-C-N 116.025 -0.534 . . . . 0.0 109.916 179.058 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 375' ' ' GLU . . . . . . . . . . . . . 43.0 mt-10 -53.23 -43.61 67.44 Favored 'General case' 0 N--CA 1.455 -0.221 0 CA-C-N 115.791 -0.64 . . . . 0.0 109.698 178.915 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 376' ' ' PHE . . . . . . . . . . . . . 70.9 t80 -62.81 -39.63 94.9 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 115.714 -0.675 . . . . 0.0 110.043 179.172 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 377' ' ' GLY . . . . . . . . . . . . . . . -58.83 -34.9 79.91 Favored Glycine 0 N--CA 1.449 -0.498 0 C-N-CA 120.735 -0.745 . . . . 0.0 111.724 179.32 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 378' ' ' GLN . . . . . . . . . . . . . 55.8 mt-30 -62.99 -30.92 71.97 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.654 0.264 . . . . 0.0 110.962 179.534 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 379' ' ' PHE . . . . . . . . . . . . . 50.2 m-85 -61.45 -35.34 77.32 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.354 -0.384 . . . . 0.0 110.74 179.715 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 380' ' ' LEU . . . . . . . . . . . . . 89.4 mt -56.07 138.25 72.92 Favored Pre-proline 0 C--N 1.329 -0.289 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.864 179.884 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 381' ' ' PRO . . . . . 0.537 ' HG3' ' HB2' ' A' ' 376' ' ' GLN . 72.3 Cg_exo . . . . . 0 C--N 1.347 0.473 0 C-N-CA 122.447 2.098 . . . . 0.0 112.309 179.953 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 366' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.232 0.147 0 CA-C-O 120.861 0.362 . . . . 0.0 110.89 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 367' ' ' VAL . . . . . . . . . . . . . 26.9 m -51.22 -21.42 1.5 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.209 0 CA-C-N 115.974 -0.557 . . . . 0.0 111.732 -179.871 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 368' ' ' TYR . . . . . . . . . . . . . 45.7 m-85 -65.19 -61.08 2.35 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.58 -0.282 . . . . 0.0 110.836 179.758 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 369' ' ' VAL . . . . . 0.57 HG12 HD21 ' A' ' 370' ' ' LEU . 2.9 p -64.25 -43.63 97.27 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.204 0 CA-C-N 116.551 -0.295 . . . . 0.0 111.541 -179.882 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 370' ' ' LEU . . . . . 0.57 HD21 HG12 ' A' ' 369' ' ' VAL . 4.2 mm? -57.9 -59.59 5.01 Favored 'General case' 0 C--O 1.235 0.295 0 CA-C-O 120.936 0.398 . . . . 0.0 111.254 -179.955 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 371' ' ' SER . . . . . . . . . . . . . 55.2 m -59.84 -32.33 70.57 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.041 -179.844 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 372' ' ' SER . . . . . . . . . . . . . 47.8 t -59.51 -50.08 75.3 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.849 0.357 . . . . 0.0 110.972 179.904 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 373' ' ' MET . . . . . . . . . . . . . 83.8 mtp -67.1 -34.64 78.07 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.48 -179.749 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 374' ' ' ALA . . . . . . . . . . . . . . . -83.66 -12.69 55.61 Favored 'General case' 0 C--N 1.33 -0.267 0 N-CA-C 112.161 0.43 . . . . 0.0 112.161 -179.239 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 375' ' ' ARG . . . . . . . . . . . . . 27.4 tpt180 -108.74 -13.05 14.85 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.75 0.309 . . . . 0.0 111.059 -179.757 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 376' ' ' GLN . . . . . 0.52 ' HB3' ' HG3' ' B' ' 381' ' ' PRO . 34.2 tt0 . . . . . 0 C--N 1.331 -0.215 0 CA-C-O 121.002 0.43 . . . . 0.0 110.573 179.764 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 302' ' ' VAL . . . . . . . . . . . . . 12.8 p . . . . . 0 CA--C 1.528 0.134 0 CA-C-O 120.699 0.285 . . . . 0.0 111.689 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' B' B ' 303' ' ' GLU . . . . . . . . . . . . . 44.2 mt-10 -56.8 -87.35 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.404 -0.362 . . . . 0.0 111.638 -179.461 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 304' ' ' PHE . . . . . . . . . . . . . 42.6 p90 -65.61 -21.12 66.55 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.319 -0.401 . . . . 0.0 111.722 -179.176 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 305' ' ' ASN . . . . . . . . . . . . . 6.2 t30 -68.37 -64.68 0.82 Allowed 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.777 0.322 . . . . 0.0 111.032 -179.744 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 306' ' ' HIS . . . . . . . . . . . . . 18.8 t-160 -64.74 -34.44 78.32 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.3 -179.435 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 307' ' ' ALA . . . . . . . . . . . . . . . -64.43 -59.54 4.22 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.497 -0.32 . . . . 0.0 111.456 -179.736 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 308' ' ' ILE . . . . . . . . . . . . . 94.5 mt -56.98 -49.51 79.07 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 CA-C-N 116.53 -0.305 . . . . 0.0 111.406 -179.796 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 309' ' ' ASN . . . . . . . . . . . . . 3.6 m-20 -55.55 -40.93 72.54 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.809 0.338 . . . . 0.0 110.812 179.832 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 310' ' ' TYR . . . . . 0.428 ' O ' HG12 ' B' ' 314' ' ' ILE . 84.1 t80 -62.5 -64.24 0.98 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.902 -179.99 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 311' ' ' VAL . . . . . . . . . . . . . 55.4 t -52.84 -24.03 6.29 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.221 0 CA-C-O 120.873 0.368 . . . . 0.0 110.894 179.986 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 312' ' ' ASN . . . . . . . . . . . . . 44.2 t30 -69.89 -56.82 6.05 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.066 179.855 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 313' ' ' LYS . . . . . 0.432 ' HD3' ' N ' ' B' ' 314' ' ' ILE . 0.0 OUTLIER -66.28 -23.55 66.41 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-O 120.775 0.322 . . . . 0.0 111.152 -179.907 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' B' B ' 314' ' ' ILE . . . . . 0.432 ' N ' ' HD3' ' B' ' 313' ' ' LYS . 31.2 mm -74.65 -43.55 47.57 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 116.392 -0.367 . . . . 0.0 110.754 179.805 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 315' ' ' LYS . . . . . . . . . . . . . 25.5 ttpp -73.42 -27.64 61.55 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.785 179.84 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 316' ' ' ASN . . . . . . . . . . . . . 30.6 t30 -74.32 -50.48 18.61 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.958 179.885 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 317' ' ' ARG . . . . . . . . . . . . . 27.3 mmm180 -61.64 -53.64 53.49 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.142 179.979 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 318' ' ' PHE . . . . . . . . . . . . . 75.6 m-85 -90.77 31.62 1.05 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.082 -179.847 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 319' ' ' GLN . . . . . . . . . . . . . 35.3 tt0 -61.91 -25.64 67.69 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.851 179.936 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 320' ' ' GLY . . . . . . . . . . . . . . . -94.48 -18.38 35.93 Favored Glycine 0 N--CA 1.451 -0.361 0 C-N-CA 120.858 -0.687 . . . . 0.0 112.455 179.971 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 321' ' ' GLN . . . . . . . . . . . . . 8.7 tp-100 -109.83 91.47 10.8 Favored Pre-proline 0 C--N 1.33 -0.273 0 CA-C-O 120.437 0.16 . . . . 0.0 110.731 179.947 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 322' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_endo -76.26 -12.73 19.07 Favored 'Trans proline' 0 C--N 1.348 0.515 0 C-N-CA 122.552 2.168 . . . . 0.0 112.548 -179.891 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 323' ' ' ASP . . . . . . . . . . . . . 20.2 t70 -70.82 -56.32 6.58 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.19 -179.854 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 324' ' ' ILE . . . . . . . . . . . . . 62.1 mt -62.44 -40.63 88.79 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.222 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.096 -179.868 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 325' ' ' TYR . . . . . . . . . . . . . 35.0 t80 -63.22 -48.64 77.42 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.589 179.767 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 326' ' ' LYS . . . . . 0.4 ' O ' ' HG3' ' B' ' 330' ' ' GLU . 41.0 ttmt -60.55 -37.3 80.79 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.706 179.887 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 327' ' ' ALA . . . . . . . . . . . . . . . -62.1 -54.48 40.69 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.133 179.941 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 328' ' ' PHE . . . . . . . . . . . . . 62.7 t80 -53.62 -45.55 70.14 Favored 'General case' 0 C--O 1.234 0.275 0 CA-C-O 121.008 0.432 . . . . 0.0 110.501 179.899 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 329' ' ' LEU . . . . . . . . . . . . . 92.1 mt -59.21 -43.34 92.3 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.868 -0.606 . . . . 0.0 110.645 179.56 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 330' ' ' GLU . . . . . 0.4 ' HG3' ' O ' ' B' ' 326' ' ' LYS . 40.6 mt-10 -59.64 -37.79 79.65 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.763 179.713 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 331' ' ' ILE . . . . . . . . . . . . . 76.1 mt -63.47 -56.6 16.08 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.806 179.728 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 332' ' ' LEU . . . . . 0.426 HD21 HD21 ' A' ' 370' ' ' LEU . 7.3 mp -66.28 -19.19 65.75 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.257 -179.984 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 333' ' ' HIS . . . . . . . . . . . . . 34.6 t-80 -71.61 -59.52 2.71 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 121.031 0.443 . . . . 0.0 110.09 179.284 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 334' ' ' THR . . . . . . . . . . . . . 88.7 m -62.41 -29.77 70.74 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.049 179.21 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 335' ' ' TYR . . . . . . . . . . . . . 69.8 t80 -69.14 -41.55 77.18 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 115.729 -0.669 . . . . 0.0 110.488 179.461 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 336' ' ' GLN . . . . . 0.429 ' HB2' ' HB ' ' A' ' 369' ' ' VAL . 26.3 tt0 -68.23 -33.38 74.3 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.693 -179.993 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 337' ' ' LYS . . . . . 0.523 ' O ' ' HG2' ' B' ' 340' ' ' ARG . 1.0 OUTLIER -72.96 -47.95 40.99 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.885 -179.976 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' B' B ' 338' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -65.78 -28.27 68.89 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.034 0.445 . . . . 0.0 109.873 179.434 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 339' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -73.83 -49.39 25.4 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 115.716 -0.675 . . . . 0.0 110.497 179.407 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 340' ' ' ARG . . . . . 0.558 ' HG3' ' N ' ' B' ' 341' ' ' ASN . 14.9 ptm180 -56.46 -51.83 66.97 Favored 'General case' 0 C--N 1.333 -0.138 0 CA-C-O 121.078 0.466 . . . . 0.0 110.742 -179.838 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 341' ' ' ASN . . . . . 0.558 ' N ' ' HG3' ' B' ' 340' ' ' ARG . 2.3 t-20 -58.72 -47.66 83.82 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.62 -0.718 . . . . 0.0 110.732 179.387 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 342' ' ' ALA . . . . . . . . . . . . . . . -63.79 -23.08 67.22 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.022 179.788 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 343' ' ' LYS . . . . . . . . . . . . . 88.0 tttt -78.77 -39.06 37.04 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.799 179.924 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 344' ' ' GLU . . . . . . . . . . . . . 7.0 mm-40 -75.64 -26.97 58.19 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.831 179.829 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 345' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.328 -0.331 0 CA-C-N 116.042 -0.526 . . . . 0.0 111.029 -179.905 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' B' B ' 351' ' ' PRO . . . . . . . . . . . . . 34.9 Cg_exo . . . . . 0 C--O 1.232 0.22 0 CA-C-O 120.866 0.277 . . . . 0.0 112.638 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' B' B ' 352' ' ' ALA . . . . . . . . . . . . . . . -98.27 -73.57 0.61 Allowed 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.453 -179.751 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 353' ' ' LEU . . . . . 0.522 HD21 ' HG2' ' B' ' 357' ' ' GLU . 40.6 mt -99.25 133.32 43.71 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.934 0.397 . . . . 0.0 111.15 -179.778 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 354' ' ' THR . . . . . . . . . . . . . 57.6 p -104.08 -178.31 3.62 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.791 179.842 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 355' ' ' GLU . . . . . . . . . . . . . 41.4 mt-10 -60.65 -39.53 88.67 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.833 0.349 . . . . 0.0 110.786 179.914 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 356' ' ' GLN . . . . . . . . . . . . . 29.1 mm-40 -70.57 -38.82 74.14 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.0 -179.961 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 357' ' ' GLU . . . . . 0.522 ' HG2' HD21 ' B' ' 353' ' ' LEU . 9.6 tp10 -61.55 -49.37 76.94 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.41 -0.359 . . . . 0.0 110.55 179.999 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 358' ' ' VAL . . . . . . . . . . . . . 53.3 t -61.42 -56.67 16.29 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.94 179.688 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 359' ' ' TYR . . . . . . . . . . . . . 2.8 t80 -53.96 -30.36 46.47 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.445 -0.343 . . . . 0.0 110.788 -179.802 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 360' ' ' ALA . . . . . . . . . . . . . . . -66.92 -60.42 2.66 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.165 179.821 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 361' ' ' GLN . . . . . . . . . . . . . 47.0 mt-30 -57.46 -39.01 75.41 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.477 179.865 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 362' ' ' VAL . . . . . . . . . . . . . 94.2 t -66.53 -33.72 65.34 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.198 179.298 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 363' ' ' ALA . . . . . 0.482 ' HA ' HD21 ' B' ' 373' ' ' LEU . . . -63.85 -43.1 97.16 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.174 179.264 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 364' ' ' ARG . . . . . . . . . . . . . 9.6 mpt_? -80.06 -17.45 52.66 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.811 -0.631 . . . . 0.0 110.161 178.896 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 365' ' ' LEU . . . . . . . . . . . . . 14.1 tp -68.78 -40.76 79.51 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.787 -0.642 . . . . 0.0 111.226 -179.917 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 366' ' ' PHE . . . . . 0.648 ' HB3' ' HB2' ' B' ' 369' ' ' GLN . 32.8 m-85 -106.4 -29.84 9.49 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.438 -0.346 . . . . 0.0 111.393 -179.522 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 367' ' ' LYS . . . . . . . . . . . . . 92.0 mttt 54.01 -96.62 0.06 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.209 -0.451 . . . . 0.0 112.19 179.892 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 368' ' ' ASN . . . . . . . . . . . . . 18.5 m120 -54.75 -46.4 74.32 Favored 'General case' 0 N--CA 1.462 0.139 0 CA-C-N 116.541 -0.299 . . . . 0.0 111.561 -179.192 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 369' ' ' GLN . . . . . 0.648 ' HB2' ' HB3' ' B' ' 366' ' ' PHE . 2.4 mp0 -66.4 97.92 0.45 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.429 -0.35 . . . . 0.0 111.035 -179.778 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 370' ' ' GLU . . . . . . . . . . . . . 43.9 tt0 -93.69 -17.8 22.82 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.97 179.907 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 371' ' ' ASP . . . . . . . . . . . . . 6.9 m-20 -54.78 -45.35 74.27 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.31 -0.404 . . . . 0.0 110.676 179.81 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 372' ' ' LEU . . . . . 0.54 HD12 ' HB3' ' B' ' 369' ' ' GLN . 6.4 mp -64.85 -41.83 95.39 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.505 179.51 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 373' ' ' LEU . . . . . 0.482 HD21 ' HA ' ' B' ' 363' ' ' ALA . 1.1 mp -61.13 -32.2 71.9 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.808 179.842 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 374' ' ' SER . . . . . . . . . . . . . 56.0 m -71.61 -52.13 19.67 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.036 179.28 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 375' ' ' GLU . . . . . . . . . . . . . 7.7 tp10 -58.05 -33.05 68.59 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 115.732 -0.667 . . . . 0.0 109.898 179.279 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 376' ' ' PHE . . . . . . . . . . . . . 54.0 t80 -79.4 -27.81 41.81 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.736 -0.665 . . . . 0.0 109.906 179.263 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 377' ' ' GLY . . . . . . . . . . . . . . . -64.29 -41.2 98.32 Favored Glycine 0 N--CA 1.448 -0.546 0 C-N-CA 120.673 -0.775 . . . . 0.0 111.317 179.076 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 378' ' ' GLN . . . . . . . . . . . . . 46.1 mt-30 -71.63 -23.44 61.69 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.915 0.388 . . . . 0.0 110.144 179.095 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 379' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -62.33 -31.8 72.48 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-N 115.813 -0.631 . . . . 0.0 110.576 179.407 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 380' ' ' LEU . . . . . . . . . . . . . 39.8 mt -61.92 147.57 89.58 Favored Pre-proline 0 C--N 1.33 -0.28 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.714 -179.964 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 381' ' ' PRO . . . . . 0.52 ' HG3' ' HB3' ' A' ' 376' ' ' GLN . 52.1 Cg_exo . . . . . 0 C--N 1.347 0.456 0 C-N-CA 122.391 2.061 . . . . 0.0 112.333 179.946 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 366' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.233 0.223 0 CA-C-O 120.775 0.321 . . . . 0.0 111.618 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 367' ' ' VAL . . . . . . . . . . . . . 35.7 m -54.88 -35.14 32.84 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.925 179.904 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 368' ' ' TYR . . . . . . . . . . . . . 68.7 m-85 -71.04 -24.24 62.31 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.487 179.531 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 369' ' ' VAL . . . . . 0.569 HG23 ' HB2' ' B' ' 336' ' ' GLN . 6.7 t -73.03 -57.73 6.37 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.195 179.383 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 370' ' ' LEU . . . . . 0.422 HD22 ' H ' ' A' ' 370' ' ' LEU . 3.2 mm? -58.56 -37.91 76.74 Favored 'General case' 0 C--O 1.233 0.201 0 CA-C-N 115.763 -0.653 . . . . 0.0 110.443 179.793 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 371' ' ' SER . . . . . 0.62 ' HA ' ' HB2' ' B' ' 303' ' ' GLU . 99.0 p -63.53 -55.87 20.5 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.901 179.928 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 372' ' ' SER . . . . . . . . . . . . . 91.4 p -54.48 -34.37 61.44 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.3 -179.806 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 373' ' ' MET . . . . . . . . . . . . . 56.6 mtt -66.69 -52.26 46.78 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.522 -179.971 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 374' ' ' ALA . . . . . 0.435 ' HB2' ' HB3' ' B' ' 303' ' ' GLU . . . -81.6 -6.74 59.29 Favored 'General case' 0 C--N 1.331 -0.236 0 N-CA-C 112.387 0.514 . . . . 0.0 112.387 -178.973 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 375' ' ' ARG . . . . . . . . . . . . . 18.7 mmt180 -94.82 -42.58 8.63 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.81 0.338 . . . . 0.0 111.164 179.88 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 376' ' ' GLN . . . . . . . . . . . . . 44.2 tt0 . . . . . 0 C--N 1.33 -0.275 0 CA-C-N 116.046 -0.524 . . . . 0.0 111.077 -179.579 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' B' B ' 302' ' ' VAL . . . . . 0.48 HG12 ' H ' ' B' ' 303' ' ' GLU . 2.7 p . . . . . 0 C--O 1.233 0.193 0 N-CA-C 111.761 0.282 . . . . 0.0 111.761 . . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 303' ' ' GLU . . . . . 0.62 ' HB2' ' HA ' ' A' ' 371' ' ' SER . 0.1 OUTLIER -62.13 -29.71 70.52 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.404 -0.362 . . . . 0.0 111.769 -179.058 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' B' B ' 304' ' ' PHE . . . . . . . . . . . . . 67.3 t80 -63.0 -71.33 0.17 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.77 0.319 . . . . 0.0 111.188 -179.648 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 305' ' ' ASN . . . . . . . . . . . . . 27.2 t-20 -53.68 -42.86 68.39 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.582 -179.413 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 306' ' ' HIS . . . . . . . . . . . . . 8.5 m-70 -62.53 -67.7 0.4 Allowed 'General case' 0 C--N 1.331 -0.22 0 N-CA-C 112.083 0.401 . . . . 0.0 112.083 -179.225 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 307' ' ' ALA . . . . . . . . . . . . . . . -49.89 -52.74 30.59 Favored 'General case' 0 N--CA 1.465 0.289 0 N-CA-C 112.331 0.493 . . . . 0.0 112.331 -178.905 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 308' ' ' ILE . . . . . . . . . . . . . 1.7 mp -54.93 -58.96 2.79 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-O 120.595 0.236 . . . . 0.0 111.439 -179.617 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 309' ' ' ASN . . . . . . . . . . . . . 14.1 m120 -61.52 -19.4 62.07 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.546 -0.297 . . . . 0.0 111.265 -179.646 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 310' ' ' TYR . . . . . . . . . . . . . 24.0 t80 -74.95 -57.28 4.0 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.416 -0.356 . . . . 0.0 111.326 -179.479 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 311' ' ' VAL . . . . . . . . . . . . . 5.8 m -63.19 -33.69 62.42 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.203 0 CA-C-O 120.87 0.367 . . . . 0.0 110.639 -179.818 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 312' ' ' ASN . . . . . . . . . . . . . 6.3 t30 -70.11 -42.88 72.09 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.585 179.751 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 313' ' ' LYS . . . . . . . . . . . . . 4.5 ttmm -60.23 -49.57 77.11 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.035 179.807 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 314' ' ' ILE . . . . . . . . . . . . . 75.8 mt -64.6 -39.59 86.12 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.658 -179.43 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 315' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -65.51 -40.2 92.72 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.744 0.307 . . . . 0.0 111.095 -179.714 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 316' ' ' ASN . . . . . . . . . . . . . 28.2 t-20 -68.77 -51.35 42.06 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.321 -0.399 . . . . 0.0 111.355 -179.479 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 317' ' ' ARG . . . . . 0.458 HH22 HD11 ' B' ' 372' ' ' LEU . 35.7 mtm180 -59.99 -59.08 6.0 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.384 -0.371 . . . . 0.0 111.071 -179.91 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 318' ' ' PHE . . . . . . . . . . . . . 95.1 m-85 -87.65 40.87 0.96 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.917 -179.97 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 319' ' ' GLN . . . . . . . . . . . . . 63.3 tt0 -59.5 -33.64 71.6 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.972 -179.875 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 320' ' ' GLY . . . . . . . . . . . . . . . -80.27 -14.32 80.53 Favored Glycine 0 N--CA 1.452 -0.256 0 C-N-CA 120.853 -0.689 . . . . 0.0 112.261 179.735 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 321' ' ' GLN . . . . . . . . . . . . . 6.1 tp-100 -118.07 83.29 19.18 Favored Pre-proline 0 C--N 1.329 -0.315 0 CA-C-O 120.528 0.204 . . . . 0.0 110.802 -179.998 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 322' ' ' PRO . . . . . . . . . . . . . 76.5 Cg_endo -77.71 -10.17 17.06 Favored 'Trans proline' 0 C--N 1.346 0.404 0 C-N-CA 122.386 2.058 . . . . 0.0 112.338 179.844 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 323' ' ' ASP . . . . . . . . . . . . . 9.5 m-20 -70.08 -52.78 21.07 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.07 -0.514 . . . . 0.0 111.191 -179.742 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 324' ' ' ILE . . . . . . . . . . . . . 71.3 mt -63.89 -46.34 94.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.425 -0.352 . . . . 0.0 111.246 -179.904 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 325' ' ' TYR . . . . . . . . . . . . . 68.8 t80 -58.15 -58.27 9.21 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.155 179.982 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 326' ' ' LYS . . . . . . . . . . . . . 39.4 ttmt -56.95 -41.47 78.35 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.121 -179.728 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 327' ' ' ALA . . . . . . . . . . . . . . . -57.02 -48.29 78.85 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.907 0.384 . . . . 0.0 111.148 -179.997 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 328' ' ' PHE . . . . . . . . . . . . . 45.7 t80 -58.56 -53.87 53.43 Favored 'General case' 0 C--O 1.237 0.435 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.664 179.931 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 329' ' ' LEU . . . . . . . . . . . . . 10.4 mp -60.82 -26.71 67.51 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.979 -179.844 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 330' ' ' GLU . . . . . . . . . . . . . 28.4 mt-10 -70.38 -42.32 71.89 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.852 0.358 . . . . 0.0 110.207 179.306 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 331' ' ' ILE . . . . . 0.494 HG23 HG23 ' B' ' 358' ' ' VAL . 93.8 mt -61.03 -48.03 90.92 Favored 'Isoleucine or valine' 0 C--O 1.233 0.224 0 CA-C-N 116.126 -0.488 . . . . 0.0 109.956 179.085 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 332' ' ' LEU . . . . . . . . . . . . . 10.8 mp -64.81 -33.66 76.52 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 115.813 -0.631 . . . . 0.0 110.512 179.427 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 333' ' ' HIS . . . . . . . . . . . . . 43.3 t60 -60.83 -54.15 48.67 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.057 -0.52 . . . . 0.0 109.956 179.297 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 334' ' ' THR . . . . . . . . . . . . . 62.8 m -61.35 -30.48 70.54 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.687 -0.688 . . . . 0.0 110.338 179.238 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 335' ' ' TYR . . . . . . . . . . . . . 67.8 t80 -60.62 -53.79 53.19 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.844 -0.617 . . . . 0.0 111.158 179.696 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 336' ' ' GLN . . . . . 0.569 ' HB2' HG23 ' A' ' 369' ' ' VAL . 6.4 tp-100 -65.89 -36.64 83.97 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.417 -0.356 . . . . 0.0 111.029 -179.928 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 337' ' ' LYS . . . . . . . . . . . . . 39.8 ttpt -57.89 -56.65 19.27 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.951 0.405 . . . . 0.0 110.995 179.9 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 338' ' ' GLU . . . . . . . . . . . . . 19.5 mm-40 -64.11 -36.25 83.42 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.037 -0.528 . . . . 0.0 111.289 -179.857 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 339' ' ' GLN . . . . . . . . . . . . . 6.5 tp-100 -61.0 -46.07 92.25 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.312 -0.403 . . . . 0.0 110.847 179.968 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 340' ' ' ARG . . . . . . . . . . . . . 96.6 mtt180 -63.87 -51.71 63.32 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.652 179.836 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 341' ' ' ASN . . . . . . . . . . . . . 74.9 m-20 -56.59 -33.44 66.21 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.8 179.706 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 342' ' ' ALA . . . . . . . . . . . . . . . -72.75 -37.05 67.82 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.011 179.885 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 343' ' ' LYS . . . . . . . . . . . . . 64.6 tttp -71.85 -28.07 63.31 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.978 -0.555 . . . . 0.0 110.497 179.803 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 344' ' ' GLU . . . . . . . . . . . . . 17.3 mm-40 -77.9 -41.32 36.95 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.912 -0.585 . . . . 0.0 110.788 179.681 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 345' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.33 -0.269 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.272 179.898 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' B' B ' 351' ' ' PRO . . . . . . . . . . . . . 45.9 Cg_exo . . . . . 0 C--O 1.232 0.189 0 CA-C-O 120.727 0.22 . . . . 0.0 112.325 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' B' B ' 352' ' ' ALA . . . . . . . . . . . . . . . -70.11 -76.95 0.09 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.133 179.993 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 353' ' ' LEU . . . . . 0.578 ' HB3' ' HG2' ' B' ' 357' ' ' GLU . 0.3 OUTLIER -107.32 154.85 20.66 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 121.095 0.474 . . . . 0.0 111.726 179.965 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' B' B ' 354' ' ' THR . . . . . . . . . . . . . 59.6 p -114.85 -172.91 2.21 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.871 -0.604 . . . . 0.0 110.767 179.586 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 355' ' ' GLU . . . . . . . . . . . . . 7.8 pt-20 -58.92 -42.73 90.4 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 121.309 0.576 . . . . 0.0 110.072 179.577 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 356' ' ' GLN . . . . . . . . . . . . . 28.9 tt0 -64.56 -38.37 90.77 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.394 -0.821 . . . . 0.0 110.97 179.656 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 357' ' ' GLU . . . . . 0.578 ' HG2' ' HB3' ' B' ' 353' ' ' LEU . 4.6 tp10 -61.21 -50.03 74.75 Favored 'General case' 0 C--N 1.333 -0.138 0 CA-C-O 120.807 0.337 . . . . 0.0 110.506 179.948 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 358' ' ' VAL . . . . . 0.494 HG23 HG23 ' B' ' 331' ' ' ILE . 93.5 t -59.09 -60.55 2.25 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.069 -0.514 . . . . 0.0 111.014 179.991 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 359' ' ' TYR . . . . . . . . . . . . . 2.2 t80 -52.0 -33.44 38.21 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.521 -0.309 . . . . 0.0 111.014 -179.325 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 360' ' ' ALA . . . . . . . . . . . . . . . -65.58 -60.59 2.76 Favored 'General case' 0 C--O 1.234 0.246 0 CA-C-N 116.502 -0.317 . . . . 0.0 111.242 179.896 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 361' ' ' GLN . . . . . 0.412 HE21 HD12 ' B' ' 331' ' ' ILE . 25.1 mt-30 -58.15 -36.23 72.7 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.98 0.419 . . . . 0.0 110.414 179.923 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 362' ' ' VAL . . . . . 0.484 HG21 ' O ' ' B' ' 358' ' ' VAL . 66.1 t -70.64 -32.05 48.17 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 115.902 -0.59 . . . . 0.0 109.988 179.246 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 363' ' ' ALA . . . . . 0.543 ' HA ' HD11 ' B' ' 373' ' ' LEU . . . -65.16 -38.87 91.96 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 115.914 -0.585 . . . . 0.0 109.876 179.124 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 364' ' ' ARG . . . . . . . . . . . . . 31.8 ttm180 -80.85 -23.41 39.12 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.574 -0.739 . . . . 0.0 110.109 179.011 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 365' ' ' LEU . . . . . . . . . . . . . 8.3 tp -58.12 -24.84 60.22 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.826 -0.625 . . . . 0.0 110.185 179.523 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 366' ' ' PHE . . . . . 0.45 ' HB3' ' HB2' ' B' ' 369' ' ' GLN . 38.1 m-85 -129.07 179.85 5.52 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.742 -0.663 . . . . 0.0 110.423 179.708 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 367' ' ' LYS . . . . . . . . . . . . . 98.4 mttt -138.49 -80.61 0.33 Allowed 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.584 -0.28 . . . . 0.0 111.246 179.904 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 368' ' ' ASN . . . . . . . . . . . . . 28.0 p30 -79.96 7.67 8.5 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.275 -0.421 . . . . 0.0 110.887 -179.886 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 369' ' ' GLN . . . . . 0.654 ' HB3' HD12 ' B' ' 372' ' ' LEU . 44.5 mt-30 -103.38 91.67 4.16 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.022 -0.536 . . . . 0.0 111.436 -179.788 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 370' ' ' GLU . . . . . . . . . . . . . 42.5 mt-10 -94.54 -20.24 19.81 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.875 179.504 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 371' ' ' ASP . . . . . . . . . . . . . 23.5 t70 -59.09 -45.3 91.2 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.69 179.748 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 372' ' ' LEU . . . . . 0.654 HD12 ' HB3' ' B' ' 369' ' ' GLN . 6.6 mp -62.5 -51.82 65.91 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.731 179.593 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 373' ' ' LEU . . . . . 0.543 HD11 ' HA ' ' B' ' 363' ' ' ALA . 1.1 mp -55.88 -37.47 68.87 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.797 -0.638 . . . . 0.0 111.282 -179.749 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 374' ' ' SER . . . . . . . . . . . . . 70.1 m -69.25 -53.39 20.07 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.676 179.754 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 375' ' ' GLU . . . . . . . . . . . . . 39.4 mm-40 -52.56 -36.76 56.5 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.259 179.485 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 376' ' ' PHE . . . . . . . . . . . . . 91.8 t80 -70.24 -41.09 73.99 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.28 179.429 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 377' ' ' GLY . . . . . . . . . . . . . . . -60.2 -32.59 76.93 Favored Glycine 0 N--CA 1.45 -0.379 0 C-N-CA 120.768 -0.729 . . . . 0.0 112.086 179.536 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 378' ' ' GLN . . . . . . . . . . . . . 23.4 mt-30 -60.31 -29.73 69.04 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.798 0.332 . . . . 0.0 110.614 179.656 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 379' ' ' PHE . . . . . . . . . . . . . 75.1 m-85 -69.9 -34.53 73.64 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.789 179.733 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 380' ' ' LEU . . . . . 0.401 ' HA ' ' HD2' ' B' ' 381' ' ' PRO . 90.8 mt -51.51 113.37 3.93 Favored Pre-proline 0 C--N 1.332 -0.164 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.612 179.861 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 381' ' ' PRO . . . . . 0.401 ' HD2' ' HA ' ' B' ' 380' ' ' LEU . 16.0 Cg_endo . . . . . 0 C--N 1.349 0.568 0 C-N-CA 122.312 2.008 . . . . 0.0 112.338 -179.726 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 366' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.232 0.173 0 CA-C-O 120.839 0.352 . . . . 0.0 110.911 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 367' ' ' VAL . . . . . . . . . . . . . 18.9 t -67.6 -21.27 27.28 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.788 179.891 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 368' ' ' TYR . . . . . . . . . . . . . 57.9 t80 -73.25 -48.99 30.26 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.977 -179.898 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 369' ' ' VAL . . . . . . . . . . . . . 14.6 m -70.11 -36.48 68.34 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.448 -179.782 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 370' ' ' LEU . . . . . 0.535 HD22 ' HA ' ' B' ' 307' ' ' ALA . 6.5 mp -69.35 -47.43 64.35 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.427 -0.352 . . . . 0.0 111.052 179.721 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 371' ' ' SER . . . . . 0.482 ' HB3' ' HB3' ' B' ' 303' ' ' GLU . 72.1 m -64.27 -38.84 92.48 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.294 -179.962 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 372' ' ' SER . . . . . . . . . . . . . 67.9 m -71.22 -61.33 1.81 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.475 -179.662 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 373' ' ' MET . . . . . 0.454 ' HB3' ' HD3' ' B' ' 381' ' ' PRO . 73.9 mtm -50.38 -41.06 51.3 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.626 -179.459 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 374' ' ' ALA . . . . . . . . . . . . . . . -73.01 -41.8 63.89 Favored 'General case' 0 C--N 1.331 -0.223 0 N-CA-C 112.008 0.373 . . . . 0.0 112.008 -179.426 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 375' ' ' ARG . . . . . 0.416 ' HB2' ' HG2' ' B' ' 303' ' ' GLU . 30.3 tpt180 -70.29 -23.08 62.8 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.692 0.282 . . . . 0.0 111.395 -179.55 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 376' ' ' GLN . . . . . . . . . . . . . 85.4 mm-40 . . . . . 0 C--N 1.33 -0.258 0 CA-C-N 116.424 -0.353 . . . . 0.0 111.119 -179.768 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' B' B ' 302' ' ' VAL . . . . . . . . . . . . . 15.0 p . . . . . 0 C--O 1.232 0.134 0 CA-C-O 120.845 0.355 . . . . 0.0 111.178 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' B' B ' 303' ' ' GLU . . . . . 0.482 ' HB3' ' HB3' ' A' ' 371' ' ' SER . 44.2 mt-10 -57.88 -78.77 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.974 -0.557 . . . . 0.0 111.647 -179.661 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 304' ' ' PHE . . . . . . . . . . . . . 64.7 m-85 -59.06 -31.55 68.97 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.898 -0.592 . . . . 0.0 111.914 -179.217 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 305' ' ' ASN . . . . . . . . . . . . . 26.9 t-20 -62.95 -71.4 0.16 Allowed 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.672 0.272 . . . . 0.0 111.57 -179.417 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 306' ' ' HIS . . . . . . . . . . . . . 4.3 t-160 -53.99 -41.1 67.55 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.36 -0.382 . . . . 0.0 111.509 -179.116 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 307' ' ' ALA . . . . . 0.535 ' HA ' HD22 ' A' ' 370' ' ' LEU . . . -60.72 -54.99 38.53 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.473 -0.33 . . . . 0.0 111.679 -179.564 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 308' ' ' ILE . . . . . . . . . . . . . 21.2 mm -57.09 -52.34 57.46 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.195 0 CA-C-N 116.662 -0.245 . . . . 0.0 111.407 -179.736 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 309' ' ' ASN . . . . . . . . . . . . . 28.5 m-80 -55.52 -34.65 64.85 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.473 -0.331 . . . . 0.0 111.211 -179.74 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 310' ' ' TYR . . . . . . . . . . . . . 80.6 t80 -66.5 -56.54 10.41 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.424 -0.353 . . . . 0.0 111.109 179.971 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 311' ' ' VAL . . . . . . . . . . . . . 61.5 t -56.14 -49.07 77.98 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.213 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.129 -179.832 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 312' ' ' ASN . . . . . . . . . . . . . 28.0 t-20 -61.99 -39.12 91.12 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.77 179.896 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 313' ' ' LYS . . . . . . . . . . . . . 42.9 tttp -55.12 -61.16 2.5 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.687 179.846 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 314' ' ' ILE . . . . . . . . . . . . . 98.2 mt -62.48 -28.07 44.0 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.077 -0.51 . . . . 0.0 111.177 -179.9 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 315' ' ' LYS . . . . . . . . . . . . . 1.6 tmmt? -67.21 -33.84 76.24 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.356 -0.383 . . . . 0.0 110.973 -179.851 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 316' ' ' ASN . . . . . . . . . . . . . 7.1 t30 -87.56 -50.45 6.51 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.454 -179.76 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 317' ' ' ARG . . . . . . . . . . . . . 29.3 mmm180 -57.75 -57.49 12.53 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.088 -179.728 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 318' ' ' PHE . . . . . . . . . . . . . 44.0 m-85 -88.41 39.54 0.91 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.944 -179.913 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 319' ' ' GLN . . . . . . . . . . . . . 9.0 tt0 -65.74 -18.04 65.05 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.594 179.815 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 320' ' ' GLY . . . . . . . . . . . . . . . -91.82 -9.62 62.39 Favored Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.845 -0.693 . . . . 0.0 112.547 -179.979 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 321' ' ' GLN . . . . . 0.565 ' N ' HE21 ' B' ' 321' ' ' GLN . 0.0 OUTLIER -112.42 88.06 10.37 Favored Pre-proline 0 C--N 1.33 -0.25 0 CA-C-O 120.582 0.23 . . . . 0.0 110.877 179.777 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' B' B ' 322' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_endo -77.35 -33.6 2.44 Favored 'Trans proline' 0 C--N 1.347 0.473 0 C-N-CA 122.537 2.158 . . . . 0.0 112.414 -179.976 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 323' ' ' ASP . . . . . . . . . . . . . 5.2 m-20 -65.46 -56.26 13.43 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.13 -0.487 . . . . 0.0 111.167 -179.761 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 324' ' ' ILE . . . . . . . . . . . . . 53.3 mt -59.28 -53.27 50.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.455 -179.713 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 325' ' ' TYR . . . . . . . . . . . . . 16.8 t80 -54.01 -47.07 71.89 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.886 -179.832 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 326' ' ' LYS . . . . . . . . . . . . . 61.7 tttm -60.09 -40.8 90.86 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.879 -179.953 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 327' ' ' ALA . . . . . . . . . . . . . . . -59.02 -53.02 63.14 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.157 -179.88 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 328' ' ' PHE . . . . . . . . . . . . . 84.0 t80 -54.66 -52.36 62.57 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.785 179.962 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 329' ' ' LEU . . . . . . . . . . . . . 77.3 mt -55.09 -39.17 69.03 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.986 -179.891 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 330' ' ' GLU . . . . . . . . . . . . . 16.4 mm-40 -63.81 -39.47 94.31 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.782 179.884 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 331' ' ' ILE . . . . . . . . . . . . . 90.4 mt -61.36 -45.71 98.06 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.17 0 CA-C-N 116.31 -0.405 . . . . 0.0 110.402 179.278 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 332' ' ' LEU . . . . . . . . . . . . . 7.7 mp -64.74 -34.7 78.93 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.867 179.533 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 333' ' ' HIS . . . . . . . . . . . . . 59.7 t-80 -62.09 -49.35 76.27 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.994 0.426 . . . . 0.0 110.111 179.502 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 334' ' ' THR . . . . . . . . . . . . . 53.1 m -63.09 -39.37 94.5 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.306 179.404 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 335' ' ' TYR . . . . . . . . . . . . . 55.7 t80 -62.72 -32.74 73.91 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.822 -0.626 . . . . 0.0 110.097 179.356 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 336' ' ' GLN . . . . . . . . . . . . . 8.8 tt0 -70.43 -45.5 65.74 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.593 -0.731 . . . . 0.0 110.64 179.808 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 337' ' ' LYS . . . . . . . . . . . . . 41.4 ttmt -60.88 -40.5 93.24 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.055 179.976 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 338' ' ' GLU . . . . . . . . . . . . . 20.8 mm-40 -67.29 -49.07 65.7 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.447 -179.753 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 339' ' ' GLN . . . . . . . . . . . . . 15.8 mm100 -61.06 -47.36 86.72 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.527 -0.306 . . . . 0.0 111.211 -179.85 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 340' ' ' ARG . . . . . . . . . . . . . 82.7 mtp180 -58.7 -51.98 67.66 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.209 -179.866 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 341' ' ' ASN . . . . . . . . . . . . . 5.6 t30 -59.76 -37.93 80.41 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.063 -179.751 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 342' ' ' ALA . . . . . . . . . . . . . . . -65.39 -35.74 81.87 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.043 179.938 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 343' ' ' LYS . . . . . . . . . . . . . 60.1 tttm -71.83 -38.59 70.13 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.923 179.976 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 344' ' ' GLU . . . . . . . . . . . . . 46.7 mt-10 -73.08 -28.51 62.34 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.145 -179.885 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 345' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.33 -0.275 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.146 -179.88 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' B' B ' 351' ' ' PRO . . . . . . . . . . . . . 31.7 Cg_exo . . . . . 0 C--O 1.231 0.154 0 CA-C-O 120.778 0.241 . . . . 0.0 112.425 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' B' B ' 352' ' ' ALA . . . . . . . . . . . . . . . -105.33 -71.17 0.75 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.38 -179.83 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 353' ' ' LEU . . . . . . . . . . . . . 7.3 mp -85.05 126.65 33.74 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 121.048 0.451 . . . . 0.0 111.332 -179.779 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 354' ' ' THR . . . . . 0.465 ' H ' ' HB2' ' B' ' 357' ' ' GLU . 81.4 p -111.61 -175.76 2.78 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.738 -0.664 . . . . 0.0 110.564 179.43 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 355' ' ' GLU . . . . . . . . . . . . . 8.9 pt-20 -53.06 -44.9 67.83 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.894 0.378 . . . . 0.0 110.933 179.861 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 356' ' ' GLN . . . . . . . . . . . . . 35.9 tt0 -69.53 -34.57 74.44 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.045 -0.525 . . . . 0.0 111.212 -179.701 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 357' ' ' GLU . . . . . 0.465 ' HB2' ' H ' ' B' ' 354' ' ' THR . 4.8 tp10 -60.28 -55.66 30.99 Favored 'General case' 0 C--O 1.233 0.203 0 CA-C-O 120.752 0.311 . . . . 0.0 110.655 -179.849 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 358' ' ' VAL . . . . . 0.459 ' O ' HG21 ' B' ' 362' ' ' VAL . 69.9 t -60.92 -54.51 34.34 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.872 179.825 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 359' ' ' TYR . . . . . . . . . . . . . 1.2 t80 -52.05 -34.36 43.09 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.774 0.321 . . . . 0.0 110.911 -179.661 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 360' ' ' ALA . . . . . . . . . . . . . . . -66.94 -60.43 2.65 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.357 -179.913 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 361' ' ' GLN . . . . . . . . . . . . . 49.1 mt-30 -55.52 -41.51 73.24 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.992 -179.949 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 362' ' ' VAL . . . . . 0.459 HG21 ' O ' ' B' ' 358' ' ' VAL . 50.1 t -67.59 -35.37 72.8 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.545 179.703 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 363' ' ' ALA . . . . . . . . . . . . . . . -62.06 -40.92 97.42 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.464 179.562 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 364' ' ' ARG . . . . . . . . . . . . . 67.3 ttt180 -81.34 -22.61 38.33 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.886 -0.597 . . . . 0.0 110.444 179.544 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 365' ' ' LEU . . . . . . . . . . . . . 6.4 tp -64.08 -23.14 67.21 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.75 179.989 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 366' ' ' PHE . . . . . . . . . . . . . 84.2 m-85 -125.72 165.72 18.09 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.643 179.811 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 367' ' ' LYS . . . . . . . . . . . . . 63.3 mttp -128.38 -77.32 0.56 Allowed 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.352 -0.386 . . . . 0.0 111.016 -179.859 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 368' ' ' ASN . . . . . . . . . . . . . 38.5 m-80 -85.17 7.9 20.21 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.847 179.951 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 369' ' ' GLN . . . . . . . . . . . . . 14.7 mm100 -112.22 56.33 0.66 Allowed 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.065 -179.842 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 370' ' ' GLU . . . . . . . . . . . . . 6.3 tm-20 -69.0 -23.23 64.08 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.511 179.753 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 371' ' ' ASP . . . . . . . . . . . . . 13.1 m-20 -52.66 -32.64 43.26 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.866 179.949 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 372' ' ' LEU . . . . . . . . . . . . . 78.1 mt -73.53 -35.74 65.59 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.68 179.717 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 373' ' ' LEU . . . . . . . . . . . . . 48.8 mt -65.5 -38.59 90.15 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.441 179.75 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 374' ' ' SER . . . . . . . . . . . . . 87.7 p -70.48 -54.45 12.21 Favored 'General case' 0 C--O 1.234 0.256 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.608 179.559 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 375' ' ' GLU . . . . . . . . . . . . . 16.4 mm-40 -53.24 -39.65 63.98 Favored 'General case' 0 C--N 1.333 -0.144 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.292 179.451 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 376' ' ' PHE . . . . . . . . . . . . . 88.4 t80 -69.29 -36.44 77.04 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.042 -0.526 . . . . 0.0 109.795 179.087 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 377' ' ' GLY . . . . . . . . . . . . . . . -61.87 -31.0 76.79 Favored Glycine 0 N--CA 1.448 -0.512 0 C-N-CA 120.896 -0.669 . . . . 0.0 111.607 179.234 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 378' ' ' GLN . . . . . . . . . . . . . 23.4 mt-30 -58.51 -32.0 68.42 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.836 0.35 . . . . 0.0 110.287 179.252 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 379' ' ' PHE . . . . . . . . . . . . . 97.6 m-85 -75.62 -31.0 59.71 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.221 179.244 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 380' ' ' LEU . . . . . . . . . . . . . 5.7 tp -59.05 127.67 84.05 Favored Pre-proline 0 C--N 1.328 -0.364 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.654 -179.97 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 381' ' ' PRO . . . . . 0.454 ' HD3' ' HB3' ' A' ' 373' ' ' MET . 51.4 Cg_exo . . . . . 0 C--N 1.348 0.514 0 C-N-CA 122.348 2.032 . . . . 0.0 112.322 -179.71 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 366' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.233 0.191 0 N-CA-C 111.811 0.3 . . . . 0.0 111.811 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 367' ' ' VAL . . . . . . . . . . . . . 20.8 m -65.35 -37.93 81.3 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 CA-C-N 116.465 -0.334 . . . . 0.0 111.558 -179.515 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 368' ' ' TYR . . . . . . . . . . . . . 80.4 t80 -68.75 -53.02 24.36 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.355 -0.384 . . . . 0.0 111.539 -179.422 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 369' ' ' VAL . . . . . 0.573 HG12 ' HB3' ' B' ' 332' ' ' LEU . 5.1 p -57.62 -50.2 78.12 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.203 0 CA-C-N 116.611 -0.268 . . . . 0.0 111.513 -179.58 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 370' ' ' LEU . . . . . 0.572 ' HB3' ' HB2' ' B' ' 307' ' ' ALA . 8.1 mp -63.55 -35.73 81.46 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.689 0.28 . . . . 0.0 111.22 -179.866 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 371' ' ' SER . . . . . 0.51 ' HA ' ' HB2' ' B' ' 303' ' ' GLU . 34.6 t -62.41 -61.78 2.21 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 120.828 0.347 . . . . 0.0 111.107 179.85 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 372' ' ' SER . . . . . . . . . . . . . 40.4 t -62.43 -25.6 68.05 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.283 -179.515 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 373' ' ' MET . . . . . . . . . . . . . 56.0 ttm -66.38 -52.14 49.91 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.318 -0.401 . . . . 0.0 111.492 -179.628 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 374' ' ' ALA . . . . . . . . . . . . . . . -88.06 -8.86 54.93 Favored 'General case' 0 C--N 1.33 -0.281 0 N-CA-C 112.419 0.526 . . . . 0.0 112.419 -179.051 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 375' ' ' ARG . . . . . . . . . . . . . 10.4 ttp180 -94.09 -30.14 14.82 Favored 'General case' 0 C--N 1.33 -0.268 0 C-N-CA 120.962 -0.295 . . . . 0.0 111.515 -179.855 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 376' ' ' GLN . . . . . . . . . . . . . 24.0 tp60 . . . . . 0 C--N 1.33 -0.246 0 CA-C-O 120.615 0.245 . . . . 0.0 111.004 -179.837 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' B' B ' 302' ' ' VAL . . . . . 0.549 HG21 ' H ' ' B' ' 303' ' ' GLU . 3.3 m . . . . . 0 C--O 1.233 0.232 0 CA-C-O 120.735 0.302 . . . . 0.0 111.541 . . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 303' ' ' GLU . . . . . 0.549 ' H ' HG21 ' B' ' 302' ' ' VAL . 0.0 OUTLIER -59.67 -16.0 23.34 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.412 -0.358 . . . . 0.0 111.073 -179.791 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' B' B ' 304' ' ' PHE . . . . . . . . . . . . . 82.3 t80 -64.13 -75.64 0.08 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.519 179.786 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 305' ' ' ASN . . . . . . . . . . . . . 25.7 t-20 -61.49 -29.44 69.98 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.995 -179.92 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 306' ' ' HIS . . . . . . . . . . . . . 2.3 m-70 -62.36 -69.33 0.26 Allowed 'General case' 0 C--O 1.233 0.202 0 CA-C-N 116.41 -0.359 . . . . 0.0 111.494 179.875 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 307' ' ' ALA . . . . . 0.572 ' HB2' ' HB3' ' A' ' 370' ' ' LEU . . . -55.56 -42.31 74.5 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.961 -179.217 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 308' ' ' ILE . . . . . . . . . . . . . 97.7 mt -60.34 -63.83 0.7 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.181 0 CA-C-O 120.672 0.272 . . . . 0.0 111.214 -179.853 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 309' ' ' ASN . . . . . . . . . . . . . 2.9 m-20 -54.76 -24.76 23.93 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.321 -0.399 . . . . 0.0 110.704 179.942 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 310' ' ' TYR . . . . . 0.438 ' O ' ' HG3' ' B' ' 313' ' ' LYS . 19.2 t80 -65.7 -57.18 8.67 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.31 179.51 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 311' ' ' VAL . . . . . . . . . . . . . 59.5 t -60.24 -31.05 47.34 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.748 179.557 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 312' ' ' ASN . . . . . . . . . . . . . 51.1 t-20 -66.26 -57.06 8.37 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.97 -0.559 . . . . 0.0 111.58 -179.696 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 313' ' ' LYS . . . . . 0.438 ' HG3' ' O ' ' B' ' 310' ' ' TYR . 0.0 OUTLIER -61.79 -30.56 70.89 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.61 -0.268 . . . . 0.0 111.633 -179.187 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' B' B ' 314' ' ' ILE . . . . . . . . . . . . . 89.3 mt -76.78 -31.69 19.64 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.206 0 CA-C-O 120.878 0.371 . . . . 0.0 110.998 179.542 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 315' ' ' LYS . . . . . . . . . . . . . 23.8 ttmm -78.49 -26.47 46.02 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.298 -179.717 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 316' ' ' ASN . . . . . . . . . . . . . 26.6 t-20 -88.95 -46.08 9.17 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.423 -0.353 . . . . 0.0 111.427 -179.607 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 317' ' ' ARG . . . . . . . . . . . . . 32.0 tpt180 -65.17 -60.41 3.03 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.432 -0.349 . . . . 0.0 111.203 -179.742 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 318' ' ' PHE . . . . . . . . . . . . . 95.4 m-85 -80.94 25.68 0.45 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.242 -0.435 . . . . 0.0 111.27 -179.655 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 319' ' ' GLN . . . . . . . . . . . . . 56.7 tt0 -62.6 -23.88 67.28 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.658 179.775 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 320' ' ' GLY . . . . . . . . . . . . . . . -72.8 -46.08 31.58 Favored Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 120.886 -0.673 . . . . 0.0 112.689 -179.915 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 321' ' ' GLN . . . . . . . . . . . . . 8.4 tt0 -108.0 92.95 9.96 Favored Pre-proline 0 C--N 1.329 -0.301 0 CA-C-O 120.462 0.172 . . . . 0.0 110.828 179.964 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 322' ' ' PRO . . . . . . . . . . . . . 57.9 Cg_endo -71.34 -4.43 14.95 Favored 'Trans proline' 0 C--N 1.348 0.507 0 C-N-CA 122.433 2.089 . . . . 0.0 112.333 179.931 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 323' ' ' ASP . . . . . . . . . . . . . 16.2 t70 -68.97 -56.09 8.87 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.914 179.876 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 324' ' ' ILE . . . . . . . . . . . . . 63.8 mt -60.98 -46.25 96.97 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.938 179.887 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 325' ' ' TYR . . . . . . . . . . . . . 30.0 t80 -57.72 -47.88 81.15 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.989 -0.551 . . . . 0.0 110.887 179.936 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 326' ' ' LYS . . . . . . . . . . . . . 23.6 ttmm -57.3 -52.39 65.52 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.022 -179.977 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 327' ' ' ALA . . . . . . . . . . . . . . . -51.21 -47.13 62.37 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.053 179.964 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 328' ' ' PHE . . . . . . . . . . . . . 59.6 t80 -56.09 -48.71 75.61 Favored 'General case' 0 C--O 1.235 0.296 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.387 179.672 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 329' ' ' LEU . . . . . . . . . . . . . 77.9 mt -58.29 -34.67 70.79 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.844 -0.617 . . . . 0.0 110.813 179.584 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 330' ' ' GLU . . . . . . . . . . . . . 48.1 mt-10 -68.71 -37.07 79.22 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.934 -0.575 . . . . 0.0 110.825 -179.903 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 331' ' ' ILE . . . . . . . . . . . . . 75.8 mt -65.71 -45.28 92.35 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.229 0 CA-C-N 116.38 -0.373 . . . . 0.0 110.697 179.769 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 332' ' ' LEU . . . . . 0.573 ' HB3' HG12 ' A' ' 369' ' ' VAL . 25.0 mt -69.0 -32.44 71.99 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.972 -179.972 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 333' ' ' HIS . . . . . . . . . . . . . 49.7 t60 -66.58 -53.79 30.58 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.927 0.394 . . . . 0.0 110.543 179.649 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 334' ' ' THR . . . . . . . . . . . . . 89.3 m -62.03 -35.86 79.84 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.825 179.751 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 335' ' ' TYR . . . . . . . . . . . . . 71.7 t80 -64.74 -41.77 95.68 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.511 179.727 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 336' ' ' GLN . . . . . . . . . . . . . 6.8 tt0 -65.9 -38.04 87.68 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.881 -0.599 . . . . 0.0 110.798 179.816 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 337' ' ' LYS . . . . . . . . . . . . . 38.1 ttpt -64.88 -50.3 67.11 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.284 -0.416 . . . . 0.0 111.115 179.941 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 338' ' ' GLU . . . . . . . . . . . . . 21.5 mm-40 -63.3 -35.4 80.25 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.978 -179.854 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 339' ' ' GLN . . . . . . . . . . . . . 28.5 tt0 -64.17 -53.03 55.76 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.669 179.873 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 340' ' ' ARG . . . . . . . . . . . . . 99.1 mtt180 -57.94 -47.07 83.98 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.856 179.819 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 341' ' ' ASN . . . . . . . . . . . . . 49.2 t-20 -56.4 -46.04 80.34 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.481 179.513 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 342' ' ' ALA . . . . . . . . . . . . . . . -66.38 -27.2 67.68 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.064 -0.517 . . . . 0.0 110.707 179.757 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 343' ' ' LYS . . . . . . . . . . . . . 22.3 tptm -71.87 -46.52 57.59 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.809 179.781 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 344' ' ' GLU . . . . . . . . . . . . . 10.9 mm-40 -67.31 -34.84 78.2 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.868 -0.605 . . . . 0.0 110.919 -179.935 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 345' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.304 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.132 179.872 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' B' B ' 351' ' ' PRO . . . . . . . . . . . . . 40.5 Cg_exo . . . . . 0 C--O 1.232 0.184 0 CA-C-O 120.735 0.223 . . . . 0.0 112.053 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' B' B ' 352' ' ' ALA . . . . . . . . . . . . . . . -103.27 -51.5 3.22 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.319 -0.4 . . . . 0.0 111.496 -179.606 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 353' ' ' LEU . . . . . 0.43 ' HG ' ' HG2' ' B' ' 357' ' ' GLU . 7.0 mp -108.87 126.28 52.89 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 121.106 0.479 . . . . 0.0 111.521 -179.529 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 354' ' ' THR . . . . . . . . . . . . . 40.4 p -111.93 -176.85 3.03 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.703 -0.68 . . . . 0.0 110.382 179.264 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 355' ' ' GLU . . . . . . . . . . . . . 8.4 pt-20 -53.44 -41.71 66.36 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.112 0.482 . . . . 0.0 110.483 179.558 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 356' ' ' GLN . . . . . . . . . . . . . 53.5 tt0 -67.57 -39.36 84.9 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.698 -0.683 . . . . 0.0 110.964 179.904 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 357' ' ' GLU . . . . . 0.43 ' HG2' ' HG ' ' B' ' 353' ' ' LEU . 4.8 tp10 -60.43 -54.07 49.97 Favored 'General case' 0 C--N 1.333 -0.136 0 CA-C-O 120.826 0.346 . . . . 0.0 110.976 -179.895 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 358' ' ' VAL . . . . . 0.443 ' O ' HG23 ' B' ' 362' ' ' VAL . 75.6 t -59.36 -59.63 3.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.104 -179.988 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 359' ' ' TYR . . . . . . . . . . . . . 78.2 t80 -51.04 -31.9 19.94 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.565 -0.289 . . . . 0.0 111.326 -179.466 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 360' ' ' ALA . . . . . . . . . . . . . . . -67.39 -60.37 2.64 Favored 'General case' 0 C--O 1.234 0.285 0 CA-C-O 120.849 0.356 . . . . 0.0 110.987 179.688 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 361' ' ' GLN . . . . . . . . . . . . . 45.1 mt-30 -57.56 -35.25 70.1 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.682 179.948 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 362' ' ' VAL . . . . . 0.443 HG23 ' O ' ' B' ' 358' ' ' VAL . 67.7 t -70.71 -34.7 57.7 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.336 179.456 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 363' ' ' ALA . . . . . 0.573 ' HA ' HD23 ' B' ' 373' ' ' LEU . . . -64.01 -39.42 94.06 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.132 179.212 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 364' ' ' ARG . . . . . . . . . . . . . 80.8 mtp180 -82.37 -22.19 35.58 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.701 -0.682 . . . . 0.0 110.325 179.193 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 365' ' ' LEU . . . . . 0.429 ' HB2' ' HA ' ' B' ' 362' ' ' VAL . 2.4 tp -60.14 -26.98 66.7 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 115.936 -0.574 . . . . 0.0 110.335 179.883 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 366' ' ' PHE . . . . . . . . . . . . . 45.3 m-85 -122.68 -176.29 3.35 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.447 179.659 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 367' ' ' LYS . . . . . 0.572 ' HZ3' ' HB2' ' B' ' 367' ' ' LYS . 0.0 OUTLIER -141.0 -75.95 0.31 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.424 -0.353 . . . . 0.0 110.885 -179.98 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' B' B ' 368' ' ' ASN . . . . . . . . . . . . . 6.6 t30 -81.12 -16.77 52.07 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.528 179.893 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 369' ' ' GLN . . . . . 0.559 ' HB3' HD13 ' B' ' 372' ' ' LEU . 12.7 mm100 -83.69 84.78 7.42 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.866 -179.939 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 370' ' ' GLU . . . . . . . . . . . . . 38.2 tt0 -93.75 -17.88 22.68 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.874 0.369 . . . . 0.0 110.519 179.81 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 371' ' ' ASP . . . . . . . . . . . . . 25.2 t70 -56.81 -40.28 75.69 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.625 179.722 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 372' ' ' LEU . . . . . 0.559 HD13 ' HB3' ' B' ' 369' ' ' GLN . 6.5 mp -65.86 -44.81 84.32 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.597 179.483 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 373' ' ' LEU . . . . . 0.573 HD23 ' HA ' ' B' ' 363' ' ' ALA . 1.3 mp -57.44 -43.33 83.8 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.76 -0.655 . . . . 0.0 111.417 -179.718 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 374' ' ' SER . . . . . . . . . . . . . 80.9 p -69.2 -53.23 21.04 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.959 0.409 . . . . 0.0 110.518 179.818 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 375' ' ' GLU . . . . . . . . . . . . . 40.0 tt0 -59.54 -24.57 63.81 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.969 -0.559 . . . . 0.0 110.509 179.776 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 376' ' ' PHE . . . . . . . . . . . . . 76.0 t80 -83.34 -34.01 25.75 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.12 179.378 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 377' ' ' GLY . . . . . . . . . . . . . . . -67.72 -32.46 78.15 Favored Glycine 0 N--CA 1.449 -0.436 0 C-N-CA 120.812 -0.708 . . . . 0.0 111.867 179.463 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 378' ' ' GLN . . . . . . . . . . . . . 54.7 mt-30 -61.75 -24.63 66.95 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.819 0.342 . . . . 0.0 110.547 179.442 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 379' ' ' PHE . . . . . . . . . . . . . 22.3 m-85 -72.06 -40.36 68.37 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.541 179.663 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 380' ' ' LEU . . . . . . . . . . . . . 75.8 mt -49.64 144.13 9.95 Favored Pre-proline 0 C--N 1.33 -0.256 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.294 179.72 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 381' ' ' PRO . . . . . . . . . . . . . 72.5 Cg_exo . . . . . 0 C--N 1.347 0.465 0 C-N-CA 122.418 2.079 . . . . 0.0 112.417 -179.462 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 366' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.233 0.196 0 CA-C-O 120.793 0.33 . . . . 0.0 110.973 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 367' ' ' VAL . . . . . . . . . . . . . 16.5 m -58.74 -35.62 56.54 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 116.03 -0.532 . . . . 0.0 111.115 179.913 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 368' ' ' TYR . . . . . . . . . . . . . 94.1 m-85 -64.65 -40.85 96.16 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.389 -0.368 . . . . 0.0 110.624 179.745 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 369' ' ' VAL . . . . . 0.57 HG22 ' HB2' ' B' ' 336' ' ' GLN . 21.9 t -63.99 -59.6 4.01 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-N 116.002 -0.544 . . . . 0.0 111.075 -179.897 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 370' ' ' LEU . . . . . 0.441 ' HB2' ' HB3' ' B' ' 307' ' ' ALA . 88.0 mt -57.81 -35.95 71.56 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.999 -0.546 . . . . 0.0 111.413 -179.604 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 371' ' ' SER . . . . . . . . . . . . . 47.3 t -61.83 -60.86 3.02 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.295 -0.412 . . . . 0.0 111.32 -179.558 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 372' ' ' SER . . . . . . . . . . . . . 79.4 p -56.93 -42.95 80.92 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.772 -179.368 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 373' ' ' MET . . . . . . . . . . . . . 90.2 mtp -57.29 -47.37 81.65 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.381 -0.372 . . . . 0.0 111.818 -179.355 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 374' ' ' ALA . . . . . 0.587 ' HB2' ' HB3' ' B' ' 303' ' ' GLU . . . -84.22 -17.93 38.21 Favored 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 112.044 0.387 . . . . 0.0 112.044 -179.341 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 375' ' ' ARG . . . . . . . . . . . . . 29.8 tpt180 -80.39 -26.49 38.52 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.769 0.319 . . . . 0.0 110.787 -179.881 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 376' ' ' GLN . . . . . . . . . . . . . 8.5 tt0 . . . . . 0 C--N 1.33 -0.265 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.132 -179.748 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' B' B ' 302' ' ' VAL . . . . . 0.55 HG21 ' H ' ' B' ' 303' ' ' GLU . 3.9 m . . . . . 0 C--O 1.233 0.223 0 CA-C-O 120.809 0.337 . . . . 0.0 111.353 . . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 303' ' ' GLU . . . . . 0.587 ' HB3' ' HB2' ' A' ' 374' ' ' ALA . 3.3 mm-40 -69.12 -23.73 64.02 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.611 -179.749 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 304' ' ' PHE . . . . . 0.406 ' O ' HG13 ' B' ' 308' ' ' ILE . 68.9 t80 -67.5 -54.48 19.76 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.188 179.433 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 305' ' ' ASN . . . . . . . . . . . . . 24.6 t-20 -60.29 -48.7 80.61 Favored 'General case' 0 C--O 1.233 0.228 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.471 179.408 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 306' ' ' HIS . . . . . . . . . . . . . 18.5 t-80 -54.72 -42.99 72.18 Favored 'General case' 0 C--O 1.234 0.264 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.24 179.494 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 307' ' ' ALA . . . . . 0.441 ' HB3' ' HB2' ' A' ' 370' ' ' LEU . . . -59.4 -44.98 92.72 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.635 179.548 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 308' ' ' ILE . . . . . 0.406 HG13 ' O ' ' B' ' 304' ' ' PHE . 85.3 mt -54.87 -51.96 47.56 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.215 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.593 179.358 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 309' ' ' ASN . . . . . . . . . . . . . 19.1 m120 -55.48 -38.17 68.78 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.731 179.788 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 310' ' ' TYR . . . . . 0.422 ' O ' ' HG3' ' B' ' 313' ' ' LYS . 15.0 t80 -61.49 -48.49 80.84 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.093 -0.503 . . . . 0.0 111.056 179.785 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 311' ' ' VAL . . . . . . . . . . . . . 40.0 t -62.57 -32.37 55.15 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.224 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.041 179.931 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 312' ' ' ASN . . . . . . . . . . . . . 31.4 t30 -67.68 -55.44 13.21 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.559 -179.652 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 313' ' ' LYS . . . . . 0.422 ' HG3' ' O ' ' B' ' 310' ' ' TYR . 0.0 OUTLIER -59.65 -36.94 77.4 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.382 -0.372 . . . . 0.0 111.784 -179.109 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' B' B ' 314' ' ' ILE . . . . . . . . . . . . . 68.3 mt -70.27 -40.1 77.53 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.162 0 C-N-CA 120.85 -0.34 . . . . 0.0 110.866 179.601 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 315' ' ' LYS . . . . . . . . . . . . . 12.9 ttpp -61.11 -47.29 86.95 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.324 -179.715 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 316' ' ' ASN . . . . . . . . . . . . . 57.6 t30 -67.51 -50.99 56.33 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.414 -179.329 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 317' ' ' ARG . . . . . . . . . . . . . 6.8 tpm_? -56.18 -61.26 2.52 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.186 -179.571 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 318' ' ' PHE . . . . . . . . . . . . . 66.9 m-85 -88.61 37.58 0.84 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.362 -179.686 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 319' ' ' GLN . . . . . . . . . . . . . 9.0 tt0 -68.66 -28.83 67.22 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.365 -0.38 . . . . 0.0 110.782 179.981 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 320' ' ' GLY . . . . . . . . . . . . . . . -82.84 -14.69 74.78 Favored Glycine 0 N--CA 1.452 -0.289 0 C-N-CA 120.847 -0.692 . . . . 0.0 112.451 179.856 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 321' ' ' GLN . . . . . . . . . . . . . 25.8 mp0 -110.21 88.53 7.29 Favored Pre-proline 0 C--N 1.33 -0.258 0 CA-C-O 120.451 0.167 . . . . 0.0 110.754 179.948 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 322' ' ' PRO . . . . . 0.429 ' HB2' ' HZ3' ' B' ' 326' ' ' LYS . 70.2 Cg_endo -73.89 -30.8 8.84 Favored 'Trans proline' 0 C--N 1.348 0.537 0 C-N-CA 122.374 2.049 . . . . 0.0 112.391 -179.996 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 323' ' ' ASP . . . . . . . . . . . . . 8.7 m-20 -63.7 -50.74 68.0 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.03 -179.884 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 324' ' ' ILE . . . . . . . . . . . . . 58.7 mt -67.03 -49.16 76.11 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.266 -179.798 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 325' ' ' TYR . . . . . . . . . . . . . 11.3 t80 -52.91 -50.79 63.23 Favored 'General case' 0 C--O 1.234 0.26 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.694 179.956 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 326' ' ' LYS . . . . . 0.463 ' O ' ' HG3' ' B' ' 330' ' ' GLU . 47.5 mttp -57.46 -53.95 52.31 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.774 179.423 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 327' ' ' ALA . . . . . 0.423 ' O ' HG13 ' B' ' 331' ' ' ILE . . . -46.31 -49.16 17.9 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.36 -179.935 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 328' ' ' PHE . . . . . . . . . . . . . 70.8 t80 -57.46 -55.26 37.09 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.747 179.844 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 329' ' ' LEU . . . . . . . . . . . . . 62.1 mt -58.65 -26.97 64.31 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.723 179.853 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 330' ' ' GLU . . . . . 0.463 ' HG3' ' O ' ' B' ' 326' ' ' LYS . 45.5 mt-10 -73.91 -36.5 64.72 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.409 179.583 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 331' ' ' ILE . . . . . 0.423 HG13 ' O ' ' B' ' 327' ' ' ALA . 91.7 mt -64.44 -50.5 75.91 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.204 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.135 179.235 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 332' ' ' LEU . . . . . . . . . . . . . 8.9 mp -65.58 -34.33 77.99 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.58 179.411 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 333' ' ' HIS . . . . . . . . . . . . . 50.2 t-80 -59.96 -57.41 13.0 Favored 'General case' 0 C--O 1.233 0.216 0 CA-C-O 120.975 0.417 . . . . 0.0 110.312 179.155 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 334' ' ' THR . . . . . . . . . . . . . 58.0 m -59.18 -33.13 70.58 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.855 -0.611 . . . . 0.0 110.555 179.421 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 335' ' ' TYR . . . . . . . . . . . . . 59.3 t80 -59.84 -51.46 69.62 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.732 179.883 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 336' ' ' GLN . . . . . 0.57 ' HB2' HG22 ' A' ' 369' ' ' VAL . 0.0 OUTLIER -62.33 -40.51 96.58 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.605 179.87 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' B' B ' 337' ' ' LYS . . . . . . . . . . . . . 25.0 ttmm -57.19 -47.82 80.29 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.747 179.712 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 338' ' ' GLU . . . . . 0.407 ' HG3' ' HB3' ' B' ' 352' ' ' ALA . 22.5 mm-40 -64.92 -37.58 88.12 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.795 179.797 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 339' ' ' GLN . . . . . . . . . . . . . 59.1 tp60 -61.7 -41.58 97.78 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.465 179.751 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 340' ' ' ARG . . . . . . . . . . . . . 72.6 mtp180 -64.17 -52.9 56.77 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.335 179.462 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 341' ' ' ASN . . . . . . . . . . . . . 3.2 m-20 -56.93 -31.01 64.51 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.002 -0.544 . . . . 0.0 110.276 179.237 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 342' ' ' ALA . . . . . . . . . . . . . . . -70.19 -40.25 74.75 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.581 179.453 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 343' ' ' LYS . . . . . . . . . . . . . 59.7 tttm -70.78 -28.74 64.89 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.723 179.62 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 344' ' ' GLU . . . . . . . . . . . . . 20.1 mm-40 -79.27 -33.6 43.32 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.105 -179.776 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 345' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.295 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.379 -179.825 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' B' B ' 351' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_exo . . . . . 0 C--O 1.232 0.2 0 CA-C-O 120.736 0.223 . . . . 0.0 112.258 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' B' B ' 352' ' ' ALA . . . . . 0.407 ' HB3' ' HG3' ' B' ' 338' ' ' GLU . . . -67.05 -55.03 16.07 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.389 -179.64 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 353' ' ' LEU . . . . . 0.499 HD22 ' HG2' ' B' ' 357' ' ' GLU . 22.0 mt -106.12 130.92 53.92 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.86 0.362 . . . . 0.0 111.192 -179.709 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 354' ' ' THR . . . . . . . . . . . . . 73.8 p -113.79 -170.63 1.74 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.905 179.69 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 355' ' ' GLU . . . . . . . . . . . . . 37.5 mt-10 -60.77 -44.3 96.94 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.97 179.912 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 356' ' ' GLN . . . . . . . . . . . . . 27.7 mm-40 -68.17 -38.18 81.8 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.028 -0.533 . . . . 0.0 111.335 -179.661 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 357' ' ' GLU . . . . . 0.499 ' HG2' HD22 ' B' ' 353' ' ' LEU . 8.8 tp10 -63.05 -54.37 39.17 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.535 -0.302 . . . . 0.0 111.018 -179.714 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 358' ' ' VAL . . . . . 0.41 ' O ' HG23 ' B' ' 362' ' ' VAL . 54.2 t -59.07 -54.05 39.48 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 116.449 -0.341 . . . . 0.0 110.909 179.817 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 359' ' ' TYR . . . . . . . . . . . . . 72.8 t80 -54.66 -32.86 59.87 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.467 -0.333 . . . . 0.0 110.885 -179.819 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 360' ' ' ALA . . . . . . . . . . . . . . . -68.03 -59.58 3.15 Favored 'General case' 0 C--N 1.332 -0.196 0 CA-C-N 116.376 -0.374 . . . . 0.0 111.012 179.701 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 361' ' ' GLN . . . . . . . . . . . . . 24.4 mt-30 -55.63 -35.21 65.64 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.81 179.822 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 362' ' ' VAL . . . . . 0.41 HG23 ' O ' ' B' ' 358' ' ' VAL . 98.3 t -74.65 -34.49 34.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.509 179.541 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 363' ' ' ALA . . . . . . . . . . . . . . . -64.21 -33.9 76.87 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.059 -0.518 . . . . 0.0 110.232 179.484 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 364' ' ' ARG . . . . . . . . . . . . . 71.1 ttt180 -90.54 -22.03 21.5 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.188 179.374 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 365' ' ' LEU . . . . . . . . . . . . . 18.4 tp -55.17 -31.67 61.55 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.708 -0.678 . . . . 0.0 110.716 179.775 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 366' ' ' PHE . . . . . . . . . . . . . 52.3 m-85 -111.81 179.99 3.86 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.954 -0.567 . . . . 0.0 110.496 179.85 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 367' ' ' LYS . . . . . . . . . . . . . 64.9 tttm -123.44 -75.63 0.6 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.701 0.286 . . . . 0.0 111.313 -179.722 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 368' ' ' ASN . . . . . . . . . . . . . 20.1 m120 -98.91 6.31 46.83 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.254 -179.669 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 369' ' ' GLN . . . . . 0.531 ' HB3' HD11 ' B' ' 372' ' ' LEU . 21.8 mp0 -100.26 87.8 3.53 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.38 -0.373 . . . . 0.0 110.754 179.842 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 370' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -93.56 -16.37 24.48 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.749 179.962 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 371' ' ' ASP . . . . . . . . . . . . . 17.4 t70 -55.96 -37.15 68.64 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.766 179.856 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 372' ' ' LEU . . . . . 0.531 HD11 ' HB3' ' B' ' 369' ' ' GLN . 6.4 mp -69.98 -36.7 75.38 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.307 179.945 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 373' ' ' LEU . . . . . . . . . . . . . 24.4 mt -65.1 -38.27 90.16 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.442 -0.344 . . . . 0.0 110.26 179.811 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 374' ' ' SER . . . . . . . . . . . . . 57.9 m -69.15 -53.31 20.82 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.477 179.359 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 375' ' ' GLU . . . . . . . . . . . . . 22.6 mm-40 -54.21 -44.39 71.58 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.305 179.638 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 376' ' ' PHE . . . . . . . . . . . . . 70.5 t80 -68.8 -33.81 74.47 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.063 179.232 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 377' ' ' GLY . . . . . . . . . . . . . . . -61.11 -34.84 89.52 Favored Glycine 0 N--CA 1.451 -0.364 0 C-N-CA 120.78 -0.724 . . . . 0.0 111.663 179.38 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 378' ' ' GLN . . . . . . . . . . . . . 27.1 mt-30 -62.14 -31.22 71.67 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.692 0.282 . . . . 0.0 110.596 179.427 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 379' ' ' PHE . . . . . . . . . . . . . 60.7 m-85 -66.42 -31.1 71.65 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.773 179.74 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 380' ' ' LEU . . . . . . . . . . . . . 97.6 mt -60.48 134.52 91.45 Favored Pre-proline 0 C--N 1.329 -0.322 0 CA-C-N 116.356 -0.384 . . . . 0.0 110.657 179.91 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 381' ' ' PRO . . . . . . . . . . . . . 79.6 Cg_exo . . . . . 0 C--N 1.351 0.673 0 C-N-CA 122.638 2.226 . . . . 0.0 112.933 -179.641 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 366' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.234 0.259 0 CA-C-O 121.015 0.436 . . . . 0.0 110.7 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 367' ' ' VAL . . . . . . . . . . . . . 39.4 t -55.97 -34.47 38.05 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.214 0 CA-C-N 115.733 -0.667 . . . . 0.0 110.653 179.495 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 368' ' ' TYR . . . . . . . . . . . . . 62.6 t80 -65.66 -37.14 85.68 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.561 179.735 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 369' ' ' VAL . . . . . 0.457 HG22 ' HB2' ' B' ' 336' ' ' GLN . 11.1 t -65.89 -56.52 14.49 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.201 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.511 179.671 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 370' ' ' LEU . . . . . . . . . . . . . 95.0 mt -61.64 -31.74 71.85 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.817 -0.629 . . . . 0.0 110.939 179.958 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 371' ' ' SER . . . . . 0.418 ' HA ' ' HB2' ' B' ' 303' ' ' GLU . 40.7 t -64.76 -52.76 55.26 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.299 -0.409 . . . . 0.0 110.379 179.517 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 372' ' ' SER . . . . . . . . . . . . . 50.3 m -60.59 -32.01 71.13 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.33 179.517 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 373' ' ' MET . . . . . 0.5 ' HG3' ' HD3' ' B' ' 381' ' ' PRO . 54.9 tpp -61.35 -60.63 3.43 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.804 -0.635 . . . . 0.0 110.837 179.622 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 374' ' ' ALA . . . . . . . . . . . . . . . -60.12 -34.17 73.14 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.596 -179.641 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 375' ' ' ARG . . . . . . . . . . . . . 18.9 tpt180 -75.76 -22.43 56.48 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.47 -0.332 . . . . 0.0 110.882 -179.688 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 376' ' ' GLN . . . . . . . . . . . . . 6.2 tp-100 . . . . . 0 C--N 1.331 -0.235 0 CA-C-O 121.029 0.442 . . . . 0.0 110.431 179.566 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' B' B ' 302' ' ' VAL . . . . . . . . . . . . . 27.7 m . . . . . 0 C--O 1.232 0.148 0 CA-C-O 120.835 0.35 . . . . 0.0 111.596 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' B' B ' 303' ' ' GLU . . . . . 0.418 ' HB2' ' HA ' ' A' ' 371' ' ' SER . 5.1 pt-20 -69.42 -46.98 65.51 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.533 -179.505 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 304' ' ' PHE . . . . . . . . . . . . . 89.4 m-85 -64.36 -49.2 72.59 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.776 0.322 . . . . 0.0 111.309 -179.629 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 305' ' ' ASN . . . . . . . . . . . . . 3.4 t-20 -59.89 -53.17 61.05 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.768 -179.322 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 306' ' ' HIS . . . . . . . . . . . . . 10.5 m-70 -60.7 -56.48 20.79 Favored 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 111.781 0.289 . . . . 0.0 111.781 -179.33 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 307' ' ' ALA . . . . . . . . . . . . . . . -51.9 -61.09 2.48 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 112.16 0.429 . . . . 0.0 112.16 -179.286 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 308' ' ' ILE . . . . . . . . . . . . . 46.9 mm -53.0 -56.68 6.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.504 -0.316 . . . . 0.0 111.841 -179.258 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 309' ' ' ASN . . . . . . . . . . . . . 2.7 t-20 -57.55 -29.22 64.22 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.483 -0.326 . . . . 0.0 111.482 -179.573 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 310' ' ' TYR . . . . . 0.524 ' HH ' ' HB2' ' B' ' 376' ' ' PHE . 11.8 t80 -69.34 -59.94 2.67 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.359 -0.382 . . . . 0.0 111.266 -179.451 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 311' ' ' VAL . . . . . . . . . . . . . 36.2 t -62.17 -26.79 41.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.289 -179.483 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 312' ' ' ASN . . . . . . . . . . . . . 6.8 t30 -72.46 -56.68 5.03 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.477 -179.537 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 313' ' ' LYS . . . . . 0.453 ' NZ ' ' HB2' ' B' ' 313' ' ' LYS . 0.0 OUTLIER -61.31 -32.34 72.2 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.38 -0.373 . . . . 0.0 111.551 -179.452 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' B' B ' 314' ' ' ILE . . . . . . . . . . . . . 98.0 mt -76.89 -39.72 30.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.563 -0.29 . . . . 0.0 111.639 -179.74 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 315' ' ' LYS . . . . . 0.408 ' HE3' ' HB3' ' B' ' 315' ' ' LYS . 1.4 tmmt? -65.64 -38.62 89.87 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.522 -0.308 . . . . 0.0 110.937 -179.853 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 316' ' ' ASN . . . . . . . . . . . . . 42.6 t30 -76.31 -51.8 11.24 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.518 -179.466 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 317' ' ' ARG . . . . . . . . . . . . . 19.0 tpp180 -60.27 -62.93 1.5 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.368 -179.6 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 318' ' ' PHE . . . . . . . . . . . . . 66.7 m-85 -86.38 38.43 0.78 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.209 -179.672 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 319' ' ' GLN . . . . . . . . . . . . . 58.1 tt0 -65.54 -29.61 70.26 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.9 179.933 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 320' ' ' GLY . . . . . . . . . . . . . . . -84.82 -2.31 88.62 Favored Glycine 0 N--CA 1.453 -0.23 0 C-N-CA 120.763 -0.732 . . . . 0.0 112.624 -179.732 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 321' ' ' GLN . . . . . . . . . . . . . 24.2 mp0 -109.98 91.73 11.56 Favored Pre-proline 0 C--N 1.33 -0.245 0 CA-C-O 120.502 0.191 . . . . 0.0 110.884 179.944 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 322' ' ' PRO . . . . . . . . . . . . . 97.6 Cg_endo -78.6 -29.03 3.9 Favored 'Trans proline' 0 C--N 1.348 0.511 0 C-N-CA 122.41 2.074 . . . . 0.0 112.59 -179.857 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 323' ' ' ASP . . . . . . . . . . . . . 25.4 t70 -69.15 -46.0 68.66 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.413 -0.358 . . . . 0.0 111.053 -179.829 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 324' ' ' ILE . . . . . . . . . . . . . 75.5 mt -70.87 -42.04 77.26 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.013 179.928 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 325' ' ' TYR . . . . . . . . . . . . . 46.0 t80 -62.96 -50.62 70.06 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.042 -0.527 . . . . 0.0 110.92 179.955 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 326' ' ' LYS . . . . . 0.63 ' HZ2' ' HB3' ' B' ' 326' ' ' LYS . 6.5 ttpm? -61.55 -49.94 74.66 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.101 -179.862 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 327' ' ' ALA . . . . . 0.41 ' HB1' HD12 ' B' ' 365' ' ' LEU . . . -54.33 -47.23 72.73 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.365 -0.379 . . . . 0.0 110.987 179.937 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 328' ' ' PHE . . . . . . . . . . . . . 53.0 t80 -56.5 -51.1 69.79 Favored 'General case' 0 C--O 1.236 0.357 0 CA-C-N 115.969 -0.56 . . . . 0.0 110.633 179.875 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 329' ' ' LEU . . . . . . . . . . . . . 92.8 mt -56.45 -34.54 66.95 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.541 179.534 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 330' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -67.65 -37.89 83.04 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.711 179.652 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 331' ' ' ILE . . . . . . . . . . . . . 79.9 mt -62.96 -51.62 69.64 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.161 0 CA-C-N 116.407 -0.36 . . . . 0.0 110.427 179.552 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 332' ' ' LEU . . . . . . . . . . . . . 17.7 mt -66.87 -26.7 67.02 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.73 179.784 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 333' ' ' HIS . . . . . . . . . . . . . 57.0 t-80 -64.12 -60.02 3.73 Favored 'General case' 0 C--O 1.234 0.256 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.199 179.481 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 334' ' ' THR . . . . . . . . . . . . . 80.0 m -58.94 -37.25 76.28 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.253 179.285 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 335' ' ' TYR . . . . . . . . . . . . . 56.4 t80 -60.59 -36.83 79.51 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.091 179.312 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 336' ' ' GLN . . . . . 0.457 ' HB2' HG22 ' A' ' 369' ' ' VAL . 24.7 tt0 -67.9 -51.44 47.99 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.781 179.771 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 337' ' ' LYS . . . . . . . . . . . . . 39.5 ttpt -51.8 -51.67 54.69 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.14 -179.824 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 338' ' ' GLU . . . . . 0.415 ' HG3' ' HB3' ' B' ' 352' ' ' ALA . 27.2 mm-40 -62.75 -39.86 95.45 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.986 -179.886 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 339' ' ' GLN . . . . . 0.441 ' HG3' ' HE2' ' B' ' 343' ' ' LYS . 8.7 tp-100 -61.45 -39.39 90.67 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 121.023 0.439 . . . . 0.0 110.652 179.718 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 340' ' ' ARG . . . . . . . . . . . . . 64.9 mtp180 -64.1 -54.16 38.37 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.589 179.757 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 341' ' ' ASN . . . . . . . . . . . . . 43.7 t-20 -56.7 -32.42 65.47 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.356 179.555 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 342' ' ' ALA . . . . . . . . . . . . . . . -66.3 -46.6 76.37 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.801 179.75 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 343' ' ' LYS . . . . . 0.441 ' HE2' ' HG3' ' B' ' 339' ' ' GLN . 68.5 mttm -66.53 -29.2 69.23 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.845 179.763 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 344' ' ' GLU . . . . . . . . . . . . . 23.9 mm-40 -69.99 -62.01 1.55 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.085 179.941 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 345' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.305 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.016 179.943 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' B' B ' 351' ' ' PRO . . . . . . . . . . . . . 32.3 Cg_exo . . . . . 0 C--O 1.231 0.127 0 CA-C-O 120.725 0.219 . . . . 0.0 112.074 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' B' B ' 352' ' ' ALA . . . . . 0.415 ' HB3' ' HG3' ' B' ' 338' ' ' GLU . . . -86.2 -55.89 3.71 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.211 179.994 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 353' ' ' LEU . . . . . 0.463 HD21 ' HG2' ' B' ' 357' ' ' GLU . 13.6 mt -91.34 125.33 36.06 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.957 0.408 . . . . 0.0 111.241 -179.854 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 354' ' ' THR . . . . . . . . . . . . . 75.2 p -113.27 -173.44 2.26 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.855 -0.612 . . . . 0.0 110.593 179.668 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 355' ' ' GLU . . . . . . . . . . . . . 7.1 pt-20 -60.61 -41.42 94.75 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.951 0.405 . . . . 0.0 110.613 179.585 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 356' ' ' GLN . . . . . . . . . . . . . 14.5 mm100 -71.61 -38.87 70.79 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.866 -0.607 . . . . 0.0 111.225 -179.98 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 357' ' ' GLU . . . . . 0.463 ' HG2' HD21 ' B' ' 353' ' ' LEU . 9.2 tp10 -60.65 -53.85 52.4 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.518 -0.31 . . . . 0.0 110.851 -179.859 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 358' ' ' VAL . . . . . . . . . . . . . 59.8 t -62.52 -50.57 79.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.112 -179.936 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 359' ' ' TYR . . . . . . . . . . . . . 65.4 t80 -58.2 -31.01 66.91 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.63 0.253 . . . . 0.0 111.178 -179.719 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 360' ' ' ALA . . . . . . . . . . . . . . . -69.57 -59.7 2.8 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.369 -0.378 . . . . 0.0 111.044 -179.976 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 361' ' ' GLN . . . . . . . . . . . . . 21.7 mt-30 -56.78 -40.59 76.16 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.579 179.861 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 362' ' ' VAL . . . . . . . . . . . . . 74.0 t -66.82 -35.43 74.74 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 115.892 -0.595 . . . . 0.0 110.602 179.708 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 363' ' ' ALA . . . . . 0.51 ' HA ' HD23 ' B' ' 373' ' ' LEU . . . -62.39 -50.2 72.49 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.766 179.742 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 364' ' ' ARG . . . . . . . . . . . . . 57.5 mtp180 -73.54 -21.91 60.24 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.523 179.655 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 365' ' ' LEU . . . . . 0.41 HD12 ' HB1' ' B' ' 327' ' ' ALA . 13.9 tp -61.12 -60.89 3.06 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.86 179.978 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 366' ' ' PHE . . . . . 0.585 ' HB3' ' HB2' ' B' ' 369' ' ' GLN . 47.8 m-85 -74.34 -44.85 50.65 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.989 -179.927 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 367' ' ' LYS . . . . . 0.528 ' C ' ' H ' ' B' ' 369' ' ' GLN . 58.9 tttm 65.37 120.9 0.02 OUTLIER 'General case' 0 N--CA 1.465 0.277 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.706 179.359 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 368' ' ' ASN . . . . . . . . . . . . . 12.1 m120 70.3 -34.04 0.28 Allowed 'General case' 0 N--CA 1.463 0.19 0 CA-C-N 116.048 -0.523 . . . . 0.0 111.31 179.707 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 369' ' ' GLN . . . . . 0.585 ' HB2' ' HB3' ' B' ' 366' ' ' PHE . 15.3 mm100 -66.52 90.57 0.16 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.885 0.374 . . . . 0.0 110.532 179.635 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 370' ' ' GLU . . . . . . . . . . . . . 44.1 mt-10 -90.01 -6.21 55.83 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.996 -0.547 . . . . 0.0 111.012 -179.673 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 371' ' ' ASP . . . . . . . . . . . . . 21.4 t70 -67.09 -47.3 71.63 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.073 0.463 . . . . 0.0 110.258 179.494 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 372' ' ' LEU . . . . . . . . . . . . . 5.6 mp -72.82 -40.53 65.71 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.779 -0.646 . . . . 0.0 110.111 179.358 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 373' ' ' LEU . . . . . 0.51 HD23 ' HA ' ' B' ' 363' ' ' ALA . 1.1 mp -62.3 -36.1 81.09 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.605 -0.725 . . . . 0.0 110.61 179.647 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 374' ' ' SER . . . . . . . . . . . . . 92.0 p -71.02 -48.93 50.19 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.086 179.433 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 375' ' ' GLU . . . . . . . . . . . . . 43.3 mt-10 -62.97 -23.15 67.29 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.143 179.011 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 376' ' ' PHE . . . . . 0.524 ' HB2' ' HH ' ' B' ' 310' ' ' TYR . 76.9 t80 -85.13 -29.05 25.13 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.696 -0.684 . . . . 0.0 110.163 179.529 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 377' ' ' GLY . . . . . . . . . . . . . . . -71.45 -41.89 57.26 Favored Glycine 0 C--N 1.331 0.257 0 C-N-CA 120.836 -0.697 . . . . 0.0 112.006 179.465 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 378' ' ' GLN . . . . . . . . . . . . . 4.3 pt20 -70.69 -28.01 64.44 Favored 'General case' 0 C--N 1.331 -0.196 0 N-CA-C 109.224 -0.658 . . . . 0.0 109.224 179.22 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 379' ' ' PHE . . . . . . . . . . . . . 3.7 t80 -82.34 -22.03 35.74 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 114.926 -1.034 . . . . 0.0 109.744 179.05 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 380' ' ' LEU . . . . . . . . . . . . . 18.8 tp -67.79 141.78 95.16 Favored Pre-proline 0 C--N 1.329 -0.306 0 CA-C-N 115.307 -0.86 . . . . 0.0 110.333 179.483 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 381' ' ' PRO . . . . . 0.5 ' HD3' ' HG3' ' A' ' 373' ' ' MET . 74.0 Cg_exo . . . . . 0 C--N 1.35 0.637 0 C-N-CA 122.187 1.925 . . . . 0.0 112.115 179.911 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 366' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.233 0.191 0 CA-C-O 121.06 0.457 . . . . 0.0 110.81 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 367' ' ' VAL . . . . . . . . . . . . . 23.5 t -65.58 -20.76 27.98 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.697 179.747 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 368' ' ' TYR . . . . . . . . . . . . . 25.7 t80 -71.01 -49.64 42.88 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.017 -179.808 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 369' ' ' VAL . . . . . 0.462 HG23 ' HE2' ' A' ' 373' ' ' MET . 6.5 p -68.46 -44.46 83.2 Favored 'Isoleucine or valine' 0 C--O 1.233 0.217 0 CA-C-N 116.433 -0.349 . . . . 0.0 110.881 179.908 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 370' ' ' LEU . . . . . . . . . . . . . 90.4 mt -60.43 -42.34 95.88 Favored 'General case' 0 C--O 1.233 0.236 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.887 179.807 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 371' ' ' SER . . . . . . . . . . . . . 87.6 p -72.64 -34.94 67.63 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.772 179.863 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 372' ' ' SER . . . . . 0.412 ' HG ' HE22 ' B' ' 339' ' ' GLN . 45.8 t -61.14 -42.81 99.23 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.341 -0.39 . . . . 0.0 111.185 -179.679 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 373' ' ' MET . . . . . 0.462 ' HE2' HG23 ' A' ' 369' ' ' VAL . 22.4 ptp -76.71 -38.4 54.41 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.432 -0.349 . . . . 0.0 111.722 -179.419 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 374' ' ' ALA . . . . . 0.436 ' HB1' ' OE1' ' B' ' 303' ' ' GLU . . . -78.62 -13.15 59.97 Favored 'General case' 0 C--N 1.33 -0.25 0 N-CA-C 112.015 0.376 . . . . 0.0 112.015 -179.421 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 375' ' ' ARG . . . . . . . . . . . . . 22.3 ttp180 -100.5 -32.62 10.7 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.823 0.345 . . . . 0.0 110.768 179.635 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 376' ' ' GLN . . . . . . . . . . . . . 6.5 tp-100 . . . . . 0 C--N 1.331 -0.238 0 CA-C-N 116.121 -0.491 . . . . 0.0 111.181 -179.94 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' B' B ' 302' ' ' VAL . . . . . . . . . . . . . 15.0 p . . . . . 0 C--O 1.231 0.121 0 CA-C-O 120.814 0.34 . . . . 0.0 111.293 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' B' B ' 303' ' ' GLU . . . . . 0.436 ' OE1' ' HB1' ' A' ' 374' ' ' ALA . 55.3 mm-40 -65.04 -51.13 63.27 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.169 -0.468 . . . . 0.0 111.402 -179.465 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 304' ' ' PHE . . . . . . . . . . . . . 85.6 m-85 -59.99 -57.39 13.07 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.329 -179.815 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 305' ' ' ASN . . . . . . . . . . . . . 6.6 t30 -51.07 -55.16 19.0 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.874 -179.279 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 306' ' ' HIS . . . . . . . . . . . . . 12.2 m-70 -61.24 -64.1 1.07 Allowed 'General case' 0 C--N 1.33 -0.267 0 N-CA-C 112.357 0.503 . . . . 0.0 112.357 -178.947 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 307' ' ' ALA . . . . . . . . . . . . . . . -53.08 -57.13 11.47 Favored 'General case' 0 N--CA 1.464 0.245 0 N-CA-C 112.468 0.544 . . . . 0.0 112.468 -178.736 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 308' ' ' ILE . . . . . . . . . . . . . 87.4 mt -53.58 -53.57 24.5 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 N-CA-C 111.985 0.365 . . . . 0.0 111.985 -179.298 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 309' ' ' ASN . . . . . . . . . . . . . 3.0 t-20 -59.46 -30.44 68.52 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.811 0.338 . . . . 0.0 110.951 -179.706 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 310' ' ' TYR . . . . . . . . . . . . . 74.8 t80 -66.99 -51.57 53.43 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.021 -179.78 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 311' ' ' VAL . . . . . . . . . . . . . 46.2 t -61.19 -52.14 64.89 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.224 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.065 -179.832 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 312' ' ' ASN . . . . . . . . . . . . . 27.6 t-20 -59.37 -34.3 72.24 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.339 -0.392 . . . . 0.0 110.976 -179.951 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 313' ' ' LYS . . . . . . . . . . . . . 39.8 tttp -62.41 -63.14 1.32 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.978 179.957 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 314' ' ' ILE . . . . . . . . . . . . . 97.9 mt -60.28 -27.79 40.35 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.352 -179.792 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 315' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -66.5 -46.34 76.6 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.413 -0.358 . . . . 0.0 110.741 -179.969 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 316' ' ' ASN . . . . . . . . . . . . . 6.7 t30 -72.48 -47.45 48.58 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.264 -179.732 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 317' ' ' ARG . . . . . . . . . . . . . 1.4 tmt_? -62.8 -63.9 1.08 Allowed 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.031 -179.836 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 318' ' ' PHE . . . . . . . . . . . . . 87.0 m-85 -85.11 40.93 0.85 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.121 -0.49 . . . . 0.0 111.043 -179.991 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 319' ' ' GLN . . . . . . . . . . . . . 35.0 tt0 -70.07 -22.61 63.04 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.885 -179.981 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 320' ' ' GLY . . . . . . . . . . . . . . . -86.59 -13.61 67.23 Favored Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.833 -0.699 . . . . 0.0 112.726 -179.793 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 321' ' ' GLN . . . . . . . . . . . . . 22.3 mp0 -110.28 93.41 15.69 Favored Pre-proline 0 C--N 1.329 -0.324 0 CA-C-O 120.416 0.151 . . . . 0.0 110.921 -179.928 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 322' ' ' PRO . . . . . . . . . . . . . 92.1 Cg_endo -79.73 -22.86 7.41 Favored 'Trans proline' 0 C--N 1.348 0.517 0 C-N-CA 122.548 2.165 . . . . 0.0 112.38 179.833 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 323' ' ' ASP . . . . . . . . . . . . . 6.0 m-20 -71.09 -48.01 54.89 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.29 -179.569 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 324' ' ' ILE . . . . . . . . . . . . . 64.0 mt -70.23 -43.07 78.98 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.415 -0.357 . . . . 0.0 111.251 -179.881 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 325' ' ' TYR . . . . . . . . . . . . . 30.8 t80 -62.1 -48.14 81.47 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 120.902 0.382 . . . . 0.0 110.75 179.984 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 326' ' ' LYS . . . . . . . . . . . . . 87.3 tttt -62.02 -50.11 73.35 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.824 179.896 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 327' ' ' ALA . . . . . 0.404 ' O ' ' HB2' ' B' ' 330' ' ' GLU . . . -54.45 -43.55 71.74 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.185 179.946 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 328' ' ' PHE . . . . . . . . . . . . . 84.5 t80 -59.39 -57.03 14.79 Favored 'General case' 0 C--O 1.235 0.331 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.569 179.927 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 329' ' ' LEU . . . . . . . . . . . . . 91.3 mt -56.85 -28.52 61.78 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.428 179.658 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 330' ' ' GLU . . . . . 0.404 ' HB2' ' O ' ' B' ' 327' ' ' ALA . 22.5 mm-40 -66.52 -44.47 82.37 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.175 179.217 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 331' ' ' ILE . . . . . . . . . . . . . 71.1 mt -61.33 -39.8 83.94 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.12 0 N-CA-C 109.78 -0.452 . . . . 0.0 109.78 178.828 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 332' ' ' LEU . . . . . . . . . . . . . 1.1 mm? -66.61 -36.22 82.07 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.533 -0.758 . . . . 0.0 110.646 179.5 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 333' ' ' HIS . . . . . . . . . . . . . 47.2 t-80 -67.52 -56.44 9.51 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.671 179.731 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 334' ' ' THR . . . . . . . . . . . . . 35.0 m -59.36 -37.78 78.74 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.805 179.697 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 335' ' ' TYR . . . . . . . . . . . . . 32.2 t80 -60.35 -48.34 82.17 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.473 179.554 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 336' ' ' GLN . . . . . 0.452 ' HB2' ' HB ' ' A' ' 369' ' ' VAL . 54.8 tp60 -60.94 -40.22 92.47 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.477 179.535 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 337' ' ' LYS . . . . . 0.566 ' HB3' ' HZ1' ' B' ' 337' ' ' LYS . 4.7 ttpm? -60.11 -47.7 84.8 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.643 179.683 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 338' ' ' GLU . . . . . . . . . . . . . 61.6 mm-40 -58.78 -42.02 88.03 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.627 179.572 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 339' ' ' GLN . . . . . 0.49 ' HG3' ' HZ3' ' B' ' 343' ' ' LYS . 29.1 tt0 -61.94 -44.79 96.03 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.707 179.844 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 340' ' ' ARG . . . . . . . . . . . . . 99.7 mtt180 -57.05 -53.78 54.25 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.673 179.825 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 341' ' ' ASN . . . . . . . . . . . . . 45.5 t-20 -55.52 -39.89 71.1 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.557 179.86 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 342' ' ' ALA . . . . . . . . . . . . . . . -60.23 -41.99 94.3 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.843 179.863 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 343' ' ' LYS . . . . . 0.49 ' HZ3' ' HG3' ' B' ' 339' ' ' GLN . 14.5 mptt -74.7 -27.19 60.29 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.847 179.706 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 344' ' ' GLU . . . . . . . . . . . . . 20.2 mm-40 -67.94 -40.05 83.37 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.69 179.556 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 345' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.331 -0.236 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.008 179.748 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' B' B ' 351' ' ' PRO . . . . . . . . . . . . . 58.7 Cg_exo . . . . . 0 C--O 1.23 0.12 0 CA-C-O 120.779 0.241 . . . . 0.0 112.297 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' B' B ' 352' ' ' ALA . . . . . . . . . . . . . . . -68.12 -23.17 64.87 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.894 179.848 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 353' ' ' LEU . . . . . 0.486 ' HG ' ' HG2' ' B' ' 357' ' ' GLU . 4.7 mp -131.93 124.11 28.77 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.119 -0.492 . . . . 0.0 111.225 179.848 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 354' ' ' THR . . . . . . . . . . . . . 75.6 p -114.76 -170.73 1.8 Allowed 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.716 -0.675 . . . . 0.0 109.594 178.66 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 355' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 -57.87 -35.98 71.71 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.093 0.473 . . . . 0.0 110.063 179.271 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 356' ' ' GLN . . . . . . . . . . . . . 5.9 tp-100 -73.1 -42.6 62.78 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 115.719 -0.673 . . . . 0.0 111.127 179.97 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 357' ' ' GLU . . . . . 0.486 ' HG2' ' HG ' ' B' ' 353' ' ' LEU . 9.4 tp10 -58.97 -56.14 26.14 Favored 'General case' 0 C--O 1.232 0.176 0 CA-C-N 116.479 -0.328 . . . . 0.0 110.893 -179.779 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 358' ' ' VAL . . . . . . . . . . . . . 47.1 t -59.61 -55.1 26.11 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.115 179.912 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 359' ' ' TYR . . . . . . . . . . . . . 67.2 t80 -54.92 -29.71 56.86 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.566 -0.288 . . . . 0.0 111.457 -179.551 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 360' ' ' ALA . . . . . . . . . . . . . . . -70.38 -60.83 2.04 Favored 'General case' 0 C--O 1.234 0.281 0 CA-C-N 116.439 -0.346 . . . . 0.0 111.494 -179.745 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 361' ' ' GLN . . . . . . . . . . . . . 97.6 mt-30 -55.79 -40.48 72.73 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.925 0.393 . . . . 0.0 110.792 -179.892 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 362' ' ' VAL . . . . . . . . . . . . . 91.2 t -66.38 -38.25 81.39 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.71 179.616 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 363' ' ' ALA . . . . . . . . . . . . . . . -59.42 -42.73 92.53 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 116.257 -0.428 . . . . 0.0 110.383 179.296 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 364' ' ' ARG . . . . . . . . . . . . . 36.3 ttm180 -77.78 -21.99 50.82 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.834 -0.621 . . . . 0.0 110.367 179.264 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 365' ' ' LEU . . . . . . . . . . . . . 10.4 tp -64.26 -29.81 70.89 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.75 -0.659 . . . . 0.0 110.919 179.909 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 366' ' ' PHE . . . . . 0.632 ' HB3' ' HB2' ' B' ' 369' ' ' GLN . 69.4 m-85 -118.32 -59.41 1.89 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.174 -179.824 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 367' ' ' LYS . . . . . . . . . . . . . 39.7 ttpt 68.55 -80.53 0.04 OUTLIER 'General case' 0 N--CA 1.463 0.184 0 CA-C-N 115.948 -0.569 . . . . 0.0 111.595 179.79 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 368' ' ' ASN . . . . . . . . . . . . . 31.2 p-10 -58.47 -17.63 22.44 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.223 -179.477 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 369' ' ' GLN . . . . . 0.632 ' HB2' ' HB3' ' B' ' 366' ' ' PHE . 15.3 mm100 -109.58 97.54 7.08 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.964 -179.999 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 370' ' ' GLU . . . . . . . . . . . . . 44.9 mt-10 -93.91 -11.53 30.81 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.057 179.714 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 371' ' ' ASP . . . . . . . . . . . . . 13.6 m-20 -57.93 -64.12 1.02 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.935 -179.758 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 372' ' ' LEU . . . . . 0.454 HD13 ' H ' ' B' ' 373' ' ' LEU . 0.4 OUTLIER -61.98 -22.57 65.77 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.965 179.824 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' B' B ' 373' ' ' LEU . . . . . 0.454 ' H ' HD13 ' B' ' 372' ' ' LEU . 4.3 tp -68.76 -43.15 76.42 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.3 179.918 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 374' ' ' SER . . . . . . . . . . . . . 53.1 m -69.12 -48.25 62.97 Favored 'General case' 0 C--O 1.236 0.373 0 N-CA-C 109.676 -0.491 . . . . 0.0 109.676 179.053 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 375' ' ' GLU . . . . . . . . . . . . . 42.0 tt0 -56.47 -32.53 65.07 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 115.747 -0.66 . . . . 0.0 109.701 178.989 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 376' ' ' PHE . . . . . . . . . . . . . 93.3 t80 -78.12 -33.44 50.54 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 115.804 -0.635 . . . . 0.0 110.066 179.014 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 377' ' ' GLY . . . . . . . . . . . . . . . -60.52 -36.49 91.45 Favored Glycine 0 N--CA 1.449 -0.467 0 C-N-CA 120.725 -0.75 . . . . 0.0 111.632 179.506 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 378' ' ' GLN . . . . . . . . . . . . . 54.5 mt-30 -56.55 -30.76 63.48 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.666 0.269 . . . . 0.0 110.823 179.464 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 379' ' ' PHE . . . . . . . . . . . . . 78.6 m-85 -66.87 -45.06 79.3 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.392 -0.367 . . . . 0.0 110.85 179.871 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 380' ' ' LEU . . . . . . . . . . . . . 92.5 mt -53.63 132.57 55.4 Favored Pre-proline 0 C--N 1.33 -0.268 0 CA-C-N 116.373 -0.376 . . . . 0.0 110.193 179.451 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 381' ' ' PRO . . . . . 0.409 ' HD3' ' HB2' ' A' ' 373' ' ' MET . 53.4 Cg_exo . . . . . 0 C--N 1.348 0.528 0 C-N-CA 122.263 1.975 . . . . 0.0 112.55 -179.581 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 366' ' ' ALA . . . . . 0.54 ' H ' HG12 ' B' ' 311' ' ' VAL . . . . . . . . 0 C--O 1.234 0.268 0 CA-C-O 121.127 0.489 . . . . 0.0 110.551 . . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 367' ' ' VAL . . . . . 0.642 HG22 ' HB3' ' B' ' 307' ' ' ALA . 8.5 p -47.58 -22.99 0.56 Allowed 'Isoleucine or valine' 0 C--O 1.226 -0.178 0 CA-C-N 115.519 -0.764 . . . . 0.0 111.464 -179.969 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 368' ' ' TYR . . . . . . . . . . . . . 85.6 t80 -61.34 -66.09 0.59 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.896 0.379 . . . . 0.0 110.568 179.548 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 369' ' ' VAL . . . . . 0.496 HG12 ' HB3' ' B' ' 332' ' ' LEU . 4.3 p -58.42 -39.21 73.91 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.622 179.609 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 370' ' ' LEU . . . . . 0.464 HD23 ' HA ' ' B' ' 307' ' ' ALA . 2.7 mp -64.78 -35.91 82.63 Favored 'General case' 0 C--O 1.233 0.222 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.152 179.918 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 371' ' ' SER . . . . . . . . . . . . . 37.6 m -66.56 -44.99 80.82 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.387 -0.369 . . . . 0.0 110.856 -179.935 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 372' ' ' SER . . . . . . . . . . . . . 43.6 t -65.19 -36.28 83.69 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.389 -0.369 . . . . 0.0 110.869 179.724 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 373' ' ' MET . . . . . . . . . . . . . 51.4 ttm -66.0 -43.78 86.74 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.888 -179.42 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 374' ' ' ALA . . . . . . . . . . . . . . . -79.56 -42.16 25.65 Favored 'General case' 0 C--N 1.33 -0.245 0 N-CA-C 112.591 0.589 . . . . 0.0 112.591 -179.023 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 375' ' ' ARG . . . . . 0.46 ' HG2' ' HG2' ' B' ' 303' ' ' GLU . 18.1 mmm180 -66.96 -35.72 80.61 Favored 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 111.905 0.335 . . . . 0.0 111.905 -179.163 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 376' ' ' GLN . . . . . . . . . . . . . 24.1 tp60 . . . . . 0 C--N 1.332 -0.171 0 CA-C-N 116.617 -0.265 . . . . 0.0 111.478 -179.554 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' B' B ' 302' ' ' VAL . . . . . 0.441 HG13 ' N ' ' B' ' 303' ' ' GLU . 4.0 p . . . . . 0 C--O 1.234 0.286 0 CA-C-O 120.81 0.338 . . . . 0.0 111.319 . . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 303' ' ' GLU . . . . . 0.46 ' HG2' ' HG2' ' A' ' 375' ' ' ARG . 0.0 OUTLIER -58.78 -21.84 56.82 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.675 -179.499 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' B' B ' 304' ' ' PHE . . . . . . . . . . . . . 73.4 t80 -55.96 -82.22 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.518 -0.31 . . . . 0.0 110.839 -179.763 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 305' ' ' ASN . . . . . . . . . . . . . 8.7 p30 -62.21 -33.58 74.83 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.459 -179.48 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 306' ' ' HIS . . . . . . . . . . . . . 7.8 t-160 -63.31 -71.02 0.18 Allowed 'General case' 0 C--O 1.233 0.221 0 CA-C-O 120.661 0.267 . . . . 0.0 111.651 -179.163 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 307' ' ' ALA . . . . . 0.642 ' HB3' HG22 ' A' ' 367' ' ' VAL . . . -55.51 -47.93 75.45 Favored 'General case' 0 C--N 1.33 -0.266 0 N-CA-C 112.003 0.372 . . . . 0.0 112.003 -179.062 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 308' ' ' ILE . . . . . . . . . . . . . 22.4 mm -53.07 -57.57 4.41 Favored 'Isoleucine or valine' 0 C--O 1.233 0.226 0 CA-C-O 120.669 0.271 . . . . 0.0 111.444 -179.759 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 309' ' ' ASN . . . . . . . . . . . . . 14.0 m120 -61.27 -26.19 67.6 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.404 -0.362 . . . . 0.0 111.236 -179.623 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 310' ' ' TYR . . . . . 0.656 ' HH ' ' HA ' ' B' ' 372' ' ' LEU . 0.3 OUTLIER -71.4 -50.52 31.18 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.567 -0.288 . . . . 0.0 111.327 -179.838 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' B' B ' 311' ' ' VAL . . . . . 0.54 HG12 ' H ' ' A' ' 366' ' ' ALA . 15.2 t -63.46 -39.0 83.69 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.225 0 CA-C-N 116.506 -0.315 . . . . 0.0 111.071 -179.546 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 312' ' ' ASN . . . . . . . . . . . . . 6.7 t30 -69.39 -41.93 75.82 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.145 -179.95 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 313' ' ' LYS . . . . . 0.456 ' NZ ' ' HB3' ' B' ' 313' ' ' LYS . 0.0 OUTLIER -61.32 -46.42 90.36 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.018 -0.537 . . . . 0.0 111.746 -179.631 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' B' B ' 314' ' ' ILE . . . . . . . . . . . . . 79.9 mt -74.71 -36.45 40.37 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 N-CA-C 111.827 0.306 . . . . 0.0 111.827 -179.248 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 315' ' ' LYS . . . . . . . . . . . . . 1.6 tmmt? -67.24 -30.56 70.5 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.551 -0.295 . . . . 0.0 111.243 -179.656 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 316' ' ' ASN . . . . . . . . . . . . . 46.9 t-20 -88.85 -45.04 10.05 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.52 -0.309 . . . . 0.0 111.086 -179.854 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 317' ' ' ARG . . . . . 0.404 ' C ' ' H ' ' B' ' 319' ' ' GLN . 22.5 tpp180 -68.79 -63.86 0.98 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.423 -0.353 . . . . 0.0 111.124 -179.757 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 318' ' ' PHE . . . . . . . . . . . . . 97.2 m-85 -80.13 27.87 0.31 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.139 -179.827 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 319' ' ' GLN . . . . . 0.404 ' H ' ' C ' ' B' ' 317' ' ' ARG . 7.8 tt0 -61.46 -32.23 72.22 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.914 179.992 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 320' ' ' GLY . . . . . . . . . . . . . . . -74.35 -15.85 80.09 Favored Glycine 0 N--CA 1.45 -0.385 0 C-N-CA 120.873 -0.68 . . . . 0.0 112.637 -179.877 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 321' ' ' GLN . . . . . 0.427 ' HG2' HD11 ' B' ' 324' ' ' ILE . 24.2 tp60 -109.75 92.68 12.81 Favored Pre-proline 0 C--N 1.33 -0.239 0 CA-C-O 120.401 0.143 . . . . 0.0 110.803 179.914 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 322' ' ' PRO . . . . . . . . . . . . . 90.9 Cg_endo -79.66 -19.01 10.25 Favored 'Trans proline' 0 C--N 1.346 0.426 0 C-N-CA 122.604 2.203 . . . . 0.0 112.723 -179.921 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 323' ' ' ASP . . . . . 0.402 ' H ' HE21 ' B' ' 321' ' ' GLN . 25.9 m-20 -70.05 -54.51 12.78 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.389 -0.369 . . . . 0.0 111.217 -179.652 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 324' ' ' ILE . . . . . 0.427 HD11 ' HG2' ' B' ' 321' ' ' GLN . 56.0 mt -62.05 -47.82 91.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.253 -0.43 . . . . 0.0 111.338 -179.871 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 325' ' ' TYR . . . . . . . . . . . . . 18.0 t80 -59.35 -51.6 69.24 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.275 -0.42 . . . . 0.0 111.278 -179.51 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 326' ' ' LYS . . . . . . . . . . . . . 87.8 tttt -55.7 -50.41 70.38 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.37 -0.377 . . . . 0.0 111.28 -179.868 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 327' ' ' ALA . . . . . . . . . . . . . . . -52.75 -50.13 64.08 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.083 -179.998 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 328' ' ' PHE . . . . . . . . . . . . . 51.4 t80 -54.59 -43.72 72.37 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.481 179.893 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 329' ' ' LEU . . . . . . . . . . . . . 86.4 mt -63.07 -36.32 83.18 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.862 -0.608 . . . . 0.0 110.865 179.635 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 330' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -65.09 -37.7 88.35 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.702 179.74 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 331' ' ' ILE . . . . . . . . . . . . . 72.9 mt -66.91 -52.24 46.41 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.12 179.818 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 332' ' ' LEU . . . . . 0.496 ' HB3' HG12 ' A' ' 369' ' ' VAL . 8.4 mp -64.45 -32.89 74.71 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.233 -0.439 . . . . 0.0 111.339 -179.86 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 333' ' ' HIS . . . . . . . . . . . . . 56.7 t-80 -66.02 -57.81 6.93 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.059 0.457 . . . . 0.0 110.032 179.38 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 334' ' ' THR . . . . . . . . . . . . . 10.8 m -60.1 -26.23 66.05 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.252 179.402 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 335' ' ' TYR . . . . . . . . . . . . . 77.4 t80 -65.98 -49.6 67.28 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.011 179.205 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 336' ' ' GLN . . . . . . . . . . . . . 47.6 mm-40 -62.53 -33.57 75.17 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.203 179.088 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 337' ' ' LYS . . . . . . . . . . . . . 37.2 ttpt -63.35 -58.98 5.33 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.986 -0.552 . . . . 0.0 111.251 179.682 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 338' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -63.97 -28.91 70.14 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.35 -0.386 . . . . 0.0 111.383 -179.535 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 339' ' ' GLN . . . . . . . . . . . . . 65.5 tt0 -68.16 -49.83 58.44 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.938 0.399 . . . . 0.0 110.573 179.885 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 340' ' ' ARG . . . . . . . . . . . . . 83.1 mtp180 -63.94 -51.72 63.09 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.74 179.781 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 341' ' ' ASN . . . . . . . . . . . . . 4.6 m-20 -52.32 -47.45 65.99 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.076 -0.511 . . . . 0.0 111.06 179.757 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 342' ' ' ALA . . . . . . . . . . . . . . . -67.84 -31.22 70.9 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.892 179.857 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 343' ' ' LYS . . . . . . . . . . . . . 87.3 tttt -75.9 -20.51 57.97 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.611 179.896 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 344' ' ' GLU . . . . . . . . . . . . . 18.5 mm-40 -84.25 -44.26 14.06 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.966 -0.561 . . . . 0.0 111.06 179.949 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 345' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.33 -0.241 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.982 179.929 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' B' B ' 351' ' ' PRO . . . . . . . . . . . . . 36.2 Cg_exo . . . . . 0 C--O 1.233 0.247 0 CA-C-O 120.775 0.239 . . . . 0.0 112.228 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' B' B ' 352' ' ' ALA . . . . . . . . . . . . . . . -111.97 -55.66 2.48 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.683 -179.612 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 353' ' ' LEU . . . . . . . . . . . . . 5.3 mp -105.99 111.04 23.51 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.902 0.382 . . . . 0.0 111.491 -179.542 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 354' ' ' THR . . . . . . . . . . . . . 60.9 p -95.94 -170.05 2.05 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.259 179.259 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 355' ' ' GLU . . . . . . . . . . . . . 41.2 mt-10 -62.03 -30.05 70.7 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 120.999 0.428 . . . . 0.0 110.38 179.659 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 356' ' ' GLN . . . . . . . . . . . . . 1.6 mp0 -72.9 -43.29 62.64 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.785 -0.643 . . . . 0.0 111.361 -179.889 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 357' ' ' GLU . . . . . . . . . . . . . 8.4 tp10 -55.98 -48.5 75.72 Favored 'General case' 0 C--O 1.233 0.194 0 CA-C-O 120.903 0.382 . . . . 0.0 110.839 -179.636 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 358' ' ' VAL . . . . . 0.413 ' O ' HG21 ' B' ' 362' ' ' VAL . 86.5 t -68.19 -59.0 4.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.019 -0.537 . . . . 0.0 111.559 -179.63 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 359' ' ' TYR . . . . . . . . . . . . . 40.2 t80 -52.43 -29.67 25.62 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.632 -0.258 . . . . 0.0 111.655 -179.01 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 360' ' ' ALA . . . . . . . . . . . . . . . -74.09 -60.68 2.15 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.847 0.356 . . . . 0.0 111.178 -179.943 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 361' ' ' GLN . . . . . . . . . . . . . 49.9 mt-30 -54.25 -36.96 64.15 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.466 179.842 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 362' ' ' VAL . . . . . 0.413 HG21 ' O ' ' B' ' 358' ' ' VAL . 87.9 t -72.06 -37.79 61.38 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-N 115.868 -0.605 . . . . 0.0 110.341 179.332 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 363' ' ' ALA . . . . . 0.555 ' HA ' HD13 ' B' ' 373' ' ' LEU . . . -57.86 -38.36 75.56 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.572 179.694 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 364' ' ' ARG . . . . . . . . . . . . . 63.3 mtm180 -90.73 -19.35 23.64 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.861 -0.609 . . . . 0.0 110.779 179.519 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 365' ' ' LEU . . . . . . . . . . . . . 24.4 tp -58.16 -37.76 75.32 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.049 -0.523 . . . . 0.0 111.511 -179.705 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 366' ' ' PHE . . . . . . . . . . . . . 75.5 m-85 -98.13 164.25 12.41 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.918 0.39 . . . . 0.0 111.425 -179.504 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 367' ' ' LYS . . . . . 0.451 ' C ' ' H ' ' B' ' 369' ' ' GLN . 65.7 mttm -96.06 87.71 4.64 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.951 -179.893 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 368' ' ' ASN . . . . . . . . . . . . . 2.4 m-20 62.05 -0.49 0.46 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.683 179.675 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 369' ' ' GLN . . . . . 0.451 ' H ' ' C ' ' B' ' 367' ' ' LYS . 8.5 tp60 -63.69 102.84 0.49 Allowed 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.827 0.346 . . . . 0.0 110.158 179.752 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 370' ' ' GLU . . . . . . . . . . . . . 46.3 tt0 -91.82 -25.56 18.94 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.132 -0.485 . . . . 0.0 111.823 -179.048 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 371' ' ' ASP . . . . . . . . . . . . . 19.0 m-20 -49.36 -63.51 1.08 Allowed 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.879 0.371 . . . . 0.0 110.812 -179.989 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 372' ' ' LEU . . . . . 0.656 ' HA ' ' HH ' ' B' ' 310' ' ' TYR . 7.4 mp -55.44 -45.66 76.78 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.695 179.273 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 373' ' ' LEU . . . . . 0.555 HD13 ' HA ' ' B' ' 363' ' ' ALA . 1.2 mp -59.22 -27.13 65.46 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.74 -0.664 . . . . 0.0 111.459 -179.729 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 374' ' ' SER . . . . . . . . . . . . . 67.4 m -77.92 -57.84 3.58 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.84 0.352 . . . . 0.0 110.82 -179.83 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 375' ' ' GLU . . . . . 0.46 ' HB2' ' OH ' ' B' ' 310' ' ' TYR . 10.8 mm-40 -59.87 -28.67 67.74 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.077 -0.511 . . . . 0.0 110.309 179.807 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 376' ' ' PHE . . . . . 0.516 ' HA ' ' HB2' ' B' ' 379' ' ' PHE . 79.2 t80 -83.1 -33.44 26.35 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.144 179.3 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 377' ' ' GLY . . . . . . . . . . . . . . . -60.1 -43.16 98.58 Favored Glycine 0 N--CA 1.45 -0.417 0 C-N-CA 120.747 -0.739 . . . . 0.0 111.384 179.249 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 378' ' ' GLN . . . . . . . . . . . . . 25.2 mm-40 -79.53 -18.04 52.73 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.105 0.479 . . . . 0.0 109.988 179.075 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 379' ' ' PHE . . . . . 0.516 ' HB2' ' HA ' ' B' ' 376' ' ' PHE . 0.6 OUTLIER -63.78 -29.33 70.55 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.642 -0.708 . . . . 0.0 110.287 179.621 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' B' B ' 380' ' ' LEU . . . . . . . . . . . . . 42.2 mt -62.93 153.0 81.95 Favored Pre-proline 0 C--N 1.33 -0.242 0 CA-C-N 115.715 -0.675 . . . . 0.0 110.989 -179.87 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 381' ' ' PRO . . . . . . . . . . . . . 55.0 Cg_endo . . . . . 0 C--N 1.347 0.474 0 C-N-CA 122.544 2.163 . . . . 0.0 112.301 179.97 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 366' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.234 0.269 0 CA-C-O 120.929 0.395 . . . . 0.0 110.735 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 367' ' ' VAL . . . . . . . . . . . . . 41.4 t -57.88 -30.2 37.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 115.797 -0.638 . . . . 0.0 110.648 179.688 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 368' ' ' TYR . . . . . . . . . . . . . 84.1 t80 -67.36 -37.11 82.71 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.099 -0.501 . . . . 0.0 110.464 179.578 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 369' ' ' VAL . . . . . . . . . . . . . 10.9 t -68.63 -56.57 11.82 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 115.87 -0.605 . . . . 0.0 110.788 179.704 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 370' ' ' LEU . . . . . 0.486 ' HB2' ' HB3' ' B' ' 307' ' ' ALA . 94.5 mt -58.21 -40.42 81.55 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.925 -0.58 . . . . 0.0 111.092 -179.854 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 371' ' ' SER . . . . . 0.528 ' HA ' ' HB3' ' B' ' 303' ' ' GLU . 84.1 p -60.97 -59.12 5.88 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.092 -179.913 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 372' ' ' SER . . . . . . . . . . . . . 47.1 t -54.54 -33.87 60.82 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.789 0.328 . . . . 0.0 111.201 -179.835 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 373' ' ' MET . . . . . . . . . . . . . 53.9 ttm -64.14 -48.31 76.54 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.515 -179.811 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 374' ' ' ALA . . . . . 0.532 ' HB1' ' HG3' ' B' ' 303' ' ' GLU . . . -87.05 -6.14 58.82 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.488 -0.324 . . . . 0.0 111.852 -179.519 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 375' ' ' ARG . . . . . 0.538 ' HB2' ' HG2' ' B' ' 303' ' ' GLU . 29.6 ttt180 -91.94 -31.17 15.74 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.874 0.369 . . . . 0.0 110.932 -179.861 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 376' ' ' GLN . . . . . . . . . . . . . 52.4 tt0 . . . . . 0 C--N 1.33 -0.246 0 CA-C-N 116.004 -0.544 . . . . 0.0 111.779 -179.31 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' B' B ' 302' ' ' VAL . . . . . 0.436 HG12 ' N ' ' B' ' 303' ' ' GLU . 2.5 p . . . . . 0 C--O 1.233 0.218 0 CA-C-O 120.814 0.34 . . . . 0.0 111.4 . . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 303' ' ' GLU . . . . . 0.538 ' HG2' ' HB2' ' A' ' 375' ' ' ARG . 2.4 mp0 -73.7 -43.75 58.41 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.259 -0.428 . . . . 0.0 112.134 -179.244 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 304' ' ' PHE . . . . . . . . . . . . . 54.6 m-85 -62.18 -39.92 94.29 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.712 0.292 . . . . 0.0 111.365 -179.589 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 305' ' ' ASN . . . . . . . . . . . . . 6.8 t30 -71.54 -47.31 55.91 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.48 -179.626 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 306' ' ' HIS . . . . . . . . . . . . . 18.5 t-160 -65.51 -40.76 93.38 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.792 0.33 . . . . 0.0 111.214 -179.559 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 307' ' ' ALA . . . . . 0.486 ' HB3' ' HB2' ' A' ' 370' ' ' LEU . . . -65.95 -51.8 55.36 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.685 -179.406 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 308' ' ' ILE . . . . . 0.415 HD11 ' O ' ' B' ' 308' ' ' ILE . 0.0 OUTLIER -58.93 -43.08 87.81 Favored 'Isoleucine or valine' 0 C--O 1.233 0.23 0 CA-C-O 120.724 0.297 . . . . 0.0 110.685 -179.827 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' B' B ' 309' ' ' ASN . . . . . . . . . . . . . 27.0 t-20 -67.32 -30.04 69.77 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.619 179.622 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 310' ' ' TYR . . . . . 0.612 ' HH ' ' HB2' ' B' ' 376' ' ' PHE . 56.8 t80 -66.11 -52.01 52.65 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.806 179.872 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 311' ' ' VAL . . . . . . . . . . . . . 47.3 t -61.53 -44.0 97.86 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.2 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.83 179.798 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 312' ' ' ASN . . . . . . . . . . . . . 23.5 t-20 -63.74 -33.8 76.47 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.817 179.777 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 313' ' ' LYS . . . . . 0.512 ' HZ3' ' HB3' ' B' ' 372' ' ' LEU . 1.1 tmmt? -64.96 -50.7 65.37 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.895 -179.975 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 314' ' ' ILE . . . . . . . . . . . . . 66.4 mt -71.76 -25.2 23.94 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.264 -179.881 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 315' ' ' LYS . . . . . 0.575 ' HB2' ' HH ' ' B' ' 325' ' ' TYR . 1.5 tmmt? -71.73 -39.74 69.89 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.875 -179.884 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 316' ' ' ASN . . . . . . . . . . . . . 27.2 t-20 -80.67 -41.68 23.34 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.293 -179.882 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 317' ' ' ARG . . . . . . . . . . . . . 29.1 tpt180 -68.68 -61.89 1.62 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.04 -179.806 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 318' ' ' PHE . . . . . . . . . . . . . 76.4 m-85 -83.67 31.56 0.47 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.089 -179.938 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 319' ' ' GLN . . . . . . . . . . . . . 6.5 tp-100 -62.1 -20.63 64.25 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.264 -0.426 . . . . 0.0 110.646 179.779 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 320' ' ' GLY . . . . . . . . . . . . . . . -92.52 -13.33 57.2 Favored Glycine 0 C--N 1.33 0.204 0 C-N-CA 120.928 -0.653 . . . . 0.0 112.502 179.968 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 321' ' ' GLN . . . . . . . . . . . . . 15.9 mm100 -108.79 92.75 10.96 Favored Pre-proline 0 C--N 1.329 -0.292 0 CA-C-O 120.548 0.213 . . . . 0.0 110.637 179.819 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 322' ' ' PRO . . . . . . . . . . . . . 98.3 Cg_endo -78.97 -26.57 5.24 Favored 'Trans proline' 0 C--N 1.347 0.48 0 C-N-CA 122.537 2.158 . . . . 0.0 112.603 -179.792 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 323' ' ' ASP . . . . . . . . . . . . . 15.7 t70 -68.9 -54.9 12.96 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.123 -179.715 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 324' ' ' ILE . . . . . . . . . . . . . 80.2 mt -64.18 -43.74 97.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.37 -179.949 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 325' ' ' TYR . . . . . 0.575 ' HH ' ' HB2' ' B' ' 315' ' ' LYS . 16.3 t80 -60.4 -44.67 95.45 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.718 -179.975 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 326' ' ' LYS . . . . . . . . . . . . . 63.8 tttp -63.29 -50.89 68.33 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.969 179.977 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 327' ' ' ALA . . . . . . . . . . . . . . . -51.86 -49.77 62.25 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.134 -179.951 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 328' ' ' PHE . . . . . . . . . . . . . 69.8 t80 -56.02 -52.92 62.51 Favored 'General case' 0 C--O 1.237 0.401 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.519 179.826 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 329' ' ' LEU . . . . . . . . . . . . . 89.9 mt -61.12 -24.19 66.07 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.815 -0.629 . . . . 0.0 110.754 179.8 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 330' ' ' GLU . . . . . . . . . . . . . 16.3 mm-40 -75.92 -34.27 59.89 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.562 179.49 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 331' ' ' ILE . . . . . . . . . . . . . 80.9 mt -68.89 -44.2 81.84 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.207 0 CA-C-N 116.204 -0.453 . . . . 0.0 109.995 179.183 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 332' ' ' LEU . . . . . . . . . . . . . 45.7 mt -69.31 -39.32 78.33 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.802 -0.636 . . . . 0.0 111.007 179.684 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 333' ' ' HIS . . . . . . . . . . . . . 68.9 t60 -63.69 -51.61 64.29 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.762 179.96 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 334' ' ' THR . . . . . 0.461 HG23 ' HZ3' ' B' ' 337' ' ' LYS . 42.1 m -62.28 -35.58 79.46 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.732 179.793 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 335' ' ' TYR . . . . . . . . . . . . . 61.0 t80 -59.31 -62.36 1.94 Allowed 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.075 -0.512 . . . . 0.0 110.825 179.731 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 336' ' ' GLN . . . . . . . . . . . . . 26.0 tp60 -54.15 -42.93 70.14 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.121 -0.49 . . . . 0.0 111.391 -179.683 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 337' ' ' LYS . . . . . 0.625 ' HB3' ' HZ1' ' B' ' 337' ' ' LYS . 6.4 ttpm? -53.83 -54.62 35.86 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.892 0.377 . . . . 0.0 111.005 -179.816 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 338' ' ' GLU . . . . . . . . . . . . . 41.6 mt-10 -62.76 -31.58 72.56 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.032 -179.8 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 339' ' ' GLN . . . . . . . . . . . . . 15.8 mm100 -64.99 -47.67 76.7 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.846 0.355 . . . . 0.0 110.546 179.55 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 340' ' ' ARG . . . . . . . . . . . . . 96.0 mtt180 -59.59 -51.39 70.03 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.269 179.38 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 341' ' ' ASN . . . . . . . . . . . . . 2.3 m-20 -59.51 -31.94 69.84 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.366 179.568 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 342' ' ' ALA . . . . . . . . . . . . . . . -70.68 -33.32 70.79 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.938 179.896 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 343' ' ' LYS . . . . . . . . . . . . . 61.3 mttp -79.03 -27.81 43.24 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.882 179.843 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 344' ' ' GLU . . . . . . . . . . . . . 19.9 mm-40 -74.99 -45.31 42.84 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.048 -179.924 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 345' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.33 -0.281 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.991 179.989 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' B' B ' 351' ' ' PRO . . . . . . . . . . . . . 51.6 Cg_exo . . . . . 0 C--O 1.232 0.191 0 CA-C-O 120.716 0.215 . . . . 0.0 112.218 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' B' B ' 352' ' ' ALA . . . . . . . . . . . . . . . -81.1 -61.4 1.97 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.564 -179.539 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 353' ' ' LEU . . . . . 0.479 ' HB2' ' HB3' ' B' ' 357' ' ' GLU . 0.2 OUTLIER -106.68 131.6 53.63 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 121.012 0.434 . . . . 0.0 111.414 -179.588 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' B' B ' 354' ' ' THR . . . . . . . . . . . . . 65.2 p -113.84 -160.84 0.74 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.827 -0.624 . . . . 0.0 110.662 179.868 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 355' ' ' GLU . . . . . . . . . . . . . 41.5 mt-10 -57.17 -28.02 62.43 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.412 -0.358 . . . . 0.0 110.876 179.755 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 356' ' ' GLN . . . . . . . . . . . . . 23.6 tm0? -69.86 -50.01 46.82 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.044 -0.525 . . . . 0.0 111.008 -179.77 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 357' ' ' GLU . . . . . 0.479 ' HB3' ' HB2' ' B' ' 353' ' ' LEU . 7.1 tp10 -64.43 -36.97 85.91 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.484 -0.325 . . . . 0.0 110.979 -179.673 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 358' ' ' VAL . . . . . . . . . . . . . 48.7 t -64.12 -59.85 3.63 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.981 179.973 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 359' ' ' TYR . . . . . . . . . . . . . 37.3 t80 -59.59 -30.1 68.43 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.474 -0.33 . . . . 0.0 111.331 -179.534 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 360' ' ' ALA . . . . . . . . . . . . . . . -69.75 -60.49 2.28 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.69 0.281 . . . . 0.0 111.324 -179.646 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 361' ' ' GLN . . . . . . . . . . . . . 76.8 mt-30 -56.19 -44.88 79.86 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.235 -0.438 . . . . 0.0 110.903 179.99 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 362' ' ' VAL . . . . . . . . . . . . . 64.2 t -64.63 -35.39 74.62 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.716 179.759 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 363' ' ' ALA . . . . . 0.509 ' HA ' HD13 ' B' ' 373' ' ' LEU . . . -61.69 -42.83 99.46 Favored 'General case' 0 CA--C 1.521 -0.171 0 CA-C-O 120.955 0.407 . . . . 0.0 110.263 179.327 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 364' ' ' ARG . . . . . . . . . . . . . 68.2 ttt180 -81.55 -18.23 45.65 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.877 -0.601 . . . . 0.0 110.201 179.42 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 365' ' ' LEU . . . . . . . . . . . . . 8.1 tp -60.96 -25.52 66.88 Favored 'General case' 0 C--O 1.232 0.164 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.381 179.659 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 366' ' ' PHE . . . . . . . . . . . . . 60.4 m-85 -125.97 162.21 25.75 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.142 179.546 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 367' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -115.61 -87.8 0.59 Allowed 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 120.753 0.311 . . . . 0.0 111.596 -179.408 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 368' ' ' ASN . . . . . 0.554 ' N ' HD21 ' B' ' 368' ' ' ASN . 0.8 OUTLIER -79.74 -0.95 36.42 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.443 -0.344 . . . . 0.0 111.276 -179.513 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' B' B ' 369' ' ' GLN . . . . . . . . . . . . . 46.9 mt-30 -98.44 84.24 3.17 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.393 -0.367 . . . . 0.0 111.218 -179.896 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 370' ' ' GLU . . . . . . . . . . . . . 44.7 mt-10 -93.9 -6.01 46.6 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.759 179.671 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 371' ' ' ASP . . . . . . . . . . . . . 19.9 t70 -57.71 -62.03 2.09 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.004 -179.812 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 372' ' ' LEU . . . . . 0.512 ' HB3' ' HZ3' ' B' ' 313' ' ' LYS . 0.3 OUTLIER -64.32 -22.51 66.97 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.257 -0.428 . . . . 0.0 111.114 179.87 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' B' B ' 373' ' ' LEU . . . . . 0.509 HD13 ' HA ' ' B' ' 363' ' ' ALA . 5.3 tp -71.53 -38.12 71.11 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.535 -179.793 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 374' ' ' SER . . . . . . . . . . . . . 48.9 m -73.66 -48.27 33.59 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.08 -0.509 . . . . 0.0 109.767 179.074 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 375' ' ' GLU . . . . . . . . . . . . . 8.5 tp10 -55.58 -38.52 69.48 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.677 -0.692 . . . . 0.0 109.813 179.133 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 376' ' ' PHE . . . . . 0.612 ' HB2' ' HH ' ' B' ' 310' ' ' TYR . 76.0 t80 -75.2 -32.73 61.29 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 115.861 -0.609 . . . . 0.0 109.903 179.15 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 377' ' ' GLY . . . . . . . . . . . . . . . -60.11 -33.11 78.18 Favored Glycine 0 N--CA 1.449 -0.486 0 C-N-CA 120.606 -0.807 . . . . 0.0 111.259 179.054 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 378' ' ' GLN . . . . . . . . . . . . . 26.8 mm-40 -67.98 -31.92 71.96 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.751 0.31 . . . . 0.0 110.881 179.318 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 379' ' ' PHE . . . . . 0.433 ' HB2' ' O ' ' B' ' 376' ' ' PHE . 15.1 m-85 -56.57 -41.13 76.39 Favored 'General case' 0 C--N 1.334 -0.105 0 CA-C-N 116.319 -0.4 . . . . 0.0 110.943 179.71 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 380' ' ' LEU . . . . . . . . . . . . . 96.0 mt -56.38 131.1 76.16 Favored Pre-proline 0 C--N 1.329 -0.302 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.633 179.824 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 381' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_exo . . . . . 0 C--N 1.347 0.473 0 C-N-CA 122.355 2.037 . . . . 0.0 112.337 -179.955 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 366' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.232 0.146 0 CA-C-O 121.013 0.435 . . . . 0.0 110.686 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 367' ' ' VAL . . . . . . . . . . . . . 61.8 t -53.7 -31.23 19.71 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 115.706 -0.679 . . . . 0.0 111.452 -179.885 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 368' ' ' TYR . . . . . . . . . . . . . 65.8 m-85 -60.39 -50.4 73.75 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.758 0.313 . . . . 0.0 111.32 -179.929 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 369' ' ' VAL . . . . . 0.539 HG13 ' HG2' ' B' ' 336' ' ' GLN . 24.0 t -67.93 -52.35 40.27 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.568 -179.534 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 370' ' ' LEU . . . . . 0.518 HD13 ' HA ' ' B' ' 307' ' ' ALA . 86.9 mt -55.93 -46.51 78.45 Favored 'General case' 0 C--O 1.235 0.341 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.215 -179.808 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 371' ' ' SER . . . . . . . . . . . . . 45.8 t -60.04 -59.42 5.45 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.089 -179.949 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 372' ' ' SER . . . . . . . . . . . . . 50.6 m -51.06 -35.02 32.48 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.459 -0.337 . . . . 0.0 111.468 -179.616 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 373' ' ' MET . . . . . . . . . . . . . 54.1 tpp -65.0 -56.18 14.63 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.419 -0.355 . . . . 0.0 111.599 -179.441 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 374' ' ' ALA . . . . . 0.474 ' HB2' ' OE1' ' B' ' 303' ' ' GLU . . . -80.96 -6.15 58.38 Favored 'General case' 0 C--N 1.33 -0.267 0 N-CA-C 112.256 0.465 . . . . 0.0 112.256 -178.885 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 375' ' ' ARG . . . . . . . . . . . . . 32.7 tpt180 -96.65 -27.31 14.85 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 120.611 0.243 . . . . 0.0 111.263 -179.688 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 376' ' ' GLN . . . . . . . . . . . . . 7.5 mm100 . . . . . 0 C--N 1.329 -0.285 0 CA-C-N 116.466 -0.334 . . . . 0.0 111.435 -179.961 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' B' B ' 302' ' ' VAL . . . . . . . . . . . . . 7.3 p . . . . . 0 C--O 1.233 0.196 0 CA-C-O 120.793 0.33 . . . . 0.0 111.296 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' B' B ' 303' ' ' GLU . . . . . 0.474 ' OE1' ' HB2' ' A' ' 374' ' ' ALA . 55.8 mm-40 -70.33 -45.58 65.9 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.178 -0.464 . . . . 0.0 111.41 -179.44 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 304' ' ' PHE . . . . . . . . . . . . . 89.7 m-85 -64.35 -50.24 68.52 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.098 -179.7 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 305' ' ' ASN . . . . . . . . . . . . . 27.7 t-20 -58.18 -54.47 46.58 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.436 -179.613 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 306' ' ' HIS . . . . . . . . . . . . . 9.8 m-70 -59.48 -61.26 2.76 Favored 'General case' 0 C--N 1.331 -0.234 0 N-CA-C 112.012 0.375 . . . . 0.0 112.012 -179.327 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 307' ' ' ALA . . . . . 0.518 ' HA ' HD13 ' A' ' 370' ' ' LEU . . . -52.7 -60.52 3.15 Favored 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 112.492 0.553 . . . . 0.0 112.492 -178.798 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 308' ' ' ILE . . . . . . . . . . . . . 90.9 mt -51.55 -54.28 12.9 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.218 0 N-CA-C 111.647 0.24 . . . . 0.0 111.647 -179.26 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 309' ' ' ASN . . . . . 0.562 HD21 ' N ' ' B' ' 309' ' ' ASN . 0.8 OUTLIER -62.52 -24.07 67.3 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.456 -0.338 . . . . 0.0 111.09 -179.744 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' B' B ' 310' ' ' TYR . . . . . . . . . . . . . 34.3 t80 -69.3 -58.92 3.4 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.424 -0.353 . . . . 0.0 111.093 -179.693 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 311' ' ' VAL . . . . . 0.435 ' O ' ' HG3' ' B' ' 315' ' ' LYS . 27.1 t -58.94 -44.83 91.84 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.117 0 CA-C-O 120.816 0.341 . . . . 0.0 110.514 179.9 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 312' ' ' ASN . . . . . . . . . . . . . 2.9 t-20 -57.96 -41.59 83.19 Favored 'General case' 0 C--O 1.232 0.179 0 CA-C-O 121.005 0.431 . . . . 0.0 110.631 179.641 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 313' ' ' LYS . . . . . . . . . . . . . 37.4 tttt -59.06 -60.01 4.55 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.771 -0.649 . . . . 0.0 111.123 179.703 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 314' ' ' ILE . . . . . . . . . . . . . 19.9 mt -59.61 -27.47 37.68 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 115.778 -0.646 . . . . 0.0 111.708 -179.04 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 315' ' ' LYS . . . . . 0.503 ' HZ2' ' HB2' ' B' ' 315' ' ' LYS . 8.7 mtmp? -71.59 -40.4 69.9 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.805 0.335 . . . . 0.0 110.805 179.681 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 316' ' ' ASN . . . . . . . . . . . . . 58.8 t30 -84.75 -12.88 52.81 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.772 179.912 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 317' ' ' ARG . . . . . 0.404 HH21 HE22 ' B' ' 369' ' ' GLN . 29.8 tpt180 -90.3 -66.63 0.91 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.798 179.814 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 318' ' ' PHE . . . . . . . . . . . . . 96.7 m-85 -88.28 39.68 0.92 Allowed 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.788 179.862 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 319' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -61.13 -9.17 4.23 Favored 'General case' 0 N--CA 1.45 -0.467 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.532 -179.785 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 320' ' ' GLY . . . . . . . . . . . . . . . -96.23 -40.25 4.04 Favored Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.83 -0.7 . . . . 0.0 112.901 179.968 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 321' ' ' GLN . . . . . . . . . . . . . 6.2 tp-100 -105.88 98.08 17.19 Favored Pre-proline 0 C--N 1.33 -0.242 0 CA-C-O 120.418 0.151 . . . . 0.0 110.925 -179.82 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 322' ' ' PRO . . . . . . . . . . . . . 93.2 Cg_endo -80.43 -13.36 12.27 Favored 'Trans proline' 0 C--N 1.348 0.552 0 C-N-CA 122.472 2.115 . . . . 0.0 112.533 179.913 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 323' ' ' ASP . . . . . . . . . . . . . 14.7 t70 -65.87 -55.11 18.73 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.007 179.992 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 324' ' ' ILE . . . . . . . . . . . . . 61.1 mt -63.32 -37.93 80.81 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.936 179.899 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 325' ' ' TYR . . . . . . . . . . . . . 55.7 t80 -60.21 -58.39 8.71 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.657 179.766 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 326' ' ' LYS . . . . . . . . . . . . . 38.2 ttmt -58.89 -40.76 85.39 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.835 -0.62 . . . . 0.0 110.993 179.994 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 327' ' ' ALA . . . . . . . . . . . . . . . -55.47 -50.48 69.76 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-O 120.891 0.376 . . . . 0.0 110.991 -179.917 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 328' ' ' PHE . . . . . . . . . . . . . 24.4 t80 -57.42 -57.46 12.56 Favored 'General case' 0 C--O 1.239 0.504 0 CA-C-O 121.334 0.587 . . . . 0.0 110.189 179.637 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 329' ' ' LEU . . . . . . . . . . . . . 10.5 mp -59.13 -20.31 52.55 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.523 -0.762 . . . . 0.0 110.904 -179.989 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 330' ' ' GLU . . . . . . . . . . . . . 21.8 mt-10 -77.84 -35.68 50.85 Favored 'General case' 0 C--N 1.332 -0.158 0 N-CA-C 109.829 -0.434 . . . . 0.0 109.829 178.825 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 331' ' ' ILE . . . . . . . . . . . . . 96.8 mt -64.93 -44.25 96.16 Favored 'Isoleucine or valine' 0 C--O 1.233 0.189 0 N-CA-C 109.312 -0.625 . . . . 0.0 109.312 178.524 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 332' ' ' LEU . . . . . 0.421 ' O ' ' HB3' ' B' ' 335' ' ' TYR . 8.9 mp -68.62 -41.03 80.06 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.621 -0.718 . . . . 0.0 110.783 179.225 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 333' ' ' HIS . . . . . . . . . . . . . 42.5 t-80 -59.68 -53.93 52.3 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.309 179.752 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 334' ' ' THR . . . . . . . . . . . . . 93.1 m -60.92 -33.16 72.72 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.277 179.143 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 335' ' ' TYR . . . . . 0.526 ' HH ' ' HG2' ' B' ' 355' ' ' GLU . 74.2 t80 -55.65 -65.35 0.61 Allowed 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.646 179.463 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 336' ' ' GLN . . . . . 0.539 ' HG2' HG13 ' A' ' 369' ' ' VAL . 63.9 mm-40 -65.18 -22.3 66.88 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.36 -0.382 . . . . 0.0 111.018 179.846 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 337' ' ' LYS . . . . . . . . . . . . . 61.0 tttp -61.32 -65.67 0.66 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.382 -0.372 . . . . 0.0 110.424 179.695 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 338' ' ' GLU . . . . . . . . . . . . . 42.9 mt-10 -63.51 -33.88 76.55 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.53 179.53 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 339' ' ' GLN . . . . . . . . . . . . . 7.7 tp60 -57.38 -53.91 52.75 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.532 179.609 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 340' ' ' ARG . . . . . . . . . . . . . 99.7 mtt180 -59.28 -50.87 72.33 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.372 179.484 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 341' ' ' ASN . . . . . . . . . . . . . 13.8 m120 -56.09 -26.82 51.15 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.861 179.637 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 342' ' ' ALA . . . . . . . . . . . . . . . -74.44 -46.7 38.23 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.056 179.948 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 343' ' ' LYS . . . . . . . . . . . . . 14.2 mptt -76.37 -12.63 60.09 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.068 179.738 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 344' ' ' GLU . . . . . . . . . . . . . 23.2 mm-40 -89.08 -40.92 12.61 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.925 179.742 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 345' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.331 -0.215 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.936 179.937 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' B' B ' 351' ' ' PRO . . . . . . . . . . . . . 26.3 Cg_exo . . . . . 0 C--O 1.232 0.193 0 CA-C-O 120.807 0.253 . . . . 0.0 112.334 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' B' B ' 352' ' ' ALA . . . . . . . . . . . . . . . -104.38 -71.11 0.75 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.486 -179.911 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 353' ' ' LEU . . . . . 0.544 ' HB3' ' HG2' ' B' ' 357' ' ' GLU . 0.3 OUTLIER -92.6 145.7 24.23 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 121.464 0.649 . . . . 0.0 112.398 -179.392 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' B' B ' 354' ' ' THR . . . . . . . . . . . . . 81.4 p -115.14 -166.65 1.14 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.447 -0.797 . . . . 0.0 110.333 179.34 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 355' ' ' GLU . . . . . 0.526 ' HG2' ' HH ' ' B' ' 335' ' ' TYR . 37.5 mt-10 -59.89 -33.09 71.38 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 121.155 0.503 . . . . 0.0 110.271 179.418 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 356' ' ' GLN . . . . . . . . . . . . . 26.2 mp0 -70.17 -44.81 67.99 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.695 -0.684 . . . . 0.0 111.176 -179.78 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 357' ' ' GLU . . . . . 0.544 ' HG2' ' HB3' ' B' ' 353' ' ' LEU . 6.5 tp10 -61.68 -44.0 97.78 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-O 120.706 0.289 . . . . 0.0 110.534 -179.984 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 358' ' ' VAL . . . . . . . . . . . . . 87.0 t -59.76 -54.57 32.79 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.633 179.499 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 359' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -60.99 -28.03 68.73 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.864 -179.869 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 360' ' ' ALA . . . . . . . . . . . . . . . -72.4 -60.98 1.96 Allowed 'General case' 0 C--O 1.233 0.22 0 CA-C-N 116.41 -0.359 . . . . 0.0 111.273 -179.767 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 361' ' ' GLN . . . . . 0.405 ' O ' ' HB2' ' B' ' 365' ' ' LEU . 47.3 mt-30 -58.96 -34.0 71.28 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.438 179.855 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 362' ' ' VAL . . . . . . . . . . . . . 11.5 t -69.99 -40.16 78.26 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 115.826 -0.625 . . . . 0.0 110.785 179.577 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 363' ' ' ALA . . . . . 0.586 ' HA ' HD23 ' B' ' 373' ' ' LEU . . . -62.14 -38.73 90.09 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.39 179.488 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 364' ' ' ARG . . . . . . . . . . . . . 64.9 ttt180 -83.63 -19.35 35.59 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.252 179.141 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 365' ' ' LEU . . . . . 0.405 ' HB2' ' O ' ' B' ' 361' ' ' GLN . 13.2 tp -58.89 -34.62 71.87 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.853 -179.959 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 366' ' ' PHE . . . . . 0.481 ' HB3' ' HB2' ' B' ' 369' ' ' GLN . 59.7 m-85 -117.25 164.66 14.48 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.732 179.983 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 367' ' ' LYS . . . . . . . . . . . . . 60.9 mttp -116.54 -75.15 0.58 Allowed 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.931 179.915 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 368' ' ' ASN . . . . . . . . . . . . . 15.9 m120 -87.48 -3.98 59.0 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.78 -179.956 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 369' ' ' GLN . . . . . 0.481 ' HB2' ' HB3' ' B' ' 366' ' ' PHE . 17.7 mm-40 -97.3 83.01 3.22 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.025 -179.867 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 370' ' ' GLU . . . . . . . . . . . . . 40.2 tt0 -93.41 -15.61 25.47 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.629 179.648 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 371' ' ' ASP . . . . . . . . . . . . . 7.3 m-20 -55.36 -39.13 69.71 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.94 -0.573 . . . . 0.0 111.122 -179.9 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 372' ' ' LEU . . . . . . . . . . . . . 6.1 mp -71.3 -38.88 71.73 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.772 179.844 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 373' ' ' LEU . . . . . 0.586 HD23 ' HA ' ' B' ' 363' ' ' ALA . 3.0 mp -56.74 -50.52 71.99 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.997 -0.547 . . . . 0.0 111.028 179.885 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 374' ' ' SER . . . . . . . . . . . . . 41.7 t -69.6 -48.0 61.58 Favored 'General case' 0 C--O 1.235 0.329 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.616 179.651 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 375' ' ' GLU . . . . . 0.408 ' O ' ' HG2' ' B' ' 378' ' ' GLN . 40.9 tt0 -54.67 -29.63 53.29 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 115.857 -0.611 . . . . 0.0 110.108 179.642 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 376' ' ' PHE . . . . . 0.441 ' O ' ' HB2' ' B' ' 379' ' ' PHE . 90.4 t80 -87.18 -27.68 22.88 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.934 -0.576 . . . . 0.0 110.004 178.71 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 377' ' ' GLY . . . . . . . . . . . . . . . -61.41 -38.67 96.12 Favored Glycine 0 N--CA 1.45 -0.376 0 C-N-CA 120.884 -0.674 . . . . 0.0 112.342 179.749 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 378' ' ' GLN . . . . . 0.408 ' HG2' ' O ' ' B' ' 375' ' ' GLU . 13.4 pt20 -63.31 -26.6 68.84 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.524 0.202 . . . . 0.0 111.053 179.731 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 379' ' ' PHE . . . . . 0.441 ' HB2' ' O ' ' B' ' 376' ' ' PHE . 29.3 m-85 -62.02 -33.96 75.32 Favored 'General case' 0 C--N 1.333 -0.122 0 CA-C-N 116.607 -0.269 . . . . 0.0 110.855 179.681 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 380' ' ' LEU . . . . . . . . . . . . . 79.3 mt -53.95 133.77 58.04 Favored Pre-proline 0 C--N 1.33 -0.26 0 CA-C-N 116.334 -0.393 . . . . 0.0 110.328 179.938 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 381' ' ' PRO . . . . . . . . . . . . . 64.1 Cg_exo . . . . . 0 C--N 1.347 0.483 0 C-N-CA 122.434 2.089 . . . . 0.0 112.353 -179.596 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 366' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.234 0.289 0 CA-C-O 121.095 0.474 . . . . 0.0 110.538 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 367' ' ' VAL . . . . . . . . . . . . . 18.4 t -57.97 -28.38 33.5 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 115.707 -0.679 . . . . 0.0 110.541 179.521 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 368' ' ' TYR . . . . . . . . . . . . . 46.1 t80 -70.16 -33.95 72.41 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.452 179.747 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 369' ' ' VAL . . . . . 0.508 HG23 ' HB2' ' B' ' 336' ' ' GLN . 20.7 t -71.48 -52.8 23.75 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.784 179.795 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 370' ' ' LEU . . . . . 0.417 HD11 ' HA ' ' B' ' 307' ' ' ALA . 87.7 mt -62.74 -41.2 99.07 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.831 -0.622 . . . . 0.0 111.183 -179.848 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 371' ' ' SER . . . . . 0.513 ' HG ' ' H ' ' A' ' 372' ' ' SER . 84.3 p -62.81 -55.78 23.29 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.768 179.901 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 372' ' ' SER . . . . . 0.513 ' H ' ' HG ' ' A' ' 371' ' ' SER . 69.1 m -53.03 -39.65 63.34 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.921 179.998 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 373' ' ' MET . . . . . . . . . . . . . 55.3 ttm -62.42 -43.07 99.7 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.768 179.779 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 374' ' ' ALA . . . . . . . . . . . . . . . -83.18 -8.44 59.49 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.557 -179.972 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 375' ' ' ARG . . . . . 0.551 ' HA ' ' HE ' ' A' ' 375' ' ' ARG . 4.1 mmp_? -102.62 -13.73 17.01 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.491 -0.322 . . . . 0.0 111.174 -179.854 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 376' ' ' GLN . . . . . 0.416 ' HB3' ' HG3' ' B' ' 381' ' ' PRO . 44.4 tt0 . . . . . 0 C--N 1.329 -0.293 0 CA-C-N 116.321 -0.4 . . . . 0.0 110.727 -179.956 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 302' ' ' VAL . . . . . . . . . . . . . 28.5 m . . . . . 0 C--O 1.233 0.187 0 CA-C-O 120.913 0.387 . . . . 0.0 110.95 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' B' B ' 303' ' ' GLU . . . . . . . . . . . . . 40.5 mt-10 -55.6 -82.88 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.75 -0.659 . . . . 0.0 111.877 -179.212 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 304' ' ' PHE . . . . . . . . . . . . . 79.6 m-85 -57.56 -39.71 77.33 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.788 -179.067 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 305' ' ' ASN . . . . . . . . . . . . . 22.5 t-20 -53.68 -69.34 0.12 Allowed 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 111.86 0.318 . . . . 0.0 111.86 -179.1 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 306' ' ' HIS . . . . . . . . . . . . . 13.4 m-70 -61.94 -53.97 48.32 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.185 -0.461 . . . . 0.0 112.243 -178.697 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 307' ' ' ALA . . . . . 0.417 ' HA ' HD11 ' A' ' 370' ' ' LEU . . . -52.3 -61.96 1.94 Allowed 'General case' 0 C--N 1.33 -0.242 0 N-CA-C 112.372 0.508 . . . . 0.0 112.372 -178.904 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 308' ' ' ILE . . . . . . . . . . . . . 86.1 mt -55.4 -54.54 24.1 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.231 0 N-CA-C 111.809 0.3 . . . . 0.0 111.809 -179.346 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 309' ' ' ASN . . . . . . . . . . . . . 39.2 t-20 -54.05 -29.91 45.92 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-O 120.899 0.38 . . . . 0.0 111.042 -179.554 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 310' ' ' TYR . . . . . 0.449 ' O ' ' HG3' ' B' ' 313' ' ' LYS . 8.6 t80 -70.86 -61.77 1.64 Allowed 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.073 -179.729 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 311' ' ' VAL . . . . . . . . . . . . . 38.4 t -59.09 -22.09 21.17 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-O 120.922 0.392 . . . . 0.0 110.656 179.875 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 312' ' ' ASN . . . . . . . . . . . . . 41.1 t30 -73.53 -57.38 4.04 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.534 -179.893 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 313' ' ' LYS . . . . . 0.449 ' HG3' ' O ' ' B' ' 310' ' ' TYR . 0.0 OUTLIER -62.46 -27.98 69.49 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 116.323 -0.399 . . . . 0.0 111.327 -179.55 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' B' B ' 314' ' ' ILE . . . . . . . . . . . . . 92.8 mt -77.43 -44.98 29.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.497 -0.32 . . . . 0.0 111.177 179.737 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 315' ' ' LYS . . . . . . . . . . . . . 27.4 ttpp -69.25 -24.74 64.03 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.223 -179.65 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 316' ' ' ASN . . . . . . . . . . . . . 6.7 t30 -85.8 -57.59 2.99 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.321 -0.399 . . . . 0.0 111.247 -179.694 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 317' ' ' ARG . . . . . . . . . . . . . 21.4 tpp180 -65.33 -59.56 3.91 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.058 -179.801 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 318' ' ' PHE . . . . . . . . . . . . . 90.3 m-85 -83.49 40.26 0.71 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.213 -0.448 . . . . 0.0 110.853 -179.89 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 319' ' ' GLN . . . . . . . . . . . . . 17.7 tt0 -71.76 -7.38 47.82 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.042 -0.527 . . . . 0.0 110.884 -179.864 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 320' ' ' GLY . . . . . . . . . . . . . . . -107.23 1.14 35.1 Favored Glycine 0 N--CA 1.452 -0.26 0 C-N-CA 120.658 -0.782 . . . . 0.0 112.83 -179.758 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 321' ' ' GLN . . . . . . . . . . . . . 27.7 mm-40 -112.5 88.49 11.13 Favored Pre-proline 0 C--N 1.33 -0.261 0 CA-C-O 120.491 0.186 . . . . 0.0 110.89 179.969 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 322' ' ' PRO . . . . . . . . . . . . . 73.9 Cg_endo -74.15 -29.46 9.78 Favored 'Trans proline' 0 C--N 1.347 0.475 0 C-N-CA 122.625 2.217 . . . . 0.0 112.654 -179.815 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 323' ' ' ASP . . . . . . . . . . . . . 13.8 t70 -68.87 -51.02 44.78 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.332 -0.395 . . . . 0.0 111.084 -179.647 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 324' ' ' ILE . . . . . . . . . . . . . 73.3 mt -68.23 -44.16 84.22 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.16 179.943 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 325' ' ' TYR . . . . . . . . . . . . . 35.3 t80 -58.04 -53.44 58.23 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.855 -179.826 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 326' ' ' LYS . . . . . 0.415 ' O ' ' HG3' ' B' ' 330' ' ' GLU . 86.1 tttt -60.09 -58.44 8.54 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.372 -179.865 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 327' ' ' ALA . . . . . 0.411 ' HB2' HD12 ' B' ' 365' ' ' LEU . . . -45.69 -53.07 9.9 Favored 'General case' 0 C--O 1.234 0.248 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.592 -179.654 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 328' ' ' PHE . . . . . . . . . . . . . 52.2 t80 -54.01 -53.52 51.84 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.146 0.498 . . . . 0.0 110.649 179.947 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 329' ' ' LEU . . . . . . . . . . . . . 84.6 mt -60.5 -24.38 65.26 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.712 -0.676 . . . . 0.0 110.984 179.891 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 330' ' ' GLU . . . . . 0.415 ' HG3' ' O ' ' B' ' 326' ' ' LYS . 48.0 mt-10 -76.17 -33.38 59.35 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.569 179.587 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 331' ' ' ILE . . . . . 0.484 HG21 HG23 ' B' ' 358' ' ' VAL . 76.8 mt -70.77 -44.53 76.2 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.222 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.275 179.378 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 332' ' ' LEU . . . . . . . . . . . . . 30.1 mt -69.34 -39.91 77.85 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.987 179.569 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 333' ' ' HIS . . . . . . . . . . . . . 53.5 t-80 -62.84 -54.04 44.87 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.977 0.418 . . . . 0.0 110.378 179.641 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 334' ' ' THR . . . . . . . . . . . . . 70.7 m -60.0 -33.69 72.32 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.361 179.545 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 335' ' ' TYR . . . . . . . . . . . . . 74.7 t80 -61.35 -48.18 82.49 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.664 179.518 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 336' ' ' GLN . . . . . 0.508 ' HB2' HG23 ' A' ' 369' ' ' VAL . 20.6 tt0 -60.75 -46.5 90.21 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.742 179.727 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 337' ' ' LYS . . . . . . . . . . . . . 41.0 ttmt -57.34 -43.08 83.12 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.031 -0.531 . . . . 0.0 111.008 179.985 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 338' ' ' GLU . . . . . . . . . . . . . 29.8 mm-40 -68.04 -36.84 80.57 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.378 -179.664 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 339' ' ' GLN . . . . . . . . . . . . . 27.0 mm-40 -66.41 -44.33 83.26 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.744 0.307 . . . . 0.0 110.837 179.949 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 340' ' ' ARG . . . . . . . . . . . . . 99.7 mtt180 -62.76 -54.11 44.02 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.738 179.895 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 341' ' ' ASN . . . . . . . . . . . . . 2.7 m-20 -57.52 -44.95 85.49 Favored 'General case' 0 C--O 1.234 0.249 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.947 179.865 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 342' ' ' ALA . . . . . . . . . . . . . . . -63.8 -30.22 71.33 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.846 179.881 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 343' ' ' LYS . . . . . . . . . . . . . 26.8 ttpp -76.1 -31.29 58.63 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.64 179.756 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 344' ' ' GLU . . . . . . . . . . . . . 22.7 mm-40 -69.63 -55.24 10.59 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.03 -0.532 . . . . 0.0 111.076 179.939 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 345' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.33 -0.258 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.814 179.997 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' B' B ' 351' ' ' PRO . . . . . . . . . . . . . 52.7 Cg_exo . . . . . 0 C--O 1.231 0.14 0 CA-C-O 120.821 0.259 . . . . 0.0 112.262 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' B' B ' 352' ' ' ALA . . . . . . . . . . . . . . . -93.48 -23.05 18.51 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.163 -179.82 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 353' ' ' LEU . . . . . 0.521 ' HB3' ' HG2' ' B' ' 357' ' ' GLU . 0.2 OUTLIER -159.15 140.31 12.9 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 121.229 0.538 . . . . 0.0 111.743 179.91 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' B' B ' 354' ' ' THR . . . . . . . . . . . . . 60.4 p -114.63 -167.09 1.17 Allowed 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.754 -0.657 . . . . 0.0 110.744 179.733 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 355' ' ' GLU . . . . . . . . . . . . . 42.7 mt-10 -56.8 -27.62 60.15 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.957 0.408 . . . . 0.0 110.521 179.547 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 356' ' ' GLN . . . . . . . . . . . . . 87.8 mt-30 -70.55 -49.53 47.08 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.814 -0.63 . . . . 0.0 111.115 -179.828 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 357' ' ' GLU . . . . . 0.521 ' HG2' ' HB3' ' B' ' 353' ' ' LEU . 7.0 tp10 -62.7 -44.06 97.21 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.103 -179.634 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 358' ' ' VAL . . . . . 0.484 HG23 HG21 ' B' ' 331' ' ' ILE . 95.1 t -62.32 -58.08 9.17 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.351 -0.386 . . . . 0.0 111.29 -179.911 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 359' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -58.81 -31.55 68.56 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.523 -179.246 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 360' ' ' ALA . . . . . . . . . . . . . . . -72.16 -60.9 2.0 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.729 0.299 . . . . 0.0 111.252 -179.811 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 361' ' ' GLN . . . . . . . . . . . . . 97.6 mt-30 -55.37 -35.7 65.55 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 121.045 0.45 . . . . 0.0 110.348 179.555 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 362' ' ' VAL . . . . . . . . . . . . . 14.4 t -70.82 -36.85 66.24 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 CA-C-N 115.734 -0.666 . . . . 0.0 110.485 179.316 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 363' ' ' ALA . . . . . 0.599 ' HA ' HD22 ' B' ' 373' ' ' LEU . . . -63.13 -38.33 90.75 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.735 179.903 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 364' ' ' ARG . . . . . . . . . . . . . 36.1 ttt180 -88.71 -18.14 28.48 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.793 179.73 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 365' ' ' LEU . . . . . 0.411 HD12 ' HB2' ' B' ' 327' ' ' ALA . 20.7 tp -56.22 -64.86 0.72 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.019 -0.537 . . . . 0.0 111.011 -179.861 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 366' ' ' PHE . . . . . . . . . . . . . 74.0 m-85 -71.56 167.83 18.89 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.024 -0.535 . . . . 0.0 111.096 -179.675 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 367' ' ' LYS . . . . . . . . . . . . . 35.1 mmtp -82.18 75.32 9.11 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.955 -179.796 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 368' ' ' ASN . . . . . . . . . . . . . 85.3 m-20 58.92 10.42 1.54 Allowed 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.11 -0.496 . . . . 0.0 111.356 179.967 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 369' ' ' GLN . . . . . . . . . . . . . 83.0 mm-40 -61.02 113.25 2.44 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.785 0.326 . . . . 0.0 110.852 179.979 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 370' ' ' GLU . . . . . . . . . . . . . 9.7 tp10 -91.25 -26.77 18.84 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.218 -0.447 . . . . 0.0 110.862 179.916 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 371' ' ' ASP . . . . . . . . . . . . . 18.0 t70 -56.6 -54.6 44.12 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.69 179.91 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 372' ' ' LEU . . . . . . . . . . . . . 6.4 mp -65.17 -43.26 92.29 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.777 179.81 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 373' ' ' LEU . . . . . 0.599 HD22 ' HA ' ' B' ' 363' ' ' ALA . 2.1 mp -56.69 -34.53 67.49 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.926 179.789 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 374' ' ' SER . . . . . . . . . . . . . 59.7 m -75.97 -56.25 4.84 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.627 -179.948 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 375' ' ' GLU . . . . . . . . . . . . . 10.1 mm-40 -50.9 -33.53 24.58 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.599 179.647 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 376' ' ' PHE . . . . . 0.407 ' HB2' ' OH ' ' B' ' 310' ' ' TYR . 79.4 t80 -80.76 -38.77 28.02 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.426 179.55 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 377' ' ' GLY . . . . . . . . . . . . . . . -58.61 -28.61 62.84 Favored Glycine 0 N--CA 1.448 -0.519 0 C-N-CA 120.653 -0.784 . . . . 0.0 111.928 179.583 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 378' ' ' GLN . . . . . . . . . . . . . 50.3 mt-30 -61.31 -35.62 77.88 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.729 0.299 . . . . 0.0 110.807 179.603 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 379' ' ' PHE . . . . . . . . . . . . . 68.2 m-85 -58.96 -40.38 84.56 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.772 179.766 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 380' ' ' LEU . . . . . . . . . . . . . 48.7 mt -51.32 131.92 33.24 Favored Pre-proline 0 C--N 1.331 -0.221 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.441 179.907 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 381' ' ' PRO . . . . . 0.416 ' HG3' ' HB3' ' A' ' 376' ' ' GLN . 76.3 Cg_exo . . . . . 0 C--N 1.348 0.529 0 C-N-CA 122.235 1.956 . . . . 0.0 112.234 -179.806 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 358' ' ' ASP . . . . . . . . . . . . . 17.5 t70 . . . . . 0 N--CA 1.487 1.385 0 CA-C-O 120.796 0.331 . . . . 0.0 111.094 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 359' ' ' PHE . . . . . . . . . . . . . 88.8 t80 -138.47 138.61 38.26 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.088 -179.82 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 360' ' ' THR . . . . . . . . . . . . . 69.4 p -133.67 104.69 11.91 Favored Pre-proline 0 C--N 1.33 -0.252 0 CA-C-N 115.967 -0.561 . . . . 0.0 110.69 179.686 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 361' ' ' PRO . . . . . . . . . . . . . 28.0 Cg_endo -62.18 -170.34 0.08 OUTLIER 'Trans proline' 0 C--N 1.349 0.562 0 C-N-CA 122.449 2.099 . . . . 0.0 112.534 -179.704 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 362' ' ' MET . . . . . . . . . . . . . 26.4 ttt -66.7 -11.18 53.18 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.813 179.979 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 363' ' ' ASP . . . . . . . . . . . . . 18.6 m-20 62.3 21.93 12.84 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.014 -179.908 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 364' ' ' SER . . . . . . . . . . . . . 48.1 t -128.38 -83.89 0.58 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.001 179.994 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 365' ' ' SER . . . . . . . . . . . . . 69.9 m -161.1 19.28 0.12 Allowed 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.985 -179.697 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 366' ' ' ALA . . . . . . . . . . . . . . . -56.16 -40.59 74.1 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.307 -179.924 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 367' ' ' VAL . . . . . . . . . . . . . 16.4 m -62.63 -26.39 40.52 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.152 179.831 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 368' ' ' TYR . . . . . . . . . . . . . 42.6 t80 -73.36 -54.92 7.15 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.251 -0.432 . . . . 0.0 111.169 -179.825 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 369' ' ' VAL . . . . . 0.513 HG12 HD21 ' A' ' 370' ' ' LEU . 7.7 p -57.99 -42.22 82.13 Favored 'Isoleucine or valine' 0 C--O 1.232 0.169 0 CA-C-O 120.782 0.325 . . . . 0.0 110.799 -179.992 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 370' ' ' LEU . . . . . 0.513 HD21 HG12 ' A' ' 369' ' ' VAL . 2.7 mm? -63.16 -46.38 87.45 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 121.011 0.434 . . . . 0.0 110.124 179.093 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 371' ' ' SER . . . . . . . . . . . . . 30.6 t -64.78 -24.21 67.48 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 115.843 -0.617 . . . . 0.0 110.641 179.36 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 372' ' ' SER . . . . . . . . . . . . . 46.6 t -72.59 -50.37 25.87 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.678 -179.972 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 373' ' ' MET . . . . . . . . . . . . . 66.4 mtt -62.02 -41.08 97.7 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.75 179.652 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 374' ' ' ALA . . . . . . . . . . . . . . . -65.71 -55.77 15.59 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.089 -0.505 . . . . 0.0 112.021 -179.329 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 375' ' ' ARG . . . . . . . . . . . . . 25.3 mmm180 -60.08 -44.6 94.65 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.506 -0.315 . . . . 0.0 111.668 -179.509 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 376' ' ' GLN . . . . . . . . . . . . . 24.2 mm-40 -66.89 -10.06 44.51 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.431 -0.35 . . . . 0.0 111.812 -179.407 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 377' ' ' ARG . . . . . 0.523 ' HA ' ' H ' ' B' ' 382' ' ' ASP . 79.7 ttt180 -67.9 123.82 21.63 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.681 0.277 . . . . 0.0 110.646 179.977 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 378' ' ' ARG . . . . . 0.408 ' O ' ' HG3' ' A' ' 378' ' ' ARG . 28.5 tpt180 61.69 10.56 3.44 Favored 'General case' 0 CA--C 1.531 0.234 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.839 -179.933 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 379' ' ' ALA . . . . . . . . . . . . . . . -98.51 161.72 13.53 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.149 180.0 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 380' ' ' SER . . . . . . . . . . . . . 47.4 t . . . . . 0 C--O 1.249 1.05 0 CA-C-O 118.207 -0.902 . . . . 0.0 111.024 179.968 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' B' B ' 295' ' ' SER . . . . . . . . . . . . . 47.3 t . . . . . 0 N--CA 1.486 1.364 0 CA-C-O 120.787 0.327 . . . . 0.0 110.914 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' B' B ' 296' ' ' LEU . . . . . 0.411 HD22 ' N ' ' B' ' 296' ' ' LEU . 3.2 mm? -102.79 178.26 4.62 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.719 179.96 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 297' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -112.89 -178.69 3.45 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.033 179.924 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 298' ' ' ASN . . . . . . . . . . . . . 37.1 m-80 -145.07 -20.11 0.5 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.922 -179.946 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 299' ' ' ASN . . . . . . . . . . . . . 7.6 t30 -89.78 125.73 35.41 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.963 -179.871 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 300' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 57.25 72.9 0.85 Allowed Pre-proline 0 C--N 1.331 -0.236 0 CA-C-N 115.971 -0.559 . . . . 0.0 111.079 179.825 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 301' ' ' PRO . . . . . 0.481 ' HB2' ' HB2' ' B' ' 304' ' ' PHE . 92.1 Cg_endo -80.33 117.84 3.52 Favored 'Trans proline' 0 C--N 1.347 0.48 0 C-N-CA 122.52 2.147 . . . . 0.0 111.987 179.453 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 302' ' ' VAL . . . . . 0.564 HG22 ' H ' ' B' ' 303' ' ' GLU . 5.1 m -91.98 -59.23 3.08 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.819 -179.456 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 303' ' ' GLU . . . . . 0.564 ' H ' HG22 ' B' ' 302' ' ' VAL . 10.6 pt-20 -57.33 -39.63 76.29 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 111.761 0.282 . . . . 0.0 111.761 -179.152 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 304' ' ' PHE . . . . . 0.481 ' HB2' ' HB2' ' B' ' 301' ' ' PRO . 81.5 m-85 -60.22 -77.08 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 112.048 0.388 . . . . 0.0 112.048 -179.217 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 305' ' ' ASN . . . . . . . . . . . . . 37.5 t30 -50.47 -45.36 56.12 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 112.779 0.659 . . . . 0.0 112.779 -178.596 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 306' ' ' HIS . . . . . 0.4 ' HB2' ' O ' ' B' ' 302' ' ' VAL . 0.4 OUTLIER -64.39 -64.87 0.77 Allowed 'General case' 0 C--N 1.33 -0.27 0 N-CA-C 112.315 0.487 . . . . 0.0 112.315 -178.418 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 307' ' ' ALA . . . . . . . . . . . . . . . -54.88 -48.69 72.67 Favored 'General case' 0 N--CA 1.464 0.27 0 N-CA-C 112.183 0.438 . . . . 0.0 112.183 -178.929 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 308' ' ' ILE . . . . . . . . . . . . . 97.6 mt -55.66 -54.19 28.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-O 120.707 0.289 . . . . 0.0 111.097 -179.889 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 309' ' ' ASN . . . . . 0.515 ' N ' HD21 ' B' ' 309' ' ' ASN . 0.9 OUTLIER -63.45 -22.34 66.83 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.436 -0.347 . . . . 0.0 110.99 179.985 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 310' ' ' TYR . . . . . 0.569 ' HH ' ' HB2' ' B' ' 376' ' ' PHE . 64.0 t80 -70.4 -61.11 1.9 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.218 -0.447 . . . . 0.0 110.826 179.887 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 311' ' ' VAL . . . . . . . . . . . . . 50.6 t -62.37 -28.39 44.55 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.771 179.823 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 312' ' ' ASN . . . . . . . . . . . . . 26.8 t-20 -69.18 -55.32 10.98 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.379 -179.873 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 313' ' ' LYS . . . . . 0.554 ' HG3' ' N ' ' B' ' 314' ' ' ILE . 40.5 pttt -58.18 -43.61 87.61 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.377 -0.374 . . . . 0.0 111.345 -179.542 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 314' ' ' ILE . . . . . 0.554 ' N ' ' HG3' ' B' ' 313' ' ' LYS . 96.0 mt -68.66 -34.97 67.86 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.437 -0.347 . . . . 0.0 111.368 -179.473 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 315' ' ' LYS . . . . . . . . . . . . . 22.4 ttmm -66.65 -37.17 84.24 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.822 0.344 . . . . 0.0 110.711 179.648 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 316' ' ' ASN . . . . . . . . . . . . . 25.4 t-20 -83.61 -21.45 32.54 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.978 -179.836 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 317' ' ' ARG . . . . . . . . . . . . . 21.9 tpt180 -75.92 -65.84 0.86 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.994 -179.998 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 318' ' ' PHE . . . . . . . . . . . . . 99.1 m-85 -91.24 35.66 0.93 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.933 179.991 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 319' ' ' GLN . . . . . . . . . . . . . 19.1 pt20 -58.34 -18.27 26.2 Favored 'General case' 0 N--CA 1.449 -0.519 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.17 179.905 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 320' ' ' GLY . . . . . . . . . . . . . . . -96.03 -22.66 19.61 Favored Glycine 0 N--CA 1.451 -0.347 0 C-N-CA 120.805 -0.712 . . . . 0.0 112.58 179.937 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 321' ' ' GLN . . . . . 0.616 HE21 ' HB2' ' B' ' 323' ' ' ASP . 48.8 tp60 -109.0 96.2 19.85 Favored Pre-proline 0 C--N 1.33 -0.26 0 CA-C-O 120.465 0.174 . . . . 0.0 110.825 -179.946 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 322' ' ' PRO . . . . . . . . . . . . . 87.8 Cg_endo -81.76 -12.25 11.11 Favored 'Trans proline' 0 C--N 1.348 0.511 0 C-N-CA 122.625 2.217 . . . . 0.0 112.847 -179.735 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 323' ' ' ASP . . . . . 0.616 ' HB2' HE21 ' B' ' 321' ' ' GLN . 9.6 m-20 -70.29 -55.69 8.59 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.517 -0.311 . . . . 0.0 111.168 -179.788 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 324' ' ' ILE . . . . . . . . . . . . . 58.8 mt -65.46 -37.37 79.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.277 -0.42 . . . . 0.0 111.065 -179.774 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 325' ' ' TYR . . . . . . . . . . . . . 28.1 t80 -64.05 -50.09 69.78 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.592 179.971 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 326' ' ' LYS . . . . . 0.4 ' O ' ' HG3' ' B' ' 330' ' ' GLU . 38.9 ttmt -61.04 -38.66 86.94 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.035 -0.529 . . . . 0.0 110.692 179.613 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 327' ' ' ALA . . . . . 0.416 ' HB3' HD23 ' B' ' 365' ' ' LEU . . . -58.87 -54.96 41.24 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.916 179.905 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 328' ' ' PHE . . . . . . . . . . . . . 90.0 t80 -53.59 -49.96 66.65 Favored 'General case' 0 C--O 1.235 0.29 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.613 179.726 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 329' ' ' LEU . . . . . . . . . . . . . 96.4 mt -58.0 -35.53 71.36 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.96 179.892 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 330' ' ' GLU . . . . . 0.4 ' HG3' ' O ' ' B' ' 326' ' ' LYS . 41.7 mt-10 -67.83 -34.84 77.52 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.617 179.652 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 331' ' ' ILE . . . . . . . . . . . . . 74.2 mt -65.65 -49.77 75.62 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.197 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.751 179.565 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 332' ' ' LEU . . . . . 0.454 ' HB3' HG11 ' A' ' 369' ' ' VAL . 5.2 mp -67.22 -30.56 70.51 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.359 -0.382 . . . . 0.0 111.104 179.939 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 333' ' ' HIS . . . . . . . . . . . . . 49.7 t-80 -65.26 -55.7 16.94 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.872 0.368 . . . . 0.0 110.279 179.565 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 334' ' ' THR . . . . . 0.418 HG23 HD12 ' B' ' 353' ' ' LEU . 77.6 m -63.18 -36.52 83.9 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.337 179.486 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 335' ' ' TYR . . . . . . . . . . . . . 87.9 t80 -66.92 -33.21 75.1 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.311 179.435 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 336' ' ' GLN . . . . . . . . . . . . . 8.1 tt0 -68.58 -49.7 57.38 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.84 -0.618 . . . . 0.0 110.66 179.815 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 337' ' ' LYS . . . . . 0.491 ' O ' ' HG2' ' B' ' 340' ' ' ARG . 39.1 ttpt -62.83 -36.89 84.69 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.068 179.955 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 338' ' ' GLU . . . . . . . . . . . . . 18.9 mm-40 -71.15 -32.53 69.07 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.974 0.416 . . . . 0.0 110.238 179.345 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 339' ' ' GLN . . . . . . . . . . . . . 58.4 tt0 -72.24 -43.3 64.59 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.798 -0.637 . . . . 0.0 110.736 179.512 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 340' ' ' ARG . . . . . 0.559 ' HG3' ' N ' ' B' ' 341' ' ' ASN . 36.3 ptt180 -63.74 -53.64 47.84 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 121.015 0.436 . . . . 0.0 110.772 179.933 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 341' ' ' ASN . . . . . 0.559 ' N ' ' HG3' ' B' ' 340' ' ' ARG . 51.1 t-20 -55.8 -51.98 65.58 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.677 -0.692 . . . . 0.0 110.837 179.502 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 342' ' ' ALA . . . . . . . . . . . . . . . -58.73 -32.76 69.51 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.015 179.897 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 343' ' ' LYS . . . . . . . . . . . . . 62.5 tttm -70.53 -38.28 74.19 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.948 179.882 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 344' ' ' GLU . . . . . . . . . . . . . 20.8 mm-40 -78.29 -22.75 47.76 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.056 -179.899 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 345' ' ' ALA . . . . . . . . . . . . . . . -76.66 -41.12 46.79 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.095 -179.967 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 346' ' ' GLY . . . . . . . . . . . . . . . 116.44 -69.08 0.28 Allowed Glycine 0 N--CA 1.451 -0.331 0 C-N-CA 120.761 -0.733 . . . . 0.0 112.504 -179.98 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 347' ' ' GLY . . . . . . . . . . . . . . . -172.34 -13.77 0.02 OUTLIER Glycine 0 N--CA 1.452 -0.293 0 C-N-CA 120.712 -0.756 . . . . 0.0 112.662 179.974 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 348' ' ' ASN . . . . . . . . . . . . . 2.0 m-20 -77.35 -0.72 26.71 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.852 0.358 . . . . 0.0 110.822 179.931 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 349' ' ' TYR . . . . . . . . . . . . . 60.0 t80 -95.29 150.36 20.34 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.807 -179.937 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 350' ' ' THR . . . . . . . . . . . . . 81.7 m -112.29 95.02 29.03 Favored Pre-proline 0 C--N 1.329 -0.303 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.981 179.981 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 351' ' ' PRO . . . . . . . . . . . . . 50.1 Cg_exo -54.35 133.89 58.4 Favored 'Trans proline' 0 C--N 1.348 0.512 0 C-N-CA 122.556 2.17 . . . . 0.0 112.529 179.928 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 352' ' ' ALA . . . . . . . . . . . . . . . -68.83 -54.34 16.31 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.838 179.838 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 353' ' ' LEU . . . . . 0.418 HD12 HG23 ' B' ' 334' ' ' THR . 7.7 mp -107.42 131.23 54.5 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.989 -0.55 . . . . 0.0 111.068 179.972 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 354' ' ' THR . . . . . . . . . . . . . 71.2 p -113.64 -177.39 3.12 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.64 179.601 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 355' ' ' GLU . . . . . . . . . . . . . 48.0 mt-10 -56.53 -35.79 68.48 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.953 0.406 . . . . 0.0 110.669 179.823 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 356' ' ' GLN . . . . . . . . . . . . . 15.4 mm100 -74.28 -34.2 63.47 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.824 -0.625 . . . . 0.0 111.217 -179.907 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 357' ' ' GLU . . . . . 0.412 ' HG2' ' HG ' ' B' ' 353' ' ' LEU . 5.2 tp10 -63.71 -47.81 79.62 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.865 0.365 . . . . 0.0 110.513 -179.966 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 358' ' ' VAL . . . . . 0.428 ' O ' HG22 ' B' ' 362' ' ' VAL . 93.7 t -67.52 -55.31 17.66 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.334 -179.933 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 359' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER -53.34 -37.81 62.68 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.575 0.226 . . . . 0.0 111.29 -179.332 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 360' ' ' ALA . . . . . . . . . . . . . . . -67.12 -60.8 2.31 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.589 -0.278 . . . . 0.0 111.396 -179.784 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 361' ' ' GLN . . . . . . . . . . . . . 97.2 mt-30 -52.96 -45.44 67.76 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.341 -0.39 . . . . 0.0 110.81 179.918 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 362' ' ' VAL . . . . . 0.428 HG22 ' O ' ' B' ' 358' ' ' VAL . 99.1 t -62.02 -38.75 81.55 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.224 -0.443 . . . . 0.0 110.386 179.371 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 363' ' ' ALA . . . . . . . . . . . . . . . -65.97 -28.05 68.61 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.503 179.484 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 364' ' ' ARG . . . . . . . . . . . . . 61.1 ttp180 -84.63 -26.98 27.47 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.905 -0.588 . . . . 0.0 110.544 179.5 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 365' ' ' LEU . . . . . 0.416 HD23 ' HB3' ' B' ' 327' ' ' ALA . 1.2 mp -61.99 -37.43 84.78 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.022 -0.536 . . . . 0.0 110.675 179.758 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 366' ' ' PHE . . . . . . . . . . . . . 20.2 m-85 -117.09 156.91 26.77 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.922 -179.622 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 367' ' ' LYS . . . . . . . . . . . . . 63.4 tttp -123.36 -73.83 0.63 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.736 179.885 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 368' ' ' ASN . . . . . . . . . . . . . 27.7 t-20 -72.69 -18.05 61.58 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.554 179.789 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 369' ' ' GLN . . . . . . . . . . . . . 23.7 mp0 -94.71 86.99 4.9 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.846 179.937 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 370' ' ' GLU . . . . . . . . . . . . . 42.8 tt0 -93.69 -14.75 26.0 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.609 179.89 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 371' ' ' ASP . . . . . . . . . . . . . 18.5 t70 -55.69 -37.73 68.73 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.914 -0.585 . . . . 0.0 110.864 179.899 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 372' ' ' LEU . . . . . . . . . . . . . 6.4 mp -67.06 -38.63 86.13 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.117 179.891 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 373' ' ' LEU . . . . . . . . . . . . . 27.3 mt -64.31 -44.27 92.1 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.404 -0.362 . . . . 0.0 110.926 -179.777 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 374' ' ' SER . . . . . . . . . . . . . 59.2 m -65.79 -55.0 19.5 Favored 'General case' 0 C--O 1.236 0.352 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.507 179.649 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 375' ' ' GLU . . . . . 0.448 ' HG3' ' NZ ' ' B' ' 313' ' ' LYS . 20.6 mm-40 -52.78 -38.55 61.25 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.993 -0.548 . . . . 0.0 110.075 179.409 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 376' ' ' PHE . . . . . 0.569 ' HB2' ' HH ' ' B' ' 310' ' ' TYR . 91.0 t80 -66.42 -41.67 88.89 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.026 179.268 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 377' ' ' GLY . . . . . . . . . . . . . . . -55.62 -35.84 63.25 Favored Glycine 0 N--CA 1.448 -0.503 0 C-N-CA 120.621 -0.8 . . . . 0.0 111.269 179.103 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 378' ' ' GLN . . . . . . . . . . . . . 18.8 mm-40 -56.99 -34.84 68.52 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.928 0.394 . . . . 0.0 110.421 179.01 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 379' ' ' PHE . . . . . . . . . . . . . 89.6 m-85 -74.31 -38.49 63.31 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.031 -0.532 . . . . 0.0 110.712 179.566 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 380' ' ' LEU . . . . . . . . . . . . . 10.9 tp -45.31 115.0 2.45 Favored Pre-proline 0 C--N 1.331 -0.231 0 CA-C-N 115.861 -0.609 . . . . 0.0 111.037 -179.475 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 381' ' ' PRO . . . . . 0.501 ' HA ' ' HA ' ' A' ' 377' ' ' ARG . 99.1 Cg_exo -45.05 124.7 6.16 Favored 'Trans proline' 0 C--N 1.35 0.645 0 C-N-CA 122.704 2.269 . . . . 0.0 112.628 -179.777 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 382' ' ' ASP . . . . . 0.523 ' H ' ' HA ' ' A' ' 377' ' ' ARG . 14.4 t70 -88.1 136.85 32.78 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.359 -0.382 . . . . 0.0 111.029 -179.967 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 383' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.1 0 CA-C-O 118.227 -0.892 . . . . 0.0 111.025 179.87 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 358' ' ' ASP . . . . . . . . . . . . . 5.0 p-10 . . . . . 0 N--CA 1.485 1.308 0 CA-C-O 120.71 0.291 . . . . 0.0 110.94 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 359' ' ' PHE . . . . . . . . . . . . . 24.8 p90 -136.08 172.36 13.13 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.956 -179.832 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 360' ' ' THR . . . . . . . . . . . . . 39.7 m -142.54 100.79 5.61 Favored Pre-proline 0 C--N 1.33 -0.241 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.974 179.945 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 361' ' ' PRO . . . . . . . . . . . . . 60.4 Cg_endo -72.78 -164.51 0.19 Allowed 'Trans proline' 0 C--N 1.349 0.58 0 C-N-CA 122.371 2.048 . . . . 0.0 112.128 179.912 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 362' ' ' MET . . . . . 0.458 ' SD ' HD12 ' B' ' 329' ' ' LEU . 12.1 tpt -54.34 -69.16 0.13 Allowed 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.584 179.686 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 363' ' ' ASP . . . . . 0.406 ' OD2' ' HG3' ' A' ' 362' ' ' MET . 4.0 p30 -167.79 -53.06 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.721 179.33 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 364' ' ' SER . . . . . . . . . . . . . 47.7 t 177.14 6.39 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.088 -0.506 . . . . 0.0 110.599 179.993 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 365' ' ' SER . . . . . 0.511 ' HB2' ' NE2' ' B' ' 336' ' ' GLN . 81.1 p -112.92 -21.01 11.35 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.501 -179.53 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 366' ' ' ALA . . . . . . . . . . . . . . . -58.38 -47.44 83.82 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.915 0.388 . . . . 0.0 110.993 179.898 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 367' ' ' VAL . . . . . . . . . . . . . 14.8 t -65.49 -22.09 30.34 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.868 -179.89 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 368' ' ' TYR . . . . . . . . . . . . . 61.5 t80 -65.14 -53.55 43.39 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.025 179.993 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 369' ' ' VAL . . . . . . . . . . . . . 17.4 m -70.96 -45.23 74.03 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-N 116.457 -0.338 . . . . 0.0 111.093 179.881 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 370' ' ' LEU . . . . . . . . . . . . . 98.9 mt -56.43 -37.97 70.94 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.386 -0.37 . . . . 0.0 110.739 179.762 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 371' ' ' SER . . . . . . . . . . . . . 83.1 p -70.51 -60.66 2.13 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.148 -179.994 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 372' ' ' SER . . . . . . . . . . . . . 79.3 p -52.56 -33.22 44.85 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.508 -0.315 . . . . 0.0 111.814 -179.28 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 373' ' ' MET . . . . . . . . . . . . . 95.8 mtp -74.4 -45.89 43.82 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 111.701 0.26 . . . . 0.0 111.701 -179.318 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 374' ' ' ALA . . . . . . . . . . . . . . . -84.48 -6.58 59.39 Favored 'General case' 0 C--N 1.331 -0.234 0 N-CA-C 112.339 0.496 . . . . 0.0 112.339 -179.217 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 375' ' ' ARG . . . . . 0.464 ' HA ' ' HE ' ' A' ' 375' ' ' ARG . 2.6 mmp_? -106.32 -27.51 10.95 Favored 'General case' 0 C--N 1.33 -0.276 0 N-CA-C 111.64 0.237 . . . . 0.0 111.64 -179.296 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 376' ' ' GLN . . . . . . . . . . . . . 27.6 tt0 -54.42 -85.38 0.01 OUTLIER 'General case' 0 C--N 1.333 -0.14 0 CA-C-O 120.702 0.287 . . . . 0.0 111.065 -179.8 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 377' ' ' ARG . . . . . 0.544 ' H ' ' HB3' ' B' ' 381' ' ' PRO . 81.5 mtp180 50.94 -158.66 0.09 Allowed 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.998 179.842 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 378' ' ' ARG . . . . . . . . . . . . . 78.5 ttt180 -60.85 -57.05 14.29 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.016 179.97 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 379' ' ' ALA . . . . . . . . . . . . . . . 60.42 -87.5 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.216 -179.817 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 380' ' ' SER . . . . . . . . . . . . . 43.6 t . . . . . 0 C--O 1.25 1.102 0 CA-C-O 118.31 -0.852 . . . . 0.0 111.111 179.897 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' B' B ' 295' ' ' SER . . . . . . . . . . . . . 64.9 m . . . . . 0 N--CA 1.486 1.346 0 CA-C-O 120.757 0.313 . . . . 0.0 110.85 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' B' B ' 296' ' ' LEU . . . . . 0.448 HD22 ' N ' ' B' ' 296' ' ' LEU . 3.3 mm? -94.41 -25.46 16.92 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.995 -179.789 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 297' ' ' GLN . . . . . . . . . . . . . 13.9 pt20 -162.48 9.82 0.06 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.023 179.871 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 298' ' ' ASN . . . . . . . . . . . . . 68.3 m-20 -95.59 134.48 38.42 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.003 179.926 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 299' ' ' ASN . . . . . . . . . . . . . 19.1 m120 60.21 102.27 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.092 -0.504 . . . . 0.0 111.068 179.977 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 300' ' ' GLN . . . . . . . . . . . . . 11.8 pt20 -99.52 151.61 37.51 Favored Pre-proline 0 C--N 1.33 -0.252 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.95 -179.998 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 301' ' ' PRO . . . . . . . . . . . . . 57.7 Cg_endo -70.71 119.38 6.28 Favored 'Trans proline' 0 C--N 1.348 0.524 0 C-N-CA 122.395 2.063 . . . . 0.0 112.296 -179.925 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 302' ' ' VAL . . . . . 0.403 HG22 ' N ' ' B' ' 303' ' ' GLU . 22.1 m -89.39 -36.8 9.1 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-O 121.06 0.457 . . . . 0.0 111.29 -179.948 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 303' ' ' GLU . . . . . 0.403 ' N ' HG22 ' B' ' 302' ' ' VAL . 0.7 OUTLIER -56.7 -68.76 0.19 Allowed 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.665 -0.698 . . . . 0.0 111.805 -178.859 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 304' ' ' PHE . . . . . 0.547 ' HA ' HD12 ' B' ' 308' ' ' ILE . 77.5 t80 -50.0 -63.58 1.07 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.867 -179.257 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 305' ' ' ASN . . . . . . . . . . . . . 53.9 t30 -46.57 -63.58 0.98 Allowed 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 112.355 0.502 . . . . 0.0 112.355 -178.803 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 306' ' ' HIS . . . . . . . . . . . . . 12.7 m-70 -55.23 -68.71 0.17 Allowed 'General case' 0 C--N 1.33 -0.266 0 N-CA-C 112.765 0.654 . . . . 0.0 112.765 -178.661 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 307' ' ' ALA . . . . . . . . . . . . . . . -48.68 -61.97 1.75 Allowed 'General case' 0 CA--C 1.532 0.254 0 N-CA-C 112.903 0.705 . . . . 0.0 112.903 -178.304 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 308' ' ' ILE . . . . . 0.547 HD12 ' HA ' ' B' ' 304' ' ' PHE . 1.8 mp -52.48 -61.22 0.82 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 N-CA-C 112.221 0.452 . . . . 0.0 112.221 -179.04 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 309' ' ' ASN . . . . . . . . . . . . . 3.2 t-20 -55.4 -27.24 46.47 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.725 0.298 . . . . 0.0 111.518 -179.256 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 310' ' ' TYR . . . . . . . . . . . . . 82.3 t80 -68.02 -57.25 6.46 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.369 -0.378 . . . . 0.0 111.225 -179.726 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 311' ' ' VAL . . . . . . . . . . . . . 27.8 t -58.17 -44.77 88.38 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.163 0 CA-C-N 116.367 -0.379 . . . . 0.0 110.705 -179.969 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 312' ' ' ASN . . . . . . . . . . . . . 2.7 t-20 -61.65 -37.15 82.96 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.13 -0.487 . . . . 0.0 110.628 179.722 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 313' ' ' LYS . . . . . . . . . . . . . 28.0 tttp -60.11 -57.11 14.25 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.963 179.827 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 314' ' ' ILE . . . . . . . . . . . . . 58.7 mt -67.51 -23.37 29.81 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.412 -179.619 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 315' ' ' LYS . . . . . . . . . . . . . 1.3 tmmt? -73.24 -36.58 66.45 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.318 -0.401 . . . . 0.0 111.142 -179.727 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 316' ' ' ASN . . . . . . . . . . . . . 24.0 t-20 -86.59 -43.19 12.87 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.412 -0.358 . . . . 0.0 111.469 -179.547 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 317' ' ' ARG . . . . . 0.41 ' HE ' ' HA ' ' B' ' 317' ' ' ARG . 5.7 tpm_? -64.02 -65.82 0.63 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.383 -0.371 . . . . 0.0 111.188 -179.779 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 318' ' ' PHE . . . . . . . . . . . . . 68.1 m-85 -81.62 31.59 0.35 Allowed 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.433 -179.639 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 319' ' ' GLN . . . . . . . . . . . . . 50.1 tt0 -68.69 -15.6 63.57 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.7 179.886 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 320' ' ' GLY . . . . . . . . . . . . . . . -74.53 -48.25 13.98 Favored Glycine 0 N--CA 1.452 -0.297 0 C-N-CA 120.888 -0.672 . . . . 0.0 112.604 179.964 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 321' ' ' GLN . . . . . . . . . . . . . 20.3 tp60 -100.92 100.94 14.06 Favored Pre-proline 0 C--N 1.33 -0.242 0 CA-C-N 116.579 0.19 . . . . 0.0 110.754 179.878 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 322' ' ' PRO . . . . . . . . . . . . . 33.6 Cg_endo -64.58 -24.71 62.83 Favored 'Trans proline' 0 C--N 1.349 0.6 0 C-N-CA 122.495 2.13 . . . . 0.0 112.525 -179.914 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 323' ' ' ASP . . . . . . . . . . . . . 8.0 m-20 -62.79 -37.07 85.23 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.059 -179.741 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 324' ' ' ILE . . . . . . . . . . . . . 48.8 mm -68.85 -61.0 1.87 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.374 -0.376 . . . . 0.0 111.039 -179.882 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 325' ' ' TYR . . . . . . . . . . . . . 23.2 t80 -51.75 -51.86 53.08 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.911 -0.586 . . . . 0.0 111.013 -179.938 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 326' ' ' LYS . . . . . . . . . . . . . 63.0 tttm -58.3 -46.02 86.89 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.145 -179.844 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 327' ' ' ALA . . . . . . . . . . . . . . . -52.23 -55.28 22.26 Favored 'General case' 0 C--O 1.233 0.237 0 CA-C-O 120.875 0.369 . . . . 0.0 111.078 -179.986 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 328' ' ' PHE . . . . . . . . . . . . . 60.6 t80 -54.05 -45.17 71.59 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.473 179.77 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 329' ' ' LEU . . . . . 0.458 HD12 ' SD ' ' A' ' 362' ' ' MET . 73.4 mt -59.44 -35.16 73.51 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.737 179.569 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 330' ' ' GLU . . . . . . . . . . . . . 47.1 mt-10 -67.69 -37.1 81.82 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.446 179.653 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 331' ' ' ILE . . . . . . . . . . . . . 70.8 mt -63.69 -53.5 43.97 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.596 179.376 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 332' ' ' LEU . . . . . . . . . . . . . 8.4 mp -63.02 -35.42 80.17 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.838 179.732 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 333' ' ' HIS . . . . . . . . . . . . . 45.6 t60 -62.27 -52.9 61.89 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.905 0.384 . . . . 0.0 110.005 179.442 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 334' ' ' THR . . . . . 0.431 HG22 HD11 ' B' ' 353' ' ' LEU . 58.8 m -60.1 -32.07 70.64 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.984 -0.553 . . . . 0.0 109.886 179.004 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 335' ' ' TYR . . . . . . . . . . . . . 57.3 t80 -63.88 -38.66 91.9 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.641 -0.709 . . . . 0.0 109.879 179.273 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 336' ' ' GLN . . . . . 0.511 ' NE2' ' HB2' ' A' ' 365' ' ' SER . 3.4 tt0 -66.35 -48.99 68.44 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.689 -0.687 . . . . 0.0 110.42 179.529 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 337' ' ' LYS . . . . . . . . . . . . . 38.6 ttpt -56.09 -50.62 70.52 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.807 -0.633 . . . . 0.0 111.018 179.987 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 338' ' ' GLU . . . . . . . . . . . . . 38.3 mm-40 -63.36 -35.67 81.16 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.139 -179.819 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 339' ' ' GLN . . . . . . . . . . . . . 23.3 tp60 -65.38 -45.65 83.22 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.719 179.936 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 340' ' ' ARG . . . . . . . . . . . . . 80.3 mtp180 -60.84 -50.53 73.07 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.604 179.705 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 341' ' ' ASN . . . . . . . . . . . . . 81.8 m-20 -54.9 -44.13 73.86 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.7 179.685 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 342' ' ' ALA . . . . . . . . . . . . . . . -64.76 -33.04 75.04 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.815 179.704 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 343' ' ' LYS . . . . . . . . . . . . . 39.5 ttpt -71.52 -40.07 70.33 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.862 179.799 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 344' ' ' GLU . . . . . . . . . . . . . 13.3 mm-40 -69.29 -33.56 73.38 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.906 179.993 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 345' ' ' ALA . . . . . . . . . . . . . . . -67.16 -32.67 73.92 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.165 -0.471 . . . . 0.0 111.021 179.922 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 346' ' ' GLY . . . . . . . . . . . . . . . 127.16 -46.06 1.11 Allowed Glycine 0 N--CA 1.451 -0.328 0 C-N-CA 120.788 -0.72 . . . . 0.0 112.514 179.988 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 347' ' ' GLY . . . . . . . . . . . . . . . 154.62 -25.65 0.66 Allowed Glycine 0 N--CA 1.452 -0.289 0 C-N-CA 120.806 -0.711 . . . . 0.0 112.448 -179.898 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 348' ' ' ASN . . . . . . . . . . . . . 26.5 t-20 -67.01 -21.92 65.92 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.713 0.292 . . . . 0.0 110.935 179.946 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 349' ' ' TYR . . . . . . . . . . . . . 63.1 t80 -63.52 147.19 52.04 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.779 -179.976 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 350' ' ' THR . . . . . . . . . . . . . 65.6 m -108.16 100.62 37.74 Favored Pre-proline 0 C--N 1.33 -0.257 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.03 -179.992 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 351' ' ' PRO . . . . . . . . . . . . . 57.7 Cg_exo -52.13 131.03 37.64 Favored 'Trans proline' 0 C--N 1.349 0.557 0 C-N-CA 122.42 2.08 . . . . 0.0 112.258 179.809 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 352' ' ' ALA . . . . . . . . . . . . . . . -59.78 -44.05 94.09 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.256 -179.796 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 353' ' ' LEU . . . . . 0.431 HD11 HG22 ' B' ' 334' ' ' THR . 6.3 mp -112.02 120.16 40.92 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 120.998 0.428 . . . . 0.0 111.28 179.879 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 354' ' ' THR . . . . . . . . . . . . . 56.2 p -113.06 -164.18 0.9 Allowed 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.802 -0.635 . . . . 0.0 110.369 179.422 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 355' ' ' GLU . . . . . . . . . . . . . 2.0 mp0 -61.29 -38.09 85.53 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 121.025 0.441 . . . . 0.0 110.368 179.681 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 356' ' ' GLN . . . . . . . . . . . . . 24.5 mt-30 -72.75 -40.91 65.65 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 115.868 -0.605 . . . . 0.0 111.317 -179.852 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 357' ' ' GLU . . . . . . . . . . . . . 4.8 tp10 -59.49 -53.1 62.02 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-O 120.785 0.326 . . . . 0.0 110.702 -179.793 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 358' ' ' VAL . . . . . 0.421 ' O ' HG22 ' B' ' 362' ' ' VAL . 49.9 t -61.82 -54.87 28.81 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.205 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.973 179.928 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 359' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER -52.28 -37.25 55.06 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.566 -0.288 . . . . 0.0 110.938 -179.524 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 360' ' ' ALA . . . . . . . . . . . . . . . -65.08 -58.64 5.53 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.43 -0.35 . . . . 0.0 111.411 -179.826 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 361' ' ' GLN . . . . . . . . . . . . . 47.8 mt-30 -55.83 -38.71 70.38 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.897 -179.889 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 362' ' ' VAL . . . . . 0.421 HG22 ' O ' ' B' ' 358' ' ' VAL . 60.4 t -71.01 -34.01 53.82 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.291 179.581 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 363' ' ' ALA . . . . . 0.516 ' HA ' HD13 ' B' ' 373' ' ' LEU . . . -64.2 -36.23 83.38 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.266 179.356 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 364' ' ' ARG . . . . . . . . . . . . . 58.9 mtp180 -87.18 -20.32 27.16 Favored 'General case' 0 N--CA 1.453 -0.286 0 CA-C-N 115.806 -0.634 . . . . 0.0 110.2 179.251 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 365' ' ' LEU . . . . . . . . . . . . . 23.6 tp -60.3 -21.11 61.58 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 115.824 -0.626 . . . . 0.0 109.916 179.239 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 366' ' ' PHE . . . . . . . . . . . . . 44.8 m-85 -131.13 -174.54 3.42 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.527 -0.76 . . . . 0.0 109.925 179.391 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 367' ' ' LYS . . . . . . . . . . . . . 66.5 mttm -133.89 -80.37 0.46 Allowed 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.745 0.307 . . . . 0.0 111.214 -179.943 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 368' ' ' ASN . . . . . . . . . . . . . 3.0 p-10 -90.18 8.83 30.98 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.955 -179.854 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 369' ' ' GLN . . . . . 0.402 ' HB3' HD12 ' B' ' 372' ' ' LEU . 13.4 mm100 -91.49 84.51 5.55 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.869 179.832 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 370' ' ' GLU . . . . . . . . . . . . . 2.2 mp0 -89.92 -11.43 41.82 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.535 -0.302 . . . . 0.0 110.653 179.749 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 371' ' ' ASP . . . . . . . . . . . . . 5.3 m-20 -63.67 -46.89 83.49 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.468 179.629 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 372' ' ' LEU . . . . . 0.402 HD12 ' HB3' ' B' ' 369' ' ' GLN . 6.3 mp -68.17 -45.81 72.44 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.553 179.477 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 373' ' ' LEU . . . . . 0.516 HD13 ' HA ' ' B' ' 363' ' ' ALA . 1.1 mp -59.08 -33.58 70.98 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.739 -0.664 . . . . 0.0 111.046 -179.898 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 374' ' ' SER . . . . . . . . . . . . . 47.7 t -74.16 -57.51 3.91 Favored 'General case' 0 C--O 1.236 0.344 0 CA-C-O 120.949 0.404 . . . . 0.0 110.673 179.794 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 375' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -54.35 -32.81 57.71 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.133 179.505 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 376' ' ' PHE . . . . . 0.456 ' O ' ' HB2' ' B' ' 379' ' ' PHE . 66.9 t80 -79.6 -31.36 41.71 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.02 179.196 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 377' ' ' GLY . . . . . . . . . . . . . . . -61.71 -33.17 84.2 Favored Glycine 0 N--CA 1.448 -0.532 0 C-N-CA 120.593 -0.813 . . . . 0.0 111.236 179.12 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 378' ' ' GLN . . . . . . . . . . . . . 23.8 mt-30 -69.53 -26.73 64.66 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.753 0.311 . . . . 0.0 110.884 179.303 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 379' ' ' PHE . . . . . 0.456 ' HB2' ' O ' ' B' ' 376' ' ' PHE . 12.9 m-85 -61.67 -38.22 86.95 Favored 'General case' 0 C--N 1.333 -0.14 0 CA-C-N 116.277 -0.419 . . . . 0.0 111.298 -179.9 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 380' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -53.22 141.43 41.09 Favored Pre-proline 0 C--N 1.331 -0.213 0 CA-C-N 116.523 -0.308 . . . . 0.0 110.62 -179.966 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 381' ' ' PRO . . . . . 0.544 ' HB3' ' H ' ' A' ' 377' ' ' ARG . 39.6 Cg_endo -66.65 145.71 76.72 Favored 'Trans proline' 0 C--N 1.346 0.405 0 C-N-CA 122.404 2.069 . . . . 0.0 112.164 -179.817 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 382' ' ' ASP . . . . . 0.426 ' H ' ' HG2' ' A' ' 377' ' ' ARG . 5.3 m-20 -94.73 108.28 20.28 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.019 179.994 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 383' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.027 0 CA-C-O 118.216 -0.897 . . . . 0.0 111.104 179.851 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 358' ' ' ASP . . . . . . . . . . . . . 3.9 p30 . . . . . 0 N--CA 1.485 1.308 0 CA-C-O 120.758 0.313 . . . . 0.0 110.87 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 359' ' ' PHE . . . . . . . . . . . . . 86.4 t80 -150.17 133.99 16.81 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.983 179.989 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 360' ' ' THR . . . . . . . . . . . . . 49.6 m -112.44 94.34 26.85 Favored Pre-proline 0 C--N 1.33 -0.265 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.039 179.877 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 361' ' ' PRO . . . . . . . . . . . . . 56.9 Cg_endo -71.07 -170.59 0.49 Allowed 'Trans proline' 0 C--N 1.347 0.492 0 C-N-CA 122.387 2.058 . . . . 0.0 112.512 -179.881 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 362' ' ' MET . . . . . 0.603 ' HG3' HD11 ' B' ' 329' ' ' LEU . 20.6 ttt -59.56 -71.52 0.12 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.996 -0.547 . . . . 0.0 111.043 -179.882 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 363' ' ' ASP . . . . . . . . . . . . . 16.7 t70 -174.42 -40.65 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.11 -179.822 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 364' ' ' SER . . . . . . . . . . . . . 48.4 t -111.09 -67.16 1.02 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.732 -0.667 . . . . 0.0 110.428 179.675 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 365' ' ' SER . . . . . . . . . . . . . 33.7 t -175.03 92.05 0.06 Allowed 'General case' 0 C--N 1.333 -0.149 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.958 179.761 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 366' ' ' ALA . . . . . . . . . . . . . . . -77.29 -34.13 55.61 Favored 'General case' 0 C--O 1.235 0.305 0 CA-C-O 121.326 0.584 . . . . 0.0 110.355 179.465 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 367' ' ' VAL . . . . . . . . . . . . . 35.2 m -62.16 -16.59 16.32 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 115.608 -0.724 . . . . 0.0 110.414 179.376 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 368' ' ' TYR . . . . . . . . . . . . . 66.9 t80 -71.39 -56.84 5.17 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.54 179.743 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 369' ' ' VAL . . . . . 0.555 HG11 ' HB3' ' B' ' 332' ' ' LEU . 3.4 p -61.21 -44.53 98.54 Favored 'Isoleucine or valine' 0 C--O 1.232 0.147 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.455 179.533 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 370' ' ' LEU . . . . . . . . . . . . . 91.9 mt -64.0 -36.49 84.16 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.71 179.821 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 371' ' ' SER . . . . . 0.538 ' HA ' ' HB3' ' B' ' 303' ' ' GLU . 29.9 t -60.85 -61.44 2.58 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.896 179.772 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 372' ' ' SER . . . . . 0.41 ' O ' ' HG3' ' A' ' 376' ' ' GLN . 79.3 p -57.43 -33.07 67.53 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.991 -179.783 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 373' ' ' MET . . . . . . . . . . . . . 52.3 ttm -58.93 -56.96 15.5 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.365 -179.804 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 374' ' ' ALA . . . . . 0.486 ' HB2' ' OE1' ' B' ' 303' ' ' GLU . . . -84.23 -6.92 59.46 Favored 'General case' 0 C--N 1.33 -0.246 0 N-CA-C 112.016 0.376 . . . . 0.0 112.016 -179.379 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 375' ' ' ARG . . . . . . . . . . . . . 21.2 tpp180 -80.97 -40.86 23.72 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.734 0.302 . . . . 0.0 110.753 179.94 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 376' ' ' GLN . . . . . 0.41 ' HG3' ' O ' ' A' ' 372' ' ' SER . 56.6 mt-30 -57.05 -82.51 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.882 179.843 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 377' ' ' ARG . . . . . . . . . . . . . 47.1 ttp180 51.86 24.78 2.67 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-O 121.085 0.469 . . . . 0.0 110.709 179.902 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 378' ' ' ARG . . . . . . . . . . . . . 98.2 mtt180 -77.24 142.36 39.58 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.988 -179.739 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 379' ' ' ALA . . . . . . . . . . . . . . . -147.14 -30.06 0.35 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.196 -0.457 . . . . 0.0 111.165 -179.975 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 380' ' ' SER . . . . . . . . . . . . . 59.1 p . . . . . 0 C--O 1.249 1.034 0 CA-C-O 118.323 -0.846 . . . . 0.0 110.885 -179.987 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' B' B ' 295' ' ' SER . . . . . . . . . . . . . 54.4 m . . . . . 0 N--CA 1.484 1.239 0 CA-C-O 120.769 0.319 . . . . 0.0 110.997 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' B' B ' 296' ' ' LEU . . . . . . . . . . . . . 78.1 mt -141.02 172.49 12.6 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.719 -179.916 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 297' ' ' GLN . . . . . . . . . . . . . 83.7 mm-40 -130.86 -36.65 1.35 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.813 179.803 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 298' ' ' ASN . . . . . . . . . . . . . 84.2 m-20 -106.52 171.21 7.48 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.85 179.861 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 299' ' ' ASN . . . . . . . . . . . . . 1.9 m-20 61.45 97.29 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.926 -179.96 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 300' ' ' GLN . . . . . 0.59 ' HB2' ' HD3' ' B' ' 301' ' ' PRO . 46.5 mt-30 -65.03 -49.57 66.7 Favored Pre-proline 0 CA--C 1.534 0.336 0 CA-C-N 116.198 -0.456 . . . . 0.0 111.371 -179.897 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 301' ' ' PRO . . . . . 0.59 ' HD3' ' HB2' ' B' ' 300' ' ' GLN . 23.3 Cg_exo -65.05 93.75 0.22 Allowed 'Trans proline' 0 C--N 1.355 0.889 0 C-N-CA 122.16 1.906 . . . . 0.0 112.078 179.812 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 302' ' ' VAL . . . . . 0.428 HG13 ' N ' ' B' ' 303' ' ' GLU . 4.2 p -92.17 -48.73 13.53 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.278 -179.964 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 303' ' ' GLU . . . . . 0.538 ' HB3' ' HA ' ' A' ' 371' ' ' SER . 72.7 mm-40 -67.32 -40.17 85.94 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.092 -0.504 . . . . 0.0 111.815 -179.314 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 304' ' ' PHE . . . . . . . . . . . . . 83.8 m-85 -58.85 -62.06 2.16 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.416 -179.482 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 305' ' ' ASN . . . . . . . . . . . . . 47.4 t-20 -59.59 -43.14 93.78 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.845 -179.228 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 306' ' ' HIS . . . . . . . . . . . . . 7.0 t-160 -61.29 -65.4 0.7 Allowed 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 111.881 0.326 . . . . 0.0 111.881 -179.063 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 307' ' ' ALA . . . . . . . . . . . . . . . -54.23 -43.86 71.23 Favored 'General case' 0 C--N 1.33 -0.242 0 N-CA-C 112.147 0.425 . . . . 0.0 112.147 -179.036 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 308' ' ' ILE . . . . . . . . . . . . . 62.7 mt -58.87 -54.75 29.48 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-O 120.676 0.274 . . . . 0.0 111.393 -179.735 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 309' ' ' ASN . . . . . 0.533 HD21 ' N ' ' B' ' 309' ' ' ASN . 0.9 OUTLIER -58.47 -30.88 67.32 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.835 0.35 . . . . 0.0 111.041 -179.962 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 310' ' ' TYR . . . . . 0.414 ' O ' ' HG3' ' B' ' 313' ' ' LYS . 24.0 t80 -65.38 -62.3 1.61 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.83 179.967 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 311' ' ' VAL . . . . . . . . . . . . . 56.4 t -61.3 -23.37 30.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.975 179.94 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 312' ' ' ASN . . . . . . . . . . . . . 27.2 t-20 -69.45 -56.72 6.6 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.486 -179.6 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 313' ' ' LYS . . . . . 0.414 ' HG3' ' O ' ' B' ' 310' ' ' TYR . 0.0 OUTLIER -64.69 -33.45 75.97 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.362 -0.381 . . . . 0.0 111.372 -179.381 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 314' ' ' ILE . . . . . . . . . . . . . 79.3 mt -72.22 -36.92 57.49 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-O 120.755 0.312 . . . . 0.0 111.278 179.774 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 315' ' ' LYS . . . . . . . . . . . . . 25.8 ttpp -67.93 -45.76 73.38 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.37 -0.377 . . . . 0.0 111.095 -179.761 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 316' ' ' ASN . . . . . . . . . . . . . 52.1 t-20 -68.58 -48.74 63.43 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.187 -0.461 . . . . 0.0 111.317 -179.625 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 317' ' ' ARG . . . . . . . . . . . . . 49.5 ttt180 -59.48 -64.2 1.03 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.481 -179.474 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 318' ' ' PHE . . . . . . . . . . . . . 96.8 m-85 -84.38 33.08 0.5 Allowed 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.323 -179.59 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 319' ' ' GLN . . . . . . . . . . . . . 7.1 tp60 -64.87 -20.16 66.28 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.416 -0.356 . . . . 0.0 110.702 179.795 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 320' ' ' GLY . . . . . . . . . . . . . . . -85.72 -21.15 54.45 Favored Glycine 0 C--N 1.33 0.213 0 C-N-CA 120.858 -0.687 . . . . 0.0 112.626 179.936 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 321' ' ' GLN . . . . . . . . . . . . . 29.6 mm-40 -106.87 96.45 14.71 Favored Pre-proline 0 C--N 1.33 -0.261 0 CA-C-O 120.539 0.209 . . . . 0.0 110.809 179.91 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 322' ' ' PRO . . . . . . . . . . . . . 86.7 Cg_endo -78.4 -28.46 4.51 Favored 'Trans proline' 0 C--N 1.348 0.537 0 C-N-CA 122.417 2.078 . . . . 0.0 112.72 -179.817 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 323' ' ' ASP . . . . . . . . . . . . . 31.3 m-20 -65.29 -48.01 74.64 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.354 -0.384 . . . . 0.0 111.103 -179.725 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 324' ' ' ILE . . . . . . . . . . . . . 71.6 mt -66.2 -47.25 85.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.236 -179.962 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 325' ' ' TYR . . . . . . . . . . . . . 41.1 t80 -55.82 -57.73 10.8 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.982 -179.989 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 326' ' ' LYS . . . . . 0.466 ' O ' ' HG3' ' B' ' 330' ' ' GLU . 98.5 mttt -55.53 -48.85 74.04 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.046 -0.524 . . . . 0.0 111.259 -179.898 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 327' ' ' ALA . . . . . . . . . . . . . . . -49.08 -51.67 30.22 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.372 -0.377 . . . . 0.0 111.231 -179.922 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 328' ' ' PHE . . . . . . . . . . . . . 84.1 t80 -56.33 -46.03 80.07 Favored 'General case' 0 C--O 1.235 0.324 0 CA-C-N 116.191 -0.459 . . . . 0.0 109.975 179.316 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 329' ' ' LEU . . . . . 0.603 HD11 ' HG3' ' A' ' 362' ' ' MET . 83.5 mt -58.71 -31.22 68.06 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 115.711 -0.677 . . . . 0.0 110.186 179.042 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 330' ' ' GLU . . . . . 0.466 ' HG3' ' O ' ' B' ' 326' ' ' LYS . 38.8 mt-10 -71.73 -36.05 70.36 Favored 'General case' 0 C--N 1.333 -0.13 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.679 179.65 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 331' ' ' ILE . . . . . . . . . . . . . 61.5 mt -65.48 -47.8 85.32 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.152 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.872 179.881 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 332' ' ' LEU . . . . . 0.555 ' HB3' HG11 ' A' ' 369' ' ' VAL . 14.0 mt -67.36 -37.82 83.8 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.412 -0.358 . . . . 0.0 110.899 179.97 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 333' ' ' HIS . . . . . 0.537 ' HB2' ' HE3' ' A' ' 362' ' ' MET . 48.4 t-80 -61.29 -57.89 10.52 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.649 179.635 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 334' ' ' THR . . . . . 0.454 HG23 HD12 ' B' ' 353' ' ' LEU . 86.3 m -59.56 -35.17 73.73 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.915 -0.584 . . . . 0.0 111.005 179.842 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 335' ' ' TYR . . . . . . . . . . . . . 83.4 t80 -61.1 -60.35 3.9 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.902 -179.935 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 336' ' ' GLN . . . . . 0.609 ' HA ' HE21 ' B' ' 336' ' ' GLN . 0.0 OUTLIER -56.98 -33.62 67.28 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.715 -179.856 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 337' ' ' LYS . . . . . . . . . . . . . 23.9 ttmm -59.02 -54.27 48.97 Favored 'General case' 0 C--O 1.234 0.251 0 CA-C-O 120.971 0.415 . . . . 0.0 110.528 179.296 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 338' ' ' GLU . . . . . . . . . . . . . 26.2 mm-40 -60.05 -33.69 72.39 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.296 179.468 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 339' ' ' GLN . . . . . . . . . . . . . 57.7 tp60 -64.1 -43.5 95.17 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.464 179.549 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 340' ' ' ARG . . . . . . . . . . . . . 94.7 mtt180 -61.83 -53.89 49.67 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.597 179.68 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 341' ' ' ASN . . . . . . . . . . . . . 47.9 t-20 -57.6 -33.05 67.8 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.507 179.696 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 342' ' ' ALA . . . . . . . . . . . . . . . -65.91 -43.28 88.62 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.937 -0.574 . . . . 0.0 111.023 179.917 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 343' ' ' LYS . . . . . . . . . . . . . 88.2 tttt -66.93 -39.79 87.42 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.839 179.965 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 344' ' ' GLU . . . . . . . . . . . . . 12.6 mm-40 -69.54 -31.79 70.21 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.898 -179.978 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 345' ' ' ALA . . . . . . . . . . . . . . . -66.43 -24.7 66.5 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.243 -179.878 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 346' ' ' GLY . . . . . . . . . . . . . . . 63.99 41.86 98.45 Favored Glycine 0 N--CA 1.452 -0.262 0 C-N-CA 120.873 -0.68 . . . . 0.0 112.47 179.992 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 347' ' ' GLY . . . . . . . . . . . . . . . 96.6 178.77 35.22 Favored Glycine 0 N--CA 1.452 -0.237 0 C-N-CA 120.762 -0.732 . . . . 0.0 112.665 179.806 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 348' ' ' ASN . . . . . . . . . . . . . 13.7 m120 59.81 13.93 3.85 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-O 120.749 0.309 . . . . 0.0 111.256 179.913 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 349' ' ' TYR . . . . . . . . . . . . . 62.5 t80 -114.24 137.2 52.08 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.843 179.929 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 350' ' ' THR . . . . . . . . . . . . . 90.8 m -110.41 96.95 29.36 Favored Pre-proline 0 C--N 1.331 -0.228 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.019 -179.957 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 351' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_exo -51.41 137.16 48.15 Favored 'Trans proline' 0 C--N 1.349 0.564 0 C-N-CA 122.476 2.118 . . . . 0.0 112.057 179.846 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 352' ' ' ALA . . . . . . . . . . . . . . . -64.32 -58.99 4.92 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.11 -0.495 . . . . 0.0 111.562 -179.485 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 353' ' ' LEU . . . . . 0.454 HD12 HG23 ' B' ' 334' ' ' THR . 6.7 mp -101.12 128.93 46.97 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.923 0.392 . . . . 0.0 111.535 -179.536 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 354' ' ' THR . . . . . . . . . . . . . 61.6 p -113.1 -173.9 2.35 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.528 179.429 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 355' ' ' GLU . . . . . . . . . . . . . 31.2 mt-10 -58.59 -35.2 72.04 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.992 0.425 . . . . 0.0 110.578 179.783 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 356' ' ' GLN . . . . . . . . . . . . . 8.6 tt0 -73.86 -37.91 64.63 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.887 -0.597 . . . . 0.0 111.01 -179.881 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 357' ' ' GLU . . . . . 0.4 ' HG2' ' HG ' ' B' ' 353' ' ' LEU . 6.9 tp10 -62.5 -45.83 91.23 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-O 120.925 0.393 . . . . 0.0 110.575 179.998 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 358' ' ' VAL . . . . . 0.441 ' O ' HG21 ' B' ' 362' ' ' VAL . 70.5 t -66.76 -58.19 7.36 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.02 -0.536 . . . . 0.0 111.114 179.933 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 359' ' ' TYR . . . . . . . . . . . . . 40.3 t80 -52.09 -32.43 34.9 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.611 -0.268 . . . . 0.0 111.087 -179.626 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 360' ' ' ALA . . . . . . . . . . . . . . . -68.91 -56.51 7.66 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.412 -0.358 . . . . 0.0 111.043 179.868 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 361' ' ' GLN . . . . . . . . . . . . . 53.4 mt-30 -57.01 -44.35 82.74 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.73 179.872 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 362' ' ' VAL . . . . . 0.441 HG21 ' O ' ' B' ' 358' ' ' VAL . 45.2 t -65.56 -32.96 60.49 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.524 179.84 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 363' ' ' ALA . . . . . 0.59 ' HA ' HD22 ' B' ' 373' ' ' LEU . . . -62.48 -51.67 66.53 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.722 179.645 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 364' ' ' ARG . . . . . . . . . . . . . 96.7 mtt180 -75.1 -18.38 60.27 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.625 179.58 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 365' ' ' LEU . . . . . . . . . . . . . 7.2 tp -59.66 -31.91 69.98 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.731 179.894 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 366' ' ' PHE . . . . . . . . . . . . . 58.4 m-85 -118.16 173.32 6.86 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.57 179.8 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 367' ' ' LYS . . . . . . . . . . . . . 47.3 mmtm -129.25 -78.16 0.55 Allowed 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.754 0.312 . . . . 0.0 111.373 -179.775 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 368' ' ' ASN . . . . . . . . . . . . . 7.5 t30 -82.95 -10.17 58.93 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.142 -179.65 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 369' ' ' GLN . . . . . . . . . . . . . 19.5 mp0 -94.2 87.59 5.31 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.411 -0.359 . . . . 0.0 111.143 -179.784 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 370' ' ' GLU . . . . . . . . . . . . . 44.0 mt-10 -94.45 -10.59 31.89 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.726 179.516 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 371' ' ' ASP . . . . . . . . . . . . . 13.8 t70 -58.48 -38.05 76.81 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.429 179.674 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 372' ' ' LEU . . . . . . . . . . . . . 6.0 mp -70.12 -39.2 75.6 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.905 -0.588 . . . . 0.0 110.49 179.316 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 373' ' ' LEU . . . . . 0.59 HD22 ' HA ' ' B' ' 363' ' ' ALA . 1.4 mp -65.73 -36.27 83.12 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.582 -0.735 . . . . 0.0 111.305 -179.702 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 374' ' ' SER . . . . . . . . . . . . . 87.8 p -71.72 -51.18 24.16 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.883 0.373 . . . . 0.0 110.287 179.663 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 375' ' ' GLU . . . . . . . . . . . . . 11.1 mm-40 -58.33 -33.38 69.45 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.263 179.347 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 376' ' ' PHE . . . . . 0.424 ' HA ' ' HB2' ' B' ' 379' ' ' PHE . 64.6 t80 -80.8 -29.7 36.0 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.151 179.373 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 377' ' ' GLY . . . . . . . . . . . . . . . -62.84 -40.13 98.87 Favored Glycine 0 N--CA 1.45 -0.412 0 C-N-CA 120.715 -0.755 . . . . 0.0 111.388 179.267 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 378' ' ' GLN . . . . . . . . . . . . . 12.9 mm100 -78.04 -16.89 57.68 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.053 0.454 . . . . 0.0 110.093 179.074 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 379' ' ' PHE . . . . . 0.424 ' HB2' ' HA ' ' B' ' 376' ' ' PHE . 0.2 OUTLIER -68.31 -42.3 79.61 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.714 -0.675 . . . . 0.0 110.622 179.803 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 380' ' ' LEU . . . . . . . . . . . . . 64.0 mt -56.82 147.32 53.74 Favored Pre-proline 0 C--N 1.33 -0.247 0 CA-C-N 116.013 -0.54 . . . . 0.0 110.866 -179.932 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 381' ' ' PRO . . . . . . . . . . . . . 70.9 Cg_exo -48.79 108.71 0.2 Allowed 'Trans proline' 0 C--N 1.347 0.497 0 C-N-CA 122.68 2.253 . . . . 0.0 112.554 -179.989 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 382' ' ' ASP . . . . . . . . . . . . . 7.9 m-20 -85.02 -172.05 3.97 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.879 179.918 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 383' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.074 0 CA-C-O 118.23 -0.89 . . . . 0.0 111.222 -179.924 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 358' ' ' ASP . . . . . . . . . . . . . 6.2 m-20 . . . . . 0 N--CA 1.486 1.327 0 CA-C-O 120.822 0.344 . . . . 0.0 110.98 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 359' ' ' PHE . . . . . . . . . . . . . 48.7 p90 -158.15 165.87 33.87 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.758 179.974 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 360' ' ' THR . . . . . . . . . . . . . 61.1 p -128.8 130.72 23.47 Favored Pre-proline 0 C--N 1.33 -0.252 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.955 179.88 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 361' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.17 -162.24 0.08 OUTLIER 'Trans proline' 0 C--N 1.348 0.502 0 C-N-CA 122.436 2.09 . . . . 0.0 112.242 -179.933 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 362' ' ' MET . . . . . 0.508 ' HG3' HD12 ' B' ' 329' ' ' LEU . 23.8 ttt -51.39 -50.22 60.03 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.911 -179.99 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 363' ' ' ASP . . . . . . . . . . . . . 18.5 t70 -171.13 -71.5 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.581 179.962 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 364' ' ' SER . . . . . . . . . . . . . 34.6 t -174.96 20.55 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.541 179.953 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 365' ' ' SER . . . . . 0.546 ' HB2' HE22 ' B' ' 336' ' ' GLN . 80.4 p -124.93 -39.77 2.23 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.403 -179.799 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 366' ' ' ALA . . . . . . . . . . . . . . . -53.68 -44.03 69.37 Favored 'General case' 0 C--O 1.233 0.209 0 CA-C-O 120.786 0.327 . . . . 0.0 111.418 -179.664 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 367' ' ' VAL . . . . . . . . . . . . . 20.6 m -60.36 -30.29 45.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.232 179.911 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 368' ' ' TYR . . . . . 0.402 ' HA ' ' HG ' ' A' ' 371' ' ' SER . 37.1 t80 -75.87 -40.54 54.35 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.991 -179.76 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 369' ' ' VAL . . . . . 0.42 HG21 ' HB2' ' B' ' 336' ' ' GLN . 20.1 t -63.31 -43.56 98.69 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.162 -179.923 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 370' ' ' LEU . . . . . . . . . . . . . 96.5 mt -71.37 -47.14 58.14 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.018 179.93 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 371' ' ' SER . . . . . 0.453 ' HA ' ' HB2' ' B' ' 303' ' ' GLU . 79.7 p -58.92 -33.0 70.07 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.219 -179.859 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 372' ' ' SER . . . . . . . . . . . . . 79.1 p -76.82 -58.01 3.52 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.417 -0.356 . . . . 0.0 111.409 -179.475 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 373' ' ' MET . . . . . . . . . . . . . 20.4 ptm -55.59 -26.81 45.84 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.382 -0.372 . . . . 0.0 111.605 -179.451 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 374' ' ' ALA . . . . . . . . . . . . . . . -87.04 -44.04 11.87 Favored 'General case' 0 C--N 1.33 -0.271 0 N-CA-C 111.692 0.256 . . . . 0.0 111.692 -179.722 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 375' ' ' ARG . . . . . 0.644 ' HB2' ' HG2' ' B' ' 303' ' ' GLU . 21.4 tpp180 -64.89 -26.67 68.42 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.83 0.348 . . . . 0.0 110.753 -179.969 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 376' ' ' GLN . . . . . . . . . . . . . 15.1 mm100 -69.59 -7.32 37.58 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.045 179.852 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 377' ' ' ARG . . . . . 0.566 ' HG3' ' H ' ' B' ' 382' ' ' ASP . 74.2 ttt180 -58.99 -37.63 77.31 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.907 0.384 . . . . 0.0 110.609 179.69 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 378' ' ' ARG . . . . . 0.43 ' HD3' ' N ' ' A' ' 378' ' ' ARG . 0.1 OUTLIER -100.95 146.45 27.37 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.848 179.884 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 379' ' ' ALA . . . . . . . . . . . . . . . -90.66 120.33 31.64 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.05 179.972 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 380' ' ' SER . . . . . . . . . . . . . 68.8 p . . . . . 0 C--O 1.249 1.047 0 CA-C-O 118.128 -0.939 . . . . 0.0 110.946 -179.973 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' B' B ' 295' ' ' SER . . . . . . . . . . . . . 52.6 m . . . . . 0 N--CA 1.484 1.266 0 CA-C-O 120.692 0.282 . . . . 0.0 110.958 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' B' B ' 296' ' ' LEU . . . . . . . . . . . . . 59.1 mt 60.7 100.73 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.148 179.905 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 297' ' ' GLN . . . . . . . . . . . . . 57.3 tp60 -163.61 -42.95 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.835 179.977 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 298' ' ' ASN . . . . . . . . . . . . . 26.1 p-10 -137.91 15.11 2.88 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.815 -179.911 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 299' ' ' ASN . . . . . . . . . . . . . 13.7 m120 -85.59 1.24 49.95 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.119 -0.492 . . . . 0.0 111.128 -179.816 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 300' ' ' GLN . . . . . 0.494 ' N ' ' HD2' ' B' ' 301' ' ' PRO . 6.1 tp-100 -82.51 -51.09 0.75 Allowed Pre-proline 0 CA--C 1.534 0.363 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.425 -179.935 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 301' ' ' PRO . . . . . 0.57 ' HB2' ' HB3' ' B' ' 304' ' ' PHE . 54.3 Cg_endo -69.24 118.93 5.98 Favored 'Trans proline' 0 C--N 1.354 0.819 0 C-N-CA 122.09 1.86 . . . . 0.0 112.124 179.883 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 302' ' ' VAL . . . . . 0.459 HG21 ' H ' ' B' ' 303' ' ' GLU . 8.8 m -92.12 -55.15 6.46 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.752 -179.738 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 303' ' ' GLU . . . . . 0.644 ' HG2' ' HB2' ' A' ' 375' ' ' ARG . 0.0 OUTLIER -72.26 -30.92 65.31 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.266 -0.425 . . . . 0.0 111.72 -179.273 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 304' ' ' PHE . . . . . 0.57 ' HB3' ' HB2' ' B' ' 301' ' ' PRO . 84.7 t80 -72.65 -51.05 21.14 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.678 0.275 . . . . 0.0 110.915 -179.663 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 305' ' ' ASN . . . . . 0.437 HD21 HD13 ' B' ' 308' ' ' ILE . 3.0 t-20 -64.46 -40.39 95.62 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.858 -179.975 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 306' ' ' HIS . . . . . . . . . . . . . 15.6 t-160 -66.8 -39.48 87.75 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.344 -0.389 . . . . 0.0 111.011 179.954 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 307' ' ' ALA . . . . . . . . . . . . . . . -67.09 -49.93 63.31 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.39 -0.368 . . . . 0.0 111.58 -179.712 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 308' ' ' ILE . . . . . 0.437 HD13 HD21 ' B' ' 305' ' ' ASN . 47.6 pt -62.38 -38.41 81.16 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.221 0 CA-C-O 120.682 0.277 . . . . 0.0 111.204 -179.681 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 309' ' ' ASN . . . . . 0.407 ' N ' HG13 ' B' ' 308' ' ' ILE . 95.9 m-20 -70.41 -32.64 70.34 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.404 -0.362 . . . . 0.0 110.605 179.681 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 310' ' ' TYR . . . . . . . . . . . . . 49.3 t80 -67.07 -51.63 52.07 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.607 179.808 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 311' ' ' VAL . . . . . . . . . . . . . 97.8 t -60.27 -43.8 94.25 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.212 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.605 179.338 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 312' ' ' ASN . . . . . . . . . . . . . 2.9 t-20 -64.37 -31.69 72.99 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.513 179.578 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 313' ' ' LYS . . . . . . . . . . . . . 20.6 tttp -65.04 -56.8 10.95 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.912 -0.586 . . . . 0.0 110.672 179.648 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 314' ' ' ILE . . . . . . . . . . . . . 30.3 mt -62.61 -28.87 45.65 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.777 -179.912 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 315' ' ' LYS . . . . . . . . . . . . . 22.1 ttmm -70.47 -36.75 74.07 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.74 179.726 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 316' ' ' ASN . . . . . . . . . . . . . 66.5 m-20 -82.23 -58.78 2.8 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.942 -0.572 . . . . 0.0 111.445 -179.8 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 317' ' ' ARG . . . . . . . . . . . . . 25.4 tpp180 -54.13 -64.4 0.84 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.096 179.988 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 318' ' ' PHE . . . . . . . . . . . . . 91.6 m-85 -86.71 42.8 1.03 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.97 179.896 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 319' ' ' GLN . . . . . . . . . . . . . 6.6 tp-100 -68.39 -22.57 64.63 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.821 179.904 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 320' ' ' GLY . . . . . . . . . . . . . . . -89.02 -15.77 58.76 Favored Glycine 0 N--CA 1.452 -0.291 0 C-N-CA 120.761 -0.733 . . . . 0.0 112.507 179.969 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 321' ' ' GLN . . . . . . . . . . . . . 2.2 mp0 -111.24 91.89 14.56 Favored Pre-proline 0 C--N 1.33 -0.267 0 CA-C-O 120.586 0.231 . . . . 0.0 110.958 -179.975 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 322' ' ' PRO . . . . . . . . . . . . . 96.7 Cg_endo -82.24 -18.28 7.37 Favored 'Trans proline' 0 C--N 1.348 0.513 0 C-N-CA 122.625 2.217 . . . . 0.0 112.392 179.875 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 323' ' ' ASP . . . . . . . . . . . . . 18.0 t70 -69.65 -50.58 42.76 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.701 -179.907 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 324' ' ' ILE . . . . . . . . . . . . . 56.3 mt -64.58 -43.86 96.76 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-N 116.081 -0.508 . . . . 0.0 110.85 179.857 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 325' ' ' TYR . . . . . . . . . . . . . 25.8 t80 -59.61 -48.18 82.67 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.647 179.822 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 326' ' ' LYS . . . . . . . . . . . . . 60.6 tttm -60.05 -45.51 92.63 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.937 -179.972 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 327' ' ' ALA . . . . . . . . . . . . . . . -55.08 -50.47 69.08 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.123 179.944 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 328' ' ' PHE . . . . . . . . . . . . . 66.3 t80 -55.78 -49.33 73.45 Favored 'General case' 0 C--O 1.234 0.273 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.53 179.781 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 329' ' ' LEU . . . . . 0.508 HD12 ' HG3' ' A' ' 362' ' ' MET . 93.1 mt -56.26 -34.3 66.28 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.53 179.541 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 330' ' ' GLU . . . . . . . . . . . . . 19.4 mm-40 -69.56 -37.45 77.02 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.869 179.85 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 331' ' ' ILE . . . . . 0.422 HG22 HG21 ' B' ' 358' ' ' VAL . 71.0 mt -62.48 -48.21 89.36 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-N 116.391 -0.368 . . . . 0.0 110.433 179.358 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 332' ' ' LEU . . . . . . . . . . . . . 10.7 mp -68.53 -31.03 69.97 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.97 179.786 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 333' ' ' HIS . . . . . . . . . . . . . 40.4 t60 -63.97 -59.52 4.39 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.93 0.395 . . . . 0.0 110.231 179.532 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 334' ' ' THR . . . . . 0.419 HG23 HD13 ' B' ' 353' ' ' LEU . 94.6 m -58.03 -38.97 77.22 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.87 -0.604 . . . . 0.0 110.471 179.366 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 335' ' ' TYR . . . . . . . . . . . . . 75.2 t80 -58.14 -43.85 87.51 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.744 -0.662 . . . . 0.0 110.306 179.509 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 336' ' ' GLN . . . . . 0.546 HE22 ' HB2' ' A' ' 365' ' ' SER . 8.1 tt0 -64.57 -42.57 95.55 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.769 -0.651 . . . . 0.0 110.802 179.974 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 337' ' ' LYS . . . . . . . . . . . . . 28.2 ttpp -58.3 -41.38 84.35 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.734 179.82 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 338' ' ' GLU . . . . . . . . . . . . . 24.9 mm-40 -66.13 -42.23 89.43 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.884 179.661 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 339' ' ' GLN . . . . . 0.418 HE21 ' HB3' ' B' ' 339' ' ' GLN . 1.0 OUTLIER -59.97 -49.29 78.24 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.13 -0.487 . . . . 0.0 110.593 179.668 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 340' ' ' ARG . . . . . . . . . . . . . 99.6 mtt180 -57.0 -53.82 53.7 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.896 179.867 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 341' ' ' ASN . . . . . . . . . . . . . 14.6 m120 -53.63 -38.47 64.1 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.936 179.923 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 342' ' ' ALA . . . . . . . . . . . . . . . -68.41 -32.95 73.36 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.92 179.875 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 343' ' ' LYS . . . . . . . . . . . . . 61.2 tttp -68.94 -49.23 59.85 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.092 -0.504 . . . . 0.0 111.006 179.822 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 344' ' ' GLU . . . . . . . . . . . . . 14.8 mm-40 -65.15 -36.03 82.97 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.236 -179.817 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 345' ' ' ALA . . . . . . . . . . . . . . . -57.82 -37.48 73.89 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.253 -179.965 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 346' ' ' GLY . . . . . . . . . . . . . . . 70.97 58.36 5.73 Favored Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 120.72 -0.752 . . . . 0.0 112.37 -179.856 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 347' ' ' GLY . . . . . . . . . . . . . . . 79.35 179.02 51.75 Favored Glycine 0 N--CA 1.45 -0.368 0 C-N-CA 120.773 -0.727 . . . . 0.0 112.397 -179.854 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 348' ' ' ASN . . . . . . . . . . . . . 18.5 m120 57.13 20.43 5.57 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.598 0.237 . . . . 0.0 111.283 179.988 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 349' ' ' TYR . . . . . . . . . . . . . 50.0 t80 -122.45 146.53 47.28 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.424 -0.353 . . . . 0.0 110.918 -180.0 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 350' ' ' THR . . . . . . . . . . . . . 59.8 m -120.71 101.46 45.7 Favored Pre-proline 0 C--N 1.328 -0.341 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.017 -179.866 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 351' ' ' PRO . . . . . . . . . . . . . 46.2 Cg_exo -56.36 170.67 1.13 Allowed 'Trans proline' 0 C--N 1.35 0.619 0 C-N-CA 122.505 2.137 . . . . 0.0 112.126 179.795 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 352' ' ' ALA . . . . . . . . . . . . . . . -98.41 -69.44 0.76 Allowed 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.378 -0.374 . . . . 0.0 111.458 -179.858 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 353' ' ' LEU . . . . . 0.419 HD13 HG23 ' B' ' 334' ' ' THR . 6.2 mp -87.62 119.68 28.16 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.308 -0.405 . . . . 0.0 111.205 -179.777 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 354' ' ' THR . . . . . . . . . . . . . 81.7 p -107.42 -175.16 2.71 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.978 -0.556 . . . . 0.0 110.368 179.342 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 355' ' ' GLU . . . . . . . . . . . . . 39.9 mt-10 -54.36 -35.93 63.29 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.056 0.455 . . . . 0.0 110.484 179.718 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 356' ' ' GLN . . . . . . . . . . . . . 22.6 mt-30 -72.93 -41.22 64.75 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.928 -179.998 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 357' ' ' GLU . . . . . 0.412 ' HG2' ' HG ' ' B' ' 353' ' ' LEU . 5.3 tp10 -57.52 -50.72 72.14 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.933 0.397 . . . . 0.0 110.58 -179.914 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 358' ' ' VAL . . . . . 0.44 ' O ' HG21 ' B' ' 362' ' ' VAL . 55.0 t -64.33 -58.88 5.38 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 115.982 -0.554 . . . . 0.0 111.013 179.887 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 359' ' ' TYR . . . . . . . . . . . . . 39.0 t80 -51.14 -27.16 7.87 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.491 -0.322 . . . . 0.0 111.279 -179.452 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 360' ' ' ALA . . . . . . . . . . . . . . . -74.09 -54.21 8.31 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.77 0.319 . . . . 0.0 110.838 179.59 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 361' ' ' GLN . . . . . . . . . . . . . 77.2 mt-30 -60.54 -36.01 77.39 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.527 179.705 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 362' ' ' VAL . . . . . 0.44 HG21 ' O ' ' B' ' 358' ' ' VAL . 51.2 t -70.02 -40.31 78.38 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.214 0 CA-C-N 116.013 -0.54 . . . . 0.0 110.347 179.538 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 363' ' ' ALA . . . . . 0.584 ' HA ' HD21 ' B' ' 373' ' ' LEU . . . -61.82 -38.09 86.86 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.346 179.414 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 364' ' ' ARG . . . . . . . . . . . . . 38.3 ttm180 -80.08 -23.84 41.02 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.783 -0.644 . . . . 0.0 110.146 179.317 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 365' ' ' LEU . . . . . . . . . . . . . 2.5 tp -60.64 -29.03 69.0 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.487 179.627 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 366' ' ' PHE . . . . . . . . . . . . . 25.0 m-85 -125.55 -177.98 4.09 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.38 179.747 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 367' ' ' LYS . . . . . . . . . . . . . 68.4 mttm -137.4 -82.87 0.34 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.399 -0.364 . . . . 0.0 111.164 179.919 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 368' ' ' ASN . . . . . . . . . . . . . 27.6 p-10 -82.65 1.03 40.39 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.802 0.334 . . . . 0.0 110.918 179.995 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 369' ' ' GLN . . . . . . . . . . . . . 21.2 mp0 -98.32 58.14 1.26 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.6 179.842 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 370' ' ' GLU . . . . . . . . . . . . . 41.2 mt-10 -69.78 -13.0 62.06 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.852 -179.928 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 371' ' ' ASP . . . . . . . . . . . . . 11.6 m-20 -55.58 -39.69 71.03 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.459 179.809 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 372' ' ' LEU . . . . . . . . . . . . . 6.2 mp -69.97 -37.99 75.95 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.567 179.649 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 373' ' ' LEU . . . . . 0.584 HD21 ' HA ' ' B' ' 363' ' ' ALA . 2.7 mp -62.19 -34.65 76.85 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.844 179.828 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 374' ' ' SER . . . . . . . . . . . . . 51.0 m -73.44 -55.66 6.07 Favored 'General case' 0 C--O 1.234 0.28 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.261 179.335 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 375' ' ' GLU . . . . . . . . . . . . . 43.0 mt-10 -54.91 -33.25 61.89 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-N 115.934 -0.576 . . . . 0.0 110.26 179.357 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 376' ' ' PHE . . . . . 0.415 ' O ' ' HB2' ' B' ' 379' ' ' PHE . 87.3 t80 -82.27 -30.21 30.77 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.025 179.333 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 377' ' ' GLY . . . . . . . . . . . . . . . -61.93 -33.51 85.74 Favored Glycine 0 N--CA 1.448 -0.564 0 C-N-CA 120.474 -0.87 . . . . 0.0 111.207 179.114 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 378' ' ' GLN . . . . . . . . . . . . . 98.1 mt-30 -69.75 -29.25 66.56 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.798 0.332 . . . . 0.0 110.56 179.155 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 379' ' ' PHE . . . . . 0.415 ' HB2' ' O ' ' B' ' 376' ' ' PHE . 10.2 m-85 -61.15 -40.35 93.51 Favored 'General case' 0 C--N 1.333 -0.123 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.639 179.541 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 380' ' ' LEU . . . . . . . . . . . . . 95.3 mt -58.19 136.26 84.65 Favored Pre-proline 0 C--N 1.33 -0.265 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.526 179.848 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 381' ' ' PRO . . . . . . . . . . . . . 51.5 Cg_exo -52.73 120.38 7.45 Favored 'Trans proline' 0 C--N 1.348 0.508 0 C-N-CA 122.377 2.051 . . . . 0.0 112.251 -179.574 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 382' ' ' ASP . . . . . 0.566 ' H ' ' HG3' ' A' ' 377' ' ' ARG . 15.4 t70 -88.75 121.68 31.38 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.279 -0.418 . . . . 0.0 110.971 179.966 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 383' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.094 0 CA-C-O 118.21 -0.9 . . . . 0.0 111.086 179.991 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 358' ' ' ASP . . . . . . . . . . . . . 4.2 p30 . . . . . 0 N--CA 1.486 1.366 0 CA-C-O 120.771 0.319 . . . . 0.0 110.884 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 359' ' ' PHE . . . . . . . . . . . . . 81.0 t80 -154.5 133.95 12.68 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.865 179.987 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 360' ' ' THR . . . . . . . . . . . . . 65.1 p -94.24 151.71 39.72 Favored Pre-proline 0 C--N 1.329 -0.293 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.962 179.79 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 361' ' ' PRO . . . . . . . . . . . . . 28.1 Cg_endo -62.16 -172.29 0.11 Allowed 'Trans proline' 0 C--N 1.349 0.562 0 C-N-CA 122.509 2.139 . . . . 0.0 112.418 -179.852 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 362' ' ' MET . . . . . . . . . . . . . 26.6 ttt -52.23 -62.77 1.43 Allowed 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.842 -179.814 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 363' ' ' ASP . . . . . . . . . . . . . 15.6 t70 -170.7 -72.08 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.59 179.915 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 364' ' ' SER . . . . . . . . . . . . . 67.4 m -160.58 9.62 0.09 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.765 179.973 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 365' ' ' SER . . . . . . . . . . . . . 48.1 t -101.72 -52.13 3.27 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.282 -179.622 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 366' ' ' ALA . . . . . . . . . . . . . . . -58.55 -45.15 89.54 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.871 0.367 . . . . 0.0 111.353 -179.818 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 367' ' ' VAL . . . . . . . . . . . . . 28.0 m -68.3 -29.51 44.54 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.354 -179.925 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 368' ' ' TYR . . . . . . . . . . . . . 71.3 t80 -72.1 -47.65 49.7 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.47 -0.332 . . . . 0.0 111.252 -179.749 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 369' ' ' VAL . . . . . . . . . . . . . 13.3 m -64.58 -48.37 85.13 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.487 -0.324 . . . . 0.0 111.273 -179.846 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 370' ' ' LEU . . . . . 0.553 HD21 ' HA ' ' B' ' 307' ' ' ALA . 8.3 mp -62.97 -42.92 99.97 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.645 -0.252 . . . . 0.0 111.362 179.997 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 371' ' ' SER . . . . . 0.409 ' O ' ' HB2' ' A' ' 375' ' ' ARG . 88.7 p -57.46 -60.3 3.86 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.481 -0.327 . . . . 0.0 110.942 179.957 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 372' ' ' SER . . . . . . . . . . . . . 44.1 t -62.96 -24.2 67.77 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.31 -0.405 . . . . 0.0 111.15 -179.783 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 373' ' ' MET . . . . . . . . . . . . . 50.6 tpp -65.11 -49.16 71.06 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.797 0.332 . . . . 0.0 111.196 -179.939 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 374' ' ' ALA . . . . . . . . . . . . . . . -85.32 -17.37 37.03 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.818 -179.391 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 375' ' ' ARG . . . . . 0.409 ' HB2' ' O ' ' A' ' 371' ' ' SER . 0.0 OUTLIER -88.3 -22.21 24.01 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.712 0.291 . . . . 0.0 111.083 -179.68 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 376' ' ' GLN . . . . . . . . . . . . . 57.6 tp60 -59.94 -82.97 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.429 -0.35 . . . . 0.0 110.749 -179.937 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 377' ' ' ARG . . . . . 0.451 ' HG2' ' H ' ' B' ' 382' ' ' ASP . 94.1 mtt180 53.49 -168.24 0.06 Allowed 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.275 179.709 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 378' ' ' ARG . . . . . 0.496 ' HA ' ' HE ' ' A' ' 378' ' ' ARG . 2.9 mmp_? -119.47 6.36 11.1 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.739 179.87 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 379' ' ' ALA . . . . . . . . . . . . . . . -123.35 109.69 14.22 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.088 -0.506 . . . . 0.0 111.108 179.926 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 380' ' ' SER . . . . . . . . . . . . . 71.6 p . . . . . 0 C--O 1.248 1.015 0 CA-C-O 118.334 -0.841 . . . . 0.0 110.881 -179.993 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' B' B ' 295' ' ' SER . . . . . . . . . . . . . 80.6 p . . . . . 0 N--CA 1.486 1.339 0 CA-C-O 120.76 0.314 . . . . 0.0 110.824 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' B' B ' 296' ' ' LEU . . . . . 0.419 HD23 ' N ' ' B' ' 296' ' ' LEU . 3.2 mm? -62.27 145.3 54.07 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.772 -179.946 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 297' ' ' GLN . . . . . . . . . . . . . 57.3 tp60 -138.12 124.07 20.12 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.965 -179.842 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 298' ' ' ASN . . . . . . . . . . . . . 3.0 m-20 -101.5 129.37 47.56 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.823 179.945 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 299' ' ' ASN . . . . . . . . . . . . . 7.1 t30 -137.76 -71.68 0.43 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.74 179.901 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 300' ' ' GLN . . . . . 0.604 ' HB3' ' HD3' ' B' ' 301' ' ' PRO . 29.9 tt0 -105.44 -50.2 0.11 Allowed Pre-proline 0 CA--C 1.535 0.37 0 CA-C-N 116.119 -0.492 . . . . 0.0 111.489 179.752 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 301' ' ' PRO . . . . . 0.604 ' HD3' ' HB3' ' B' ' 300' ' ' GLN . 7.1 Cg_exo -73.97 78.46 2.52 Favored 'Trans proline' 0 C--N 1.353 0.81 0 C-N-CA 122.41 2.074 . . . . 0.0 112.381 -179.969 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 302' ' ' VAL . . . . . 0.501 ' HA ' HD22 ' B' ' 305' ' ' ASN . 7.7 p -92.41 -44.75 14.16 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.03 179.815 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 303' ' ' GLU . . . . . . . . . . . . . 29.1 mt-10 -58.15 -33.83 69.63 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.888 -179.958 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 304' ' ' PHE . . . . . . . . . . . . . 76.5 t80 -58.05 -76.94 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.895 -0.593 . . . . 0.0 111.225 -179.612 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 305' ' ' ASN . . . . . 0.501 HD22 ' HA ' ' B' ' 302' ' ' VAL . 9.5 p30 -49.36 -38.8 29.55 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.757 -179.507 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 306' ' ' HIS . . . . . . . . . . . . . 2.0 m-70 -59.24 -74.63 0.07 Allowed 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 112.301 0.482 . . . . 0.0 112.301 -179.391 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 307' ' ' ALA . . . . . 0.553 ' HA ' HD21 ' A' ' 370' ' ' LEU . . . -56.48 -44.75 80.93 Favored 'General case' 0 C--N 1.33 -0.26 0 N-CA-C 112.455 0.539 . . . . 0.0 112.455 -178.542 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 308' ' ' ILE . . . . . . . . . . . . . 46.4 mm -58.11 -64.24 0.57 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 N-CA-C 111.737 0.273 . . . . 0.0 111.737 -179.51 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 309' ' ' ASN . . . . . . . . . . . . . 49.9 t30 -50.77 -37.29 41.32 Favored 'General case' 0 N--CA 1.463 0.196 0 CA-C-O 120.735 0.303 . . . . 0.0 110.972 -179.692 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 310' ' ' TYR . . . . . 0.506 ' O ' HG12 ' B' ' 314' ' ' ILE . 90.9 t80 -58.32 -65.92 0.57 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.731 179.705 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 311' ' ' VAL . . . . . . . . . . . . . 59.6 t -51.23 -29.39 8.57 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.378 -0.374 . . . . 0.0 111.163 -179.759 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 312' ' ' ASN . . . . . . . . . . . . . 27.0 t-20 -65.04 -57.09 9.56 Favored 'General case' 0 C--O 1.234 0.262 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.596 -179.832 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 313' ' ' LYS . . . . . 0.437 ' HZ2' ' HG2' ' B' ' 375' ' ' GLU . 0.1 OUTLIER -65.62 -28.95 69.49 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 120.587 0.232 . . . . 0.0 111.623 -179.371 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 314' ' ' ILE . . . . . 0.506 HG12 ' O ' ' B' ' 310' ' ' TYR . 20.3 mm -67.7 -44.98 85.57 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-O 120.879 0.371 . . . . 0.0 110.841 179.791 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 315' ' ' LYS . . . . . 0.439 ' HE3' ' HB3' ' B' ' 315' ' ' LYS . 1.2 tmmt? -67.34 -42.37 83.66 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.897 -179.988 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 316' ' ' ASN . . . . . . . . . . . . . 6.0 t30 -61.14 -54.39 45.1 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.398 -0.364 . . . . 0.0 111.326 -179.73 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 317' ' ' ARG . . . . . . . . . . . . . 27.9 mmm180 -59.68 -24.33 63.84 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.831 0.348 . . . . 0.0 111.123 -179.875 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 318' ' ' PHE . . . . . . . . . . . . . 34.9 m-85 -114.46 36.76 3.63 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.809 179.837 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 319' ' ' GLN . . . . . . . . . . . . . 32.1 tt0 -64.84 -18.15 64.89 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.903 -0.589 . . . . 0.0 110.893 -179.996 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 320' ' ' GLY . . . . . . . . . . . . . . . -115.64 27.03 8.6 Favored Glycine 0 N--CA 1.452 -0.269 0 C-N-CA 120.851 -0.69 . . . . 0.0 112.591 -179.956 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 321' ' ' GLN . . . . . 0.554 ' HA ' HE21 ' B' ' 321' ' ' GLN . 0.1 OUTLIER -148.74 89.32 5.03 Favored Pre-proline 0 C--N 1.329 -0.302 0 CA-C-O 120.517 0.199 . . . . 0.0 110.717 179.946 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 322' ' ' PRO . . . . . . . . . . . . . 87.8 Cg_endo -81.27 -22.04 6.09 Favored 'Trans proline' 0 C--N 1.347 0.459 0 C-N-CA 122.608 2.205 . . . . 0.0 112.827 -179.764 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 323' ' ' ASP . . . . . . . . . . . . . 6.4 p-10 -68.37 -53.92 20.75 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.495 -0.321 . . . . 0.0 111.219 -179.667 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 324' ' ' ILE . . . . . . . . . . . . . 56.1 mt -64.89 -44.41 96.22 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-O 120.786 0.326 . . . . 0.0 111.007 179.958 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 325' ' ' TYR . . . . . . . . . . . . . 37.3 t80 -58.72 -43.39 90.14 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.599 179.89 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 326' ' ' LYS . . . . . . . . . . . . . 63.3 tttm -62.85 -43.82 97.76 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.449 179.54 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 327' ' ' ALA . . . . . . . . . . . . . . . -55.9 -44.27 78.05 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.78 179.547 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 328' ' ' PHE . . . . . . . . . . . . . 71.5 t80 -60.67 -50.63 72.72 Favored 'General case' 0 C--O 1.233 0.223 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.484 179.732 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 329' ' ' LEU . . . . . . . . . . . . . 95.6 mt -58.3 -28.85 65.38 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 115.816 -0.629 . . . . 0.0 110.863 179.662 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 330' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 -73.07 -41.23 64.33 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.894 179.845 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 331' ' ' ILE . . . . . 0.444 HG21 HG22 ' B' ' 358' ' ' VAL . 78.8 mt -62.01 -44.51 99.05 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.199 0 CA-C-O 120.852 0.358 . . . . 0.0 110.357 179.227 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 332' ' ' LEU . . . . . . . . . . . . . 9.6 mp -69.37 -34.98 75.36 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.619 179.603 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 333' ' ' HIS . . . . . . . . . . . . . 49.4 t-80 -62.59 -53.87 48.12 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.297 179.428 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 334' ' ' THR . . . . . . . . . . . . . 86.0 m -59.87 -38.94 83.59 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.306 179.303 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 335' ' ' TYR . . . . . . . . . . . . . 55.6 t80 -62.04 -37.83 86.42 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.211 179.396 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 336' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -64.85 -47.98 75.95 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 115.76 -0.654 . . . . 0.0 110.372 179.806 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 337' ' ' LYS . . . . . . . . . . . . . 39.5 ttpt -55.17 -48.11 74.22 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.66 179.575 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 338' ' ' GLU . . . . . 0.4 ' HB3' ' HB3' ' B' ' 351' ' ' PRO . 13.6 mm-40 -60.37 -40.36 90.55 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.71 179.685 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 339' ' ' GLN . . . . . . . . . . . . . 8.6 tp-100 -58.27 -44.9 88.63 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.741 179.883 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 340' ' ' ARG . . . . . . . . . . . . . 59.1 mtp180 -62.02 -53.28 57.77 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.433 179.755 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 341' ' ' ASN . . . . . . . . . . . . . 86.6 m-20 -53.37 -31.87 46.67 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.846 -0.616 . . . . 0.0 110.577 179.341 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 342' ' ' ALA . . . . . . . . . . . . . . . -74.28 -43.15 58.06 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.97 -0.559 . . . . 0.0 111.13 179.932 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 343' ' ' LYS . . . . . . . . . . . . . 64.0 tttm -75.6 -11.8 60.09 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.709 -179.966 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 344' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -92.41 -40.48 10.85 Favored 'General case' 0 N--CA 1.453 -0.298 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.478 179.786 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 345' ' ' ALA . . . . . . . . . . . . . . . -61.41 -26.2 67.7 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.985 179.926 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 346' ' ' GLY . . . . . . . . . . . . . . . 76.76 33.46 46.67 Favored Glycine 0 N--CA 1.451 -0.326 0 C-N-CA 120.784 -0.722 . . . . 0.0 112.692 179.85 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 347' ' ' GLY . . . . . . . . . . . . . . . 99.75 176.7 30.96 Favored Glycine 0 N--CA 1.452 -0.262 0 C-N-CA 120.742 -0.742 . . . . 0.0 112.569 179.938 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 348' ' ' ASN . . . . . . . . . . . . . 66.1 t30 60.27 14.96 4.97 Favored 'General case' 0 C--N 1.333 -0.122 0 CA-C-O 120.979 0.419 . . . . 0.0 110.795 -179.979 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 349' ' ' TYR . . . . . . . . . . . . . 59.8 t80 -117.73 124.95 49.74 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.817 179.994 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 350' ' ' THR . . . . . . . . . . . . . 61.4 m -105.81 103.52 44.43 Favored Pre-proline 0 C--N 1.33 -0.264 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.009 179.95 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 351' ' ' PRO . . . . . 0.4 ' HB3' ' HB3' ' B' ' 338' ' ' GLU . 47.0 Cg_exo -56.61 166.79 3.32 Favored 'Trans proline' 0 C--N 1.349 0.562 0 C-N-CA 122.5 2.133 . . . . 0.0 112.43 179.902 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 352' ' ' ALA . . . . . . . . . . . . . . . -83.08 -63.15 1.42 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.041 179.868 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 353' ' ' LEU . . . . . . . . . . . . . 6.3 mp -88.12 116.51 26.36 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.137 -179.99 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 354' ' ' THR . . . . . . . . . . . . . 61.3 p -111.25 -166.06 1.04 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.269 179.397 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 355' ' ' GLU . . . . . . . . . . . . . 8.1 pt-20 -56.8 -42.29 79.27 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.912 0.387 . . . . 0.0 110.638 179.616 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 356' ' ' GLN . . . . . . . . . . . . . 15.0 mm100 -68.07 -42.6 80.2 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.875 -0.602 . . . . 0.0 111.42 -179.888 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 357' ' ' GLU . . . . . . . . . . . . . 5.0 tp10 -60.31 -51.45 69.49 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.515 -0.311 . . . . 0.0 111.082 -179.584 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 358' ' ' VAL . . . . . 0.474 ' O ' HG21 ' B' ' 362' ' ' VAL . 4.4 t -60.41 -59.84 3.5 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.352 -0.386 . . . . 0.0 111.24 179.941 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 359' ' ' TYR . . . . . . . . . . . . . 4.4 t80 -51.97 -31.65 30.09 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.616 -0.266 . . . . 0.0 111.05 -179.285 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 360' ' ' ALA . . . . . . . . . . . . . . . -67.99 -59.71 3.06 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.527 -0.306 . . . . 0.0 110.954 179.659 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 361' ' ' GLN . . . . . . . . . . . . . 14.7 mm100 -53.43 -40.49 65.2 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.264 -0.426 . . . . 0.0 110.722 179.7 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 362' ' ' VAL . . . . . 0.474 HG21 ' O ' ' B' ' 358' ' ' VAL . 60.2 t -68.81 -37.03 76.88 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.366 179.502 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 363' ' ' ALA . . . . . 0.571 ' HA ' HD13 ' B' ' 373' ' ' LEU . . . -60.54 -35.72 76.69 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 121.042 0.449 . . . . 0.0 110.003 179.136 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 364' ' ' ARG . . . . . . . . . . . . . 77.3 ttt180 -86.16 -20.02 29.24 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.673 -0.694 . . . . 0.0 109.799 179.048 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 365' ' ' LEU . . . . . . . . . . . . . 24.8 tp -65.6 -42.33 91.75 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 115.594 -0.73 . . . . 0.0 110.393 179.497 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 366' ' ' PHE . . . . . . . . . . . . . 25.4 m-85 -112.83 144.5 42.27 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.289 179.358 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 367' ' ' LYS . . . . . . . . . . . . . 37.4 mtmm -120.76 -79.73 0.61 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.691 0.281 . . . . 0.0 111.358 -179.754 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 368' ' ' ASN . . . . . . . . . . . . . 33.6 m-80 -70.99 -14.83 62.49 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.341 -0.39 . . . . 0.0 110.938 -179.842 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 369' ' ' GLN . . . . . 0.411 HE21 ' HB2' ' B' ' 369' ' ' GLN . 17.4 mt-30 -107.7 94.03 4.86 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.0 179.932 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 370' ' ' GLU . . . . . . . . . . . . . 45.1 mt-10 -93.56 -5.06 49.79 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.996 -179.982 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 371' ' ' ASP . . . . . . . . . . . . . 8.9 m-20 -47.29 -63.78 0.95 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.322 -179.856 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 372' ' ' LEU . . . . . 0.525 ' N ' HD12 ' B' ' 372' ' ' LEU . 0.0 OUTLIER -58.6 -33.34 69.88 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.37 -0.377 . . . . 0.0 111.172 -179.906 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 373' ' ' LEU . . . . . 0.571 HD13 ' HA ' ' B' ' 363' ' ' ALA . 5.4 tp -58.54 -52.93 63.59 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.112 -0.494 . . . . 0.0 111.236 -179.399 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 374' ' ' SER . . . . . . . . . . . . . 46.7 t -64.95 -46.21 82.54 Favored 'General case' 0 C--O 1.233 0.23 0 CA-C-O 120.942 0.401 . . . . 0.0 110.536 179.788 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 375' ' ' GLU . . . . . 0.437 ' HG2' ' HZ2' ' B' ' 313' ' ' LYS . 10.5 tp10 -54.36 -35.11 62.43 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.792 -0.64 . . . . 0.0 110.441 179.647 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 376' ' ' PHE . . . . . 0.433 ' HB2' ' HH ' ' B' ' 310' ' ' TYR . 85.9 t80 -78.31 -32.77 49.46 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.089 179.49 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 377' ' ' GLY . . . . . . . . . . . . . . . -60.99 -36.0 91.57 Favored Glycine 0 N--CA 1.449 -0.481 0 C-N-CA 120.805 -0.712 . . . . 0.0 111.977 179.581 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 378' ' ' GLN . . . . . . . . . . . . . 88.5 mt-30 -55.49 -28.33 53.96 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-O 120.826 0.346 . . . . 0.0 110.67 179.497 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 379' ' ' PHE . . . . . 0.447 ' HB3' ' H ' ' B' ' 380' ' ' LEU . 67.0 m-85 -72.69 -146.2 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.399 179.39 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 380' ' ' LEU . . . . . 0.447 ' H ' ' HB3' ' B' ' 379' ' ' PHE . 40.4 mt 67.13 143.18 0.08 OUTLIER Pre-proline 0 N--CA 1.462 0.173 0 CA-C-N 116.492 -0.322 . . . . 0.0 110.871 -179.874 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 381' ' ' PRO . . . . . . . . . . . . . 52.2 Cg_exo -53.08 116.78 3.16 Favored 'Trans proline' 0 C--N 1.347 0.456 0 C-N-CA 122.563 2.176 . . . . 0.0 112.398 -179.988 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 382' ' ' ASP . . . . . 0.451 ' H ' ' HG2' ' A' ' 377' ' ' ARG . 15.4 t70 -64.38 138.96 58.7 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.993 -179.973 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 383' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.083 0 CA-C-O 118.352 -0.833 . . . . 0.0 111.098 179.949 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 358' ' ' ASP . . . . . . . . . . . . . 4.2 p30 . . . . . 0 N--CA 1.486 1.329 0 CA-C-O 120.795 0.331 . . . . 0.0 110.866 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 359' ' ' PHE . . . . . . . . . . . . . 43.7 p90 -141.56 139.66 33.22 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.862 179.978 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 360' ' ' THR . . . . . . . . . . . . . 28.7 m -91.54 128.97 44.49 Favored Pre-proline 0 C--N 1.328 -0.341 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.051 -179.87 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 361' ' ' PRO . . . . . . . . . . . . . 43.4 Cg_exo -57.36 -58.86 0.72 Allowed 'Trans proline' 0 C--N 1.349 0.588 0 C-N-CA 122.494 2.13 . . . . 0.0 112.59 -179.978 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 362' ' ' MET . . . . . 0.5 ' HB2' HD11 ' B' ' 329' ' ' LEU . 27.0 ttt -117.76 -71.38 0.74 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.009 -179.771 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 363' ' ' ASP . . . . . . . . . . . . . 24.9 t70 -168.83 -35.85 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.886 -0.597 . . . . 0.0 110.544 -179.936 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 364' ' ' SER . . . . . . . . . . . . . 44.3 t -115.76 -71.26 0.75 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.934 -0.575 . . . . 0.0 110.675 179.704 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 365' ' ' SER . . . . . . . . . . . . . 47.7 t -169.57 82.69 0.12 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.048 -0.524 . . . . 0.0 111.128 179.925 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 366' ' ' ALA . . . . . . . . . . . . . . . -78.33 -22.48 48.0 Favored 'General case' 0 C--O 1.237 0.418 0 CA-C-O 121.229 0.538 . . . . 0.0 110.333 179.429 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 367' ' ' VAL . . . . . . . . . . . . . 32.7 m -59.66 -29.05 41.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 115.441 -0.799 . . . . 0.0 110.52 179.533 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 368' ' ' TYR . . . . . . . . . . . . . 91.6 t80 -62.43 -42.27 99.33 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.35 179.452 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 369' ' ' VAL . . . . . . . . . . . . . 18.6 t -68.29 -52.76 34.25 Favored 'Isoleucine or valine' 0 C--O 1.234 0.285 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.635 179.641 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 370' ' ' LEU . . . . . . . . . . . . . 97.0 mt -57.16 -36.07 70.31 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.995 179.923 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 371' ' ' SER . . . . . . . . . . . . . 67.7 m -69.49 -41.69 75.8 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.587 179.773 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 372' ' ' SER . . . . . . . . . . . . . 64.4 m -61.31 -35.14 76.54 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.642 179.746 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 373' ' ' MET . . . . . . . . . . . . . 65.4 mtt -70.44 -48.54 55.5 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.313 179.728 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 374' ' ' ALA . . . . . . . . . . . . . . . -72.92 -19.2 61.31 Favored 'General case' 0 C--N 1.331 -0.239 0 N-CA-C 112.054 0.39 . . . . 0.0 112.054 -179.283 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 375' ' ' ARG . . . . . . . . . . . . . 28.9 mmt180 -90.84 -32.67 15.97 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 111.582 0.216 . . . . 0.0 111.582 -179.584 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 376' ' ' GLN . . . . . 0.48 ' HG3' ' H ' ' A' ' 378' ' ' ARG . 6.3 tp-100 -61.04 -87.32 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.677 0.275 . . . . 0.0 110.814 -179.996 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 377' ' ' ARG . . . . . . . . . . . . . 75.5 mtp180 57.46 13.28 1.76 Allowed 'General case' 0 N--CA 1.462 0.131 0 CA-C-N 116.4 -0.364 . . . . 0.0 111.48 179.682 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 378' ' ' ARG . . . . . 0.48 ' H ' ' HG3' ' A' ' 376' ' ' GLN . 37.2 mmt180 -103.12 141.84 35.15 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.422 -0.354 . . . . 0.0 110.927 179.985 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 379' ' ' ALA . . . . . . . . . . . . . . . -96.94 -66.69 0.89 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.078 179.944 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 380' ' ' SER . . . . . . . . . . . . . 49.3 m . . . . . 0 C--O 1.249 1.068 0 CA-C-O 118.286 -0.864 . . . . 0.0 110.898 179.97 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' B' B ' 295' ' ' SER . . . . . . . . . . . . . 52.8 m . . . . . 0 N--CA 1.485 1.324 0 CA-C-O 120.753 0.311 . . . . 0.0 110.888 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' B' B ' 296' ' ' LEU . . . . . 0.448 HD21 ' N ' ' B' ' 296' ' ' LEU . 2.9 mm? -77.36 -23.59 50.8 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.662 179.717 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 297' ' ' GLN . . . . . . . . . . . . . 25.8 mt-30 -87.37 161.67 17.77 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.751 179.86 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 298' ' ' ASN . . . . . . . . . . . . . 24.4 p-10 -127.89 164.29 22.58 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.244 -0.434 . . . . 0.0 111.035 -179.949 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 299' ' ' ASN . . . . . . . . . . . . . 19.0 m120 -147.08 154.14 40.81 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.72 179.838 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 300' ' ' GLN . . . . . . . . . . . . . 77.3 mt-30 -113.81 151.48 44.74 Favored Pre-proline 0 C--N 1.331 -0.228 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.853 179.978 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 301' ' ' PRO . . . . . . . . . . . . . 57.9 Cg_endo -71.26 135.18 26.37 Favored 'Trans proline' 0 C--N 1.347 0.477 0 C-N-CA 122.44 2.093 . . . . 0.0 112.277 179.933 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 302' ' ' VAL . . . . . . . . . . . . . 35.9 m -72.44 -12.47 15.79 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.093 -179.942 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 303' ' ' GLU . . . . . . . . . . . . . 46.5 mt-10 -58.04 -83.25 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.0 -0.545 . . . . 0.0 111.422 -179.724 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 304' ' ' PHE . . . . . . . . . . . . . 99.6 m-85 -59.97 -30.46 69.13 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.339 -179.583 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 305' ' ' ASN . . . . . . . . . . . . . 27.3 t-20 -58.21 -69.69 0.17 Allowed 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.402 -0.363 . . . . 0.0 111.45 -179.599 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 306' ' ' HIS . . . . . . . . . . . . . 20.5 m-70 -62.57 -47.16 85.04 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.123 -0.489 . . . . 0.0 112.147 -179.152 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 307' ' ' ALA . . . . . . . . . . . . . . . -56.61 -62.45 1.72 Allowed 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 112.361 0.504 . . . . 0.0 112.361 -178.921 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 308' ' ' ILE . . . . . . . . . . . . . 85.1 mt -56.56 -49.41 77.75 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.247 0 N-CA-C 111.644 0.239 . . . . 0.0 111.644 -179.335 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 309' ' ' ASN . . . . . . . . . . . . . 36.7 t30 -54.21 -42.73 70.12 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.885 0.374 . . . . 0.0 111.011 -179.82 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 310' ' ' TYR . . . . . 0.518 ' HH ' ' HB2' ' B' ' 376' ' ' PHE . 84.5 t80 -61.94 -62.78 1.54 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.949 -179.808 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 311' ' ' VAL . . . . . . . . . . . . . 43.6 t -54.24 -25.61 13.81 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-O 120.859 0.361 . . . . 0.0 110.978 -179.833 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 312' ' ' ASN . . . . . . . . . . . . . 2.8 t-20 -67.9 -56.71 8.03 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.026 -179.924 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 313' ' ' LYS . . . . . 0.446 ' HD3' ' N ' ' B' ' 314' ' ' ILE . 0.1 OUTLIER -65.32 -30.53 71.38 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.519 -0.309 . . . . 0.0 111.514 -179.592 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' B' B ' 314' ' ' ILE . . . . . 0.456 HG12 ' O ' ' B' ' 310' ' ' TYR . 25.9 mm -70.06 -40.55 78.55 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.197 0 CA-C-O 120.945 0.402 . . . . 0.0 110.744 179.578 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 315' ' ' LYS . . . . . 0.613 ' HZ2' ' HB2' ' B' ' 315' ' ' LYS . 4.3 ttmp? -66.92 -42.42 85.4 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.936 -0.574 . . . . 0.0 110.911 -179.899 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 316' ' ' ASN . . . . . . . . . . . . . 27.6 t-20 -64.19 -52.61 58.05 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.333 -179.713 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 317' ' ' ARG . . . . . 0.442 ' HA ' ' NE ' ' B' ' 317' ' ' ARG . 4.7 mmp_? -59.38 -60.75 3.36 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.904 0.383 . . . . 0.0 111.197 -179.873 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 318' ' ' PHE . . . . . . . . . . . . . 65.4 m-85 -85.23 38.14 0.71 Allowed 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.093 -0.503 . . . . 0.0 111.379 -179.559 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 319' ' ' GLN . . . . . . . . . . . . . 22.6 tt0 -65.28 -26.17 67.96 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.706 179.863 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 320' ' ' GLY . . . . . . . . . . . . . . . -96.9 -5.43 58.49 Favored Glycine 0 N--CA 1.451 -0.301 0 C-N-CA 120.804 -0.712 . . . . 0.0 112.624 -179.845 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 321' ' ' GLN . . . . . . . . . . . . . 27.8 mm-40 -108.33 94.04 12.65 Favored Pre-proline 0 C--N 1.329 -0.298 0 CA-C-O 120.45 0.167 . . . . 0.0 110.945 -179.962 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 322' ' ' PRO . . . . . . . . . . . . . 97.1 Cg_endo -79.69 -33.78 1.16 Allowed 'Trans proline' 0 C--N 1.348 0.531 0 C-N-CA 122.459 2.106 . . . . 0.0 112.458 -179.911 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 323' ' ' ASP . . . . . . . . . . . . . 20.8 m-20 -63.86 -51.7 63.44 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.146 -179.682 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 324' ' ' ILE . . . . . . . . . . . . . 57.1 mt -65.12 -46.24 91.73 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.424 -179.696 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 325' ' ' TYR . . . . . 0.41 ' O ' HD22 ' B' ' 329' ' ' LEU . 35.0 t80 -57.57 -58.43 8.34 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.996 -179.624 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 326' ' ' LYS . . . . . . . . . . . . . 14.2 mptt -54.03 -44.73 71.23 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.017 179.916 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 327' ' ' ALA . . . . . . . . . . . . . . . -53.59 -45.64 70.09 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 121.055 0.455 . . . . 0.0 110.916 179.802 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 328' ' ' PHE . . . . . . . . . . . . . 54.9 t80 -60.54 -54.92 39.7 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.857 -0.611 . . . . 0.0 110.822 179.961 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 329' ' ' LEU . . . . . 0.5 HD11 ' HB2' ' A' ' 362' ' ' MET . 4.0 mm? -59.76 -25.63 65.03 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.652 179.815 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 330' ' ' GLU . . . . . . . . . . . . . 10.2 mm-40 -69.76 -41.97 74.48 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.39 -0.368 . . . . 0.0 110.037 179.107 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 331' ' ' ILE . . . . . . . . . . . . . 84.8 mt -63.88 -42.41 95.71 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.038 178.814 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 332' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -64.48 -44.42 91.09 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.655 -0.702 . . . . 0.0 110.671 179.532 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 333' ' ' HIS . . . . . 0.465 ' HB2' ' HE2' ' A' ' 362' ' ' MET . 54.1 t-80 -61.95 -56.27 20.9 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.777 -179.99 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 334' ' ' THR . . . . . . . . . . . . . 70.9 m -54.16 -37.51 64.52 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.338 179.486 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 335' ' ' TYR . . . . . . . . . . . . . 60.7 t80 -63.27 -38.56 91.66 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.069 179.299 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 336' ' ' GLN . . . . . . . . . . . . . 23.8 tt0 -64.68 -43.83 92.27 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.729 179.454 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 337' ' ' LYS . . . . . . . . . . . . . 26.9 ttpp -59.16 -52.24 66.57 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.821 -179.849 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 338' ' ' GLU . . . . . . . . . . . . . 35.5 mm-40 -58.29 -42.84 87.48 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.797 179.706 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 339' ' ' GLN . . . . . . . . . . . . . 8.7 tt0 -59.36 -41.1 88.46 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.755 -179.963 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 340' ' ' ARG . . . . . . . . . . . . . 99.1 mtt180 -62.41 -52.03 65.2 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.753 179.772 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 341' ' ' ASN . . . . . . . . . . . . . 18.9 m120 -60.96 -27.2 68.09 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.872 179.881 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 342' ' ' ALA . . . . . . . . . . . . . . . -73.8 -42.22 61.26 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.21 179.973 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 343' ' ' LYS . . . . . . . . . . . . . 98.6 mttt -76.61 -24.66 53.41 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.99 -179.95 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 344' ' ' GLU . . . . . . . . . . . . . 15.6 mm-40 -82.43 -34.01 28.35 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.264 -0.426 . . . . 0.0 110.861 179.814 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 345' ' ' ALA . . . . . . . . . . . . . . . -64.56 -30.37 71.4 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.066 179.911 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 346' ' ' GLY . . . . . . . . . . . . . . . 85.88 -40.48 3.04 Favored Glycine 0 N--CA 1.452 -0.249 0 C-N-CA 120.743 -0.741 . . . . 0.0 112.576 -179.977 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 347' ' ' GLY . . . . . . . . . . . . . . . -178.53 178.12 48.59 Favored Glycine 0 N--CA 1.452 -0.276 0 C-N-CA 120.804 -0.712 . . . . 0.0 112.514 -179.987 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 348' ' ' ASN . . . . . . . . . . . . . 2.9 t-20 59.31 17.61 5.97 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.909 0.385 . . . . 0.0 111.008 179.93 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 349' ' ' TYR . . . . . . . . . . . . . 56.0 t80 -107.86 141.59 39.21 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.768 179.984 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 350' ' ' THR . . . . . . . . . . . . . 39.1 m -119.73 96.8 49.74 Favored Pre-proline 0 C--N 1.329 -0.306 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.981 179.891 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 351' ' ' PRO . . . . . . . . . . . . . 51.8 Cg_exo -52.56 131.33 40.56 Favored 'Trans proline' 0 C--N 1.348 0.543 0 C-N-CA 122.451 2.101 . . . . 0.0 112.288 179.97 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 352' ' ' ALA . . . . . . . . . . . . . . . -62.75 -57.27 11.52 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.066 -0.516 . . . . 0.0 111.401 -179.739 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 353' ' ' LEU . . . . . 0.424 ' HG ' ' HG2' ' B' ' 357' ' ' GLU . 5.9 mp -101.33 121.97 42.86 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 120.924 0.392 . . . . 0.0 111.375 -179.846 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 354' ' ' THR . . . . . . . . . . . . . 79.9 p -112.35 -170.76 1.72 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.389 179.158 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 355' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -57.57 -37.45 73.17 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.997 0.427 . . . . 0.0 110.28 179.654 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 356' ' ' GLN . . . . . . . . . . . . . 93.5 mt-30 -71.21 -40.71 70.96 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.807 -0.633 . . . . 0.0 111.029 -179.857 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 357' ' ' GLU . . . . . 0.424 ' HG2' ' HG ' ' B' ' 353' ' ' LEU . 6.6 tp10 -59.34 -52.74 64.32 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 116.345 -0.389 . . . . 0.0 110.908 -179.62 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 358' ' ' VAL . . . . . 0.421 ' O ' HG21 ' B' ' 362' ' ' VAL . 76.3 t -61.51 -54.66 31.87 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.942 179.842 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 359' ' ' TYR . . . . . . . . . . . . . 38.4 t80 -54.57 -28.66 47.59 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.689 0.281 . . . . 0.0 111.196 -179.444 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 360' ' ' ALA . . . . . . . . . . . . . . . -72.09 -60.66 2.12 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.867 0.365 . . . . 0.0 110.981 179.768 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 361' ' ' GLN . . . . . . . . . . . . . 24.2 mm-40 -55.0 -40.33 69.99 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.593 179.788 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 362' ' ' VAL . . . . . 0.421 HG21 ' O ' ' B' ' 358' ' ' VAL . 90.5 t -66.25 -39.87 85.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.304 179.338 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 363' ' ' ALA . . . . . 0.536 ' HA ' HD23 ' B' ' 373' ' ' LEU . . . -58.98 -36.93 75.7 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.139 179.227 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 364' ' ' ARG . . . . . . . . . . . . . 98.2 mtt180 -80.74 -25.29 38.13 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.729 -0.669 . . . . 0.0 110.41 179.387 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 365' ' ' LEU . . . . . . . . . . . . . 14.6 tp -61.14 -29.67 69.93 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.456 179.843 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 366' ' ' PHE . . . . . . . . . . . . . 43.9 m-85 -120.09 -170.2 1.92 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.855 -0.611 . . . . 0.0 110.164 179.545 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 367' ' ' LYS . . . . . . . . . . . . . 61.0 tttp -158.32 -84.24 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.663 0.268 . . . . 0.0 111.38 179.944 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 368' ' ' ASN . . . . . . . . . . . . . 80.6 m-20 -70.0 -7.87 44.41 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.378 -0.373 . . . . 0.0 110.948 -179.83 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 369' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -110.57 86.83 2.39 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.888 179.999 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 370' ' ' GLU . . . . . . . . . . . . . 42.8 mt-10 -91.36 -12.55 34.57 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.396 -0.365 . . . . 0.0 110.553 179.837 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 371' ' ' ASP . . . . . . . . . . . . . 19.2 t70 -55.1 -34.11 63.4 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 116.158 -0.473 . . . . 0.0 110.155 179.476 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 372' ' ' LEU . . . . . . . . . . . . . 6.0 mp -69.97 -38.16 76.0 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.662 -0.699 . . . . 0.0 110.211 179.15 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 373' ' ' LEU . . . . . 0.536 HD23 ' HA ' ' B' ' 363' ' ' ALA . 1.7 mp -63.26 -37.31 86.75 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.733 -0.667 . . . . 0.0 110.783 179.793 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 374' ' ' SER . . . . . . . . . . . . . 61.6 m -72.67 -57.14 4.35 Favored 'General case' 0 C--O 1.235 0.339 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.462 179.532 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 375' ' ' GLU . . . . . . . . . . . . . 17.2 mm-40 -52.56 -40.58 62.72 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.565 179.503 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 376' ' ' PHE . . . . . 0.518 ' HB2' ' HH ' ' B' ' 310' ' ' TYR . 81.5 t80 -72.8 -34.47 66.92 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.13 -0.487 . . . . 0.0 109.99 179.442 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 377' ' ' GLY . . . . . . . . . . . . . . . -58.97 -32.74 71.36 Favored Glycine 0 N--CA 1.449 -0.485 0 C-N-CA 120.583 -0.818 . . . . 0.0 111.373 179.091 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 378' ' ' GLN . . . . . . . . . . . . . 15.8 mm100 -56.98 -36.31 70.18 Favored 'General case' 0 C--N 1.333 -0.142 0 CA-C-O 120.929 0.395 . . . . 0.0 110.09 178.829 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 379' ' ' PHE . . . . . . . . . . . . . 70.3 m-85 -68.14 -42.06 80.68 Favored 'General case' 0 C--N 1.333 -0.144 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.243 179.339 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 380' ' ' LEU . . . . . . . . . . . . . 5.8 tp -51.38 121.27 16.62 Favored Pre-proline 0 C--N 1.329 -0.306 0 CA-C-N 115.554 -0.748 . . . . 0.0 110.667 -179.829 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 381' ' ' PRO . . . . . . . . . . . . . 84.9 Cg_exo -46.4 122.14 5.35 Favored 'Trans proline' 0 C--N 1.351 0.677 0 C-N-CA 122.413 2.075 . . . . 0.0 112.462 -179.984 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 382' ' ' ASP . . . . . . . . . . . . . 28.9 t70 -61.26 132.28 53.11 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.92 -179.872 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 383' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.045 0 CA-C-O 118.203 -0.904 . . . . 0.0 111.079 -179.972 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 358' ' ' ASP . . . . . . . . . . . . . 17.3 m-20 . . . . . 0 N--CA 1.485 1.318 0 CA-C-O 120.815 0.34 . . . . 0.0 110.845 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 359' ' ' PHE . . . . . . . . . . . . . 77.7 t80 -142.13 141.93 32.71 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.189 -0.46 . . . . 0.0 111.055 -179.98 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 360' ' ' THR . . . . . 0.552 HG22 ' HB ' ' B' ' 308' ' ' ILE . 0.1 OUTLIER -159.57 -51.82 0.01 OUTLIER Pre-proline 0 CA--C 1.534 0.351 0 CA-C-N 115.999 -0.546 . . . . 0.0 111.559 179.643 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 361' ' ' PRO . . . . . 0.478 ' HD2' ' H ' ' A' ' 360' ' ' THR . 53.7 Cg_endo -88.55 176.48 3.49 Favored 'Trans proline' 0 C--N 1.354 0.844 0 C-N-CA 122.411 2.074 . . . . 0.0 112.087 179.431 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 362' ' ' MET . . . . . 0.433 ' SD ' ' HB3' ' B' ' 329' ' ' LEU . 5.7 ttt -101.26 -71.36 0.71 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.086 0.47 . . . . 0.0 110.655 179.361 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 363' ' ' ASP . . . . . . . . . . . . . 14.5 t70 -170.92 -32.28 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.621 -0.718 . . . . 0.0 110.122 -179.719 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 364' ' ' SER . . . . . . . . . . . . . 78.7 p -115.62 19.19 15.48 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.703 -0.681 . . . . 0.0 110.171 179.434 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 365' ' ' SER . . . . . . . . . . . . . 46.3 t 65.36 80.0 0.24 Allowed 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.632 -0.713 . . . . 0.0 111.283 -179.883 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 366' ' ' ALA . . . . . . . . . . . . . . . -77.99 -20.74 52.02 Favored 'General case' 0 C--O 1.234 0.253 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.643 179.67 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 367' ' ' VAL . . . . . . . . . . . . . 21.4 t -53.28 -32.65 19.74 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 115.892 -0.595 . . . . 0.0 110.986 179.969 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 368' ' ' TYR . . . . . . . . . . . . . 66.3 t80 -68.02 -36.78 80.52 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.675 179.785 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 369' ' ' VAL . . . . . . . . . . . . . 6.0 t -67.26 -52.97 36.99 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.238 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.728 179.85 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 370' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -62.32 -32.36 73.1 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.766 179.801 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 371' ' ' SER . . . . . . . . . . . . . 27.2 t -64.12 -58.34 6.94 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.045 179.878 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 372' ' ' SER . . . . . . . . . . . . . 41.7 t -59.68 -32.5 70.54 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.09 -179.86 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 373' ' ' MET . . . . . . . . . . . . . 55.6 ttm -63.99 -47.24 81.09 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.402 -0.363 . . . . 0.0 111.174 179.935 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 374' ' ' ALA . . . . . . . . . . . . . . . -83.17 -13.79 54.77 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.363 -0.38 . . . . 0.0 111.686 -179.715 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 375' ' ' ARG . . . . . 0.49 ' HG2' ' HG2' ' B' ' 303' ' ' GLU . 7.0 mmt180 -86.07 -30.73 22.38 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.487 -0.324 . . . . 0.0 111.25 -179.844 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 376' ' ' GLN . . . . . 0.459 ' HB3' ' HG3' ' B' ' 381' ' ' PRO . 52.6 tt0 -54.16 -82.33 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.255 -0.429 . . . . 0.0 111.179 -179.617 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 377' ' ' ARG . . . . . . . . . . . . . 67.0 mtm180 55.47 -167.28 0.1 Allowed 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.803 0.335 . . . . 0.0 110.985 -179.965 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 378' ' ' ARG . . . . . . . . . . . . . 35.5 mmt180 -115.82 9.64 15.13 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.31 -0.405 . . . . 0.0 111.016 179.82 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 379' ' ' ALA . . . . . . . . . . . . . . . -65.61 -37.06 85.53 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.955 179.845 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 380' ' ' SER . . . . . . . . . . . . . 49.3 m . . . . . 0 C--O 1.25 1.115 0 CA-C-O 118.152 -0.928 . . . . 0.0 111.046 179.811 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' B' B ' 295' ' ' SER . . . . . . . . . . . . . 76.3 p . . . . . 0 N--CA 1.485 1.313 0 CA-C-O 120.821 0.343 . . . . 0.0 111.039 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' B' B ' 296' ' ' LEU . . . . . 0.416 ' N ' HD21 ' B' ' 296' ' ' LEU . 2.8 mm? -111.41 145.99 37.96 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.733 179.864 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 297' ' ' GLN . . . . . 0.577 HE21 ' H ' ' B' ' 297' ' ' GLN . 0.0 OUTLIER -104.93 136.47 44.35 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.808 179.888 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 298' ' ' ASN . . . . . . . . . . . . . 26.8 t-20 -114.3 -50.78 2.79 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.788 179.932 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 299' ' ' ASN . . . . . . . . . . . . . 8.8 p30 -82.69 138.78 34.0 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.665 179.864 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 300' ' ' GLN . . . . . . . . . . . . . 3.9 pt20 -96.53 146.68 31.73 Favored Pre-proline 0 C--N 1.329 -0.285 0 CA-C-N 116.268 -0.424 . . . . 0.0 111.012 -179.875 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 301' ' ' PRO . . . . . . . . . . . . . 25.2 Cg_exo -63.01 131.3 32.12 Favored 'Trans proline' 0 C--N 1.348 0.506 0 C-N-CA 122.527 2.151 . . . . 0.0 112.298 179.807 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 302' ' ' VAL . . . . . . . . . . . . . 15.0 p -92.22 -29.58 4.59 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.23 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.805 179.766 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 303' ' ' GLU . . . . . 0.49 ' HG2' ' HG2' ' A' ' 375' ' ' ARG . 35.5 mt-10 -51.64 -80.75 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.77 -0.65 . . . . 0.0 111.879 -179.34 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 304' ' ' PHE . . . . . 0.487 ' O ' HG12 ' B' ' 308' ' ' ILE . 81.0 m-85 -54.79 -55.0 34.78 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.918 -0.583 . . . . 0.0 112.043 -179.023 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 305' ' ' ASN . . . . . . . . . . . . . 2.8 t-20 -47.58 -68.89 0.15 Allowed 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 112.87 0.693 . . . . 0.0 112.87 -178.668 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 306' ' ' HIS . . . . . . . . . . . . . 2.5 t-160 -54.98 -46.33 75.1 Favored 'General case' 0 C--N 1.33 -0.266 0 N-CA-C 112.417 0.525 . . . . 0.0 112.417 -178.244 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 307' ' ' ALA . . . . . . . . . . . . . . . -58.6 -62.19 2.04 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 112.37 0.507 . . . . 0.0 112.37 -178.89 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 308' ' ' ILE . . . . . 0.552 ' HB ' HG22 ' A' ' 360' ' ' THR . 30.9 pt -54.68 -37.74 40.72 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.208 0 N-CA-C 111.825 0.306 . . . . 0.0 111.825 -179.173 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 309' ' ' ASN . . . . . 0.411 ' N ' HG13 ' B' ' 308' ' ' ILE . 5.3 m-20 -61.58 -45.27 94.85 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.896 0.379 . . . . 0.0 110.804 179.987 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 310' ' ' TYR . . . . . 0.481 ' O ' HG12 ' B' ' 314' ' ' ILE . 81.4 t80 -61.54 -60.13 4.16 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.847 179.869 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 311' ' ' VAL . . . . . . . . . . . . . 47.5 t -54.13 -31.26 21.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-O 120.896 0.379 . . . . 0.0 111.178 -179.572 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 312' ' ' ASN . . . . . . . . . . . . . 3.2 t-20 -65.11 -56.52 12.48 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.361 -179.668 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 313' ' ' LYS . . . . . 0.56 ' HZ1' ' HB2' ' B' ' 313' ' ' LYS . 0.0 OUTLIER -65.31 -23.52 67.04 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 116.493 -0.321 . . . . 0.0 111.595 -179.555 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 314' ' ' ILE . . . . . 0.481 HG12 ' O ' ' B' ' 310' ' ' TYR . 24.6 mm -76.68 -36.61 27.45 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-O 120.814 0.34 . . . . 0.0 111.087 179.723 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 315' ' ' LYS . . . . . . . . . . . . . 1.2 tmmt? -75.84 -35.94 59.8 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.404 -0.362 . . . . 0.0 110.858 -179.982 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 316' ' ' ASN . . . . . . . . . . . . . 27.0 t-20 -74.4 -46.0 43.11 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.045 -0.525 . . . . 0.0 111.525 -179.47 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 317' ' ' ARG . . . . . . . . . . . . . 19.1 tpt180 -68.61 -25.55 64.91 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.448 -0.342 . . . . 0.0 111.177 -179.644 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 318' ' ' PHE . . . . . . . . . . . . . 95.7 m-85 -117.31 37.51 3.85 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.172 -179.837 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 319' ' ' GLN . . . . . . . . . . . . . 3.0 pt20 -63.4 -15.15 56.7 Favored 'General case' 0 N--CA 1.447 -0.586 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.925 179.591 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 320' ' ' GLY . . . . . . . . . . . . . . . -104.98 -7.22 38.79 Favored Glycine 0 C--N 1.331 0.284 0 C-N-CA 120.837 -0.697 . . . . 0.0 112.697 -179.85 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 321' ' ' GLN . . . . . . . . . . . . . 23.5 mp0 -113.05 88.32 11.92 Favored Pre-proline 0 C--N 1.33 -0.281 0 CA-C-O 120.549 0.214 . . . . 0.0 111.004 -179.991 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 322' ' ' PRO . . . . . . . . . . . . . 90.2 Cg_endo -80.87 -26.5 3.6 Favored 'Trans proline' 0 C--N 1.348 0.507 0 C-N-CA 122.474 2.116 . . . . 0.0 112.689 179.778 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 323' ' ' ASP . . . . . . . . . . . . . 12.4 m-20 -67.05 -56.82 8.41 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.383 -179.542 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 324' ' ' ILE . . . . . . . . . . . . . 57.1 mt -64.3 -43.39 97.17 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 CA-C-N 116.299 -0.41 . . . . 0.0 111.195 -179.784 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 325' ' ' TYR . . . . . . . . . . . . . 55.1 t80 -57.12 -58.23 9.09 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.714 179.957 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 326' ' ' LYS . . . . . 0.432 ' O ' ' HG2' ' B' ' 330' ' ' GLU . 58.6 mtpt -52.2 -50.02 62.72 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.012 179.833 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 327' ' ' ALA . . . . . 0.431 ' O ' ' HB2' ' B' ' 330' ' ' GLU . . . -50.35 -46.46 55.76 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 116.369 -0.378 . . . . 0.0 111.207 179.997 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 328' ' ' PHE . . . . . . . . . . . . . 71.3 t80 -58.01 -53.5 57.49 Favored 'General case' 0 C--O 1.237 0.44 0 CA-C-O 121.062 0.458 . . . . 0.0 109.985 179.293 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 329' ' ' LEU . . . . . 0.433 ' HB3' ' SD ' ' A' ' 362' ' ' MET . 4.2 mm? -58.73 -27.73 65.19 Favored 'General case' 0 N--CA 1.452 -0.327 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.372 179.082 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 330' ' ' GLU . . . . . 0.432 ' HG2' ' O ' ' B' ' 326' ' ' LYS . 27.4 mm-40 -69.23 -39.22 78.66 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.035 179.464 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 331' ' ' ILE . . . . . 0.485 HG21 HG23 ' B' ' 358' ' ' VAL . 68.2 mt -63.8 -50.51 77.39 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.23 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.254 179.204 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 332' ' ' LEU . . . . . . . . . . . . . 11.0 mp -66.48 -28.92 68.96 Favored 'General case' 0 C--O 1.233 0.2 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.796 179.643 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 333' ' ' HIS . . . . . . . . . . . . . 34.4 t-80 -66.88 -61.05 2.14 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.401 179.348 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 334' ' ' THR . . . . . . . . . . . . . 95.3 m -56.1 -34.29 65.89 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.925 -0.579 . . . . 0.0 110.242 179.286 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 335' ' ' TYR . . . . . . . . . . . . . 52.4 t80 -63.79 -41.73 97.88 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.809 -0.632 . . . . 0.0 110.245 179.31 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 336' ' ' GLN . . . . . . . . . . . . . 44.4 tt0 -62.77 -47.07 85.08 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.773 179.665 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 337' ' ' LYS . . . . . . . . . . . . . 28.7 ttpp -56.72 -54.32 47.52 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.177 -179.914 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 338' ' ' GLU . . . . . . . . . . . . . 19.7 mm-40 -60.94 -33.34 73.03 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.272 -179.916 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 339' ' ' GLN . . . . . . . . . . . . . 60.5 tt0 -63.14 -61.22 2.52 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.854 -179.949 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 340' ' ' ARG . . . . . . . . . . . . . 95.4 mtt180 -52.54 -52.67 53.68 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.011 -0.54 . . . . 0.0 111.084 -179.99 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 341' ' ' ASN . . . . . . . . . . . . . 80.2 m-20 -54.32 -40.66 68.2 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.952 179.906 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 342' ' ' ALA . . . . . . . . . . . . . . . -66.89 -31.25 71.72 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.119 179.961 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 343' ' ' LYS . . . . . . . . . . . . . 14.0 mmmm -72.35 -46.64 54.61 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.112 -0.494 . . . . 0.0 111.195 -179.885 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 344' ' ' GLU . . . . . . . . . . . . . 14.1 mm-40 -69.7 -29.23 66.59 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.17 -179.706 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 345' ' ' ALA . . . . . . . . . . . . . . . -59.98 -28.91 68.08 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.215 -179.898 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 346' ' ' GLY . . . . . . . . . . . . . . . 135.56 -23.69 3.41 Favored Glycine 0 N--CA 1.45 -0.398 0 C-N-CA 120.786 -0.721 . . . . 0.0 112.531 -179.966 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 347' ' ' GLY . . . . . . . . . . . . . . . 113.96 -17.17 20.19 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.829 -0.701 . . . . 0.0 112.488 179.977 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 348' ' ' ASN . . . . . . . . . . . . . 13.8 m120 -85.99 -14.89 43.2 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.751 0.31 . . . . 0.0 111.035 -179.967 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 349' ' ' TYR . . . . . . . . . . . . . 80.2 t80 -70.91 130.22 41.07 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.896 179.927 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 350' ' ' THR . . . . . . . . . . . . . 33.0 m -92.9 110.93 48.91 Favored Pre-proline 0 C--N 1.33 -0.267 0 CA-C-N 116.158 -0.474 . . . . 0.0 111.022 179.984 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 351' ' ' PRO . . . . . . . . . . . . . 52.5 Cg_exo -55.65 162.44 6.53 Favored 'Trans proline' 0 C--N 1.348 0.52 0 C-N-CA 122.453 2.102 . . . . 0.0 112.459 -179.878 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 352' ' ' ALA . . . . . . . . . . . . . . . -77.26 -41.71 39.94 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.058 179.947 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 353' ' ' LEU . . . . . 0.421 ' HG ' ' HG2' ' B' ' 357' ' ' GLU . 7.1 mp -114.74 130.32 56.82 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.01 179.969 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 354' ' ' THR . . . . . . . . . . . . . 81.0 p -112.36 -174.86 2.55 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.055 -0.521 . . . . 0.0 110.805 179.769 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 355' ' ' GLU . . . . . . . . . . . . . 8.5 pt-20 -56.54 -42.14 77.97 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 121.209 0.528 . . . . 0.0 110.573 179.985 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 356' ' ' GLN . . . . . . . . . . . . . 15.8 mm100 -65.95 -38.92 89.85 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.5 -0.773 . . . . 0.0 111.055 179.789 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 357' ' ' GLU . . . . . 0.421 ' HG2' ' HG ' ' B' ' 353' ' ' LEU . 5.5 tp10 -61.33 -46.48 90.09 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 120.856 0.36 . . . . 0.0 110.707 -179.833 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 358' ' ' VAL . . . . . 0.485 HG23 HG21 ' B' ' 331' ' ' ILE . 71.5 t -63.5 -59.92 3.57 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-N 116.101 -0.499 . . . . 0.0 111.173 179.889 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 359' ' ' TYR . . . . . . . . . . . . . 46.5 t80 -52.36 -32.47 38.6 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.375 -0.375 . . . . 0.0 111.569 -179.335 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 360' ' ' ALA . . . . . . . . . . . . . . . -68.42 -60.54 2.36 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.77 0.319 . . . . 0.0 111.075 -179.95 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 361' ' ' GLN . . . . . . . . . . . . . 25.0 mt-30 -55.44 -45.5 76.82 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.68 179.939 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 362' ' ' VAL . . . . . 0.431 HG21 ' O ' ' B' ' 358' ' ' VAL . 57.5 t -61.61 -36.96 76.66 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.217 0 CA-C-N 116.152 -0.477 . . . . 0.0 110.305 179.399 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 363' ' ' ALA . . . . . 0.415 ' HA ' HD13 ' B' ' 373' ' ' LEU . . . -63.84 -34.69 78.49 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.104 179.133 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 364' ' ' ARG . . . . . . . . . . . . . 59.2 ttt180 -75.83 -26.93 57.64 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.821 -0.627 . . . . 0.0 110.085 179.197 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 365' ' ' LEU . . . . . . . . . . . . . 2.5 mp -60.04 -57.97 10.53 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.792 179.333 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 366' ' ' PHE . . . . . . . . . . . . . 4.9 m-85 -104.97 133.72 49.29 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.609 179.937 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 367' ' ' LYS . . . . . . . . . . . . . 96.7 mttt -105.23 -78.0 0.58 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.844 0.354 . . . . 0.0 111.15 -179.636 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 368' ' ' ASN . . . . . . . . . . . . . 14.8 m120 -66.88 -16.59 64.41 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.935 -179.982 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 369' ' ' GLN . . . . . . . . . . . . . 22.7 mt-30 -97.02 85.75 3.81 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.947 179.964 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 370' ' ' GLU . . . . . . . . . . . . . 10.5 mm-40 -94.06 -6.03 46.09 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.068 -0.515 . . . . 0.0 111.095 179.847 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 371' ' ' ASP . . . . . . . . . . . . . 20.2 t70 -58.67 -62.77 1.62 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.009 -179.976 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 372' ' ' LEU . . . . . 0.496 HD12 ' H ' ' B' ' 373' ' ' LEU . 0.3 OUTLIER -62.25 -22.52 66.04 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.077 179.927 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 373' ' ' LEU . . . . . 0.496 ' H ' HD12 ' B' ' 372' ' ' LEU . 6.1 tp -70.18 -39.82 75.04 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.25 -179.997 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 374' ' ' SER . . . . . . . . . . . . . 54.7 m -71.98 -48.82 42.24 Favored 'General case' 0 C--O 1.234 0.274 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.065 179.247 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 375' ' ' GLU . . . . . . . . . . . . . 15.3 mm-40 -54.43 -44.79 72.75 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-N 116.009 -0.542 . . . . 0.0 110.057 179.361 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 376' ' ' PHE . . . . . . . . . . . . . 82.3 t80 -65.54 -38.52 89.85 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.015 -0.538 . . . . 0.0 109.934 179.206 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 377' ' ' GLY . . . . . . . . . . . . . . . -58.05 -34.27 72.12 Favored Glycine 0 N--CA 1.449 -0.451 0 C-N-CA 120.683 -0.77 . . . . 0.0 111.721 179.332 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 378' ' ' GLN . . . . . . . . . . . . . 98.1 mt-30 -60.99 -34.73 75.24 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.68 0.276 . . . . 0.0 110.711 179.381 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 379' ' ' PHE . . . . . . . . . . . . . 56.6 m-85 -59.57 -36.5 76.34 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.57 179.656 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 380' ' ' LEU . . . . . . . . . . . . . 93.5 mt -54.22 145.49 35.44 Favored Pre-proline 0 C--N 1.331 -0.204 0 CA-C-N 115.921 -0.581 . . . . 0.0 110.644 179.834 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 381' ' ' PRO . . . . . 0.459 ' HG3' ' HB3' ' A' ' 376' ' ' GLN . 76.6 Cg_exo -50.69 107.49 0.17 Allowed 'Trans proline' 0 C--N 1.346 0.428 0 C-N-CA 122.408 2.072 . . . . 0.0 112.226 179.929 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 382' ' ' ASP . . . . . . . . . . . . . 16.4 m-20 -66.45 134.67 52.94 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.92 -179.962 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 383' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.077 0 CA-C-O 118.206 -0.902 . . . . 0.0 111.173 -179.845 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 358' ' ' ASP . . . . . . . . . . . . . 15.3 t70 . . . . . 0 N--CA 1.486 1.34 0 CA-C-O 120.903 0.382 . . . . 0.0 110.829 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 359' ' ' PHE . . . . . . . . . . . . . 41.9 p90 -87.8 178.99 6.57 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.73 179.901 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 360' ' ' THR . . . . . . . . . . . . . 73.7 p -101.61 130.51 24.49 Favored Pre-proline 0 C--N 1.328 -0.363 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.887 179.838 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 361' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_endo -74.33 -172.04 1.07 Allowed 'Trans proline' 0 C--N 1.348 0.519 0 C-N-CA 122.376 2.05 . . . . 0.0 112.212 179.978 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 362' ' ' MET . . . . . 0.558 ' HG2' HD11 ' B' ' 329' ' ' LEU . 2.1 tmt? -76.24 -71.12 0.4 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.561 179.932 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 363' ' ' ASP . . . . . . . . . . . . . 14.6 t70 -179.72 -37.98 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 115.89 -0.596 . . . . 0.0 110.039 179.783 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 364' ' ' SER . . . . . . . . . . . . . 35.6 t -124.24 29.35 6.41 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.715 -0.675 . . . . 0.0 110.155 179.608 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 365' ' ' SER . . . . . . . . . . . . . 49.7 m 62.33 96.77 0.04 OUTLIER 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 115.726 -0.67 . . . . 0.0 111.138 -179.781 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 366' ' ' ALA . . . . . . . . . . . . . . . -75.66 -18.1 59.76 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.033 -0.531 . . . . 0.0 110.762 179.75 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 367' ' ' VAL . . . . . . . . . . . . . 21.9 t -59.64 -19.4 16.81 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.744 179.918 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 368' ' ' TYR . . . . . . . . . . . . . 84.7 t80 -65.91 -60.03 3.26 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.061 -179.993 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 369' ' ' VAL . . . . . 0.442 HG23 ' HB3' ' B' ' 332' ' ' LEU . 20.8 m -67.82 -36.82 77.14 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.19 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.555 -179.697 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 370' ' ' LEU . . . . . . . . . . . . . 97.5 mt -62.4 -58.46 7.56 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.958 0.409 . . . . 0.0 110.94 179.88 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 371' ' ' SER . . . . . . . . . . . . . 36.6 t -58.87 -51.4 70.17 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.045 -0.525 . . . . 0.0 111.037 179.8 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 372' ' ' SER . . . . . . . . . . . . . 93.0 p -55.17 -41.32 71.72 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.338 -179.503 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 373' ' ' MET . . . . . 0.492 ' HG2' ' H ' ' B' ' 380' ' ' LEU . 54.3 ttm -62.97 -41.49 99.56 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.458 -0.337 . . . . 0.0 111.186 -179.724 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 374' ' ' ALA . . . . . . . . . . . . . . . -87.03 -6.68 58.65 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.357 -0.383 . . . . 0.0 111.922 -179.595 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 375' ' ' ARG . . . . . . . . . . . . . 22.1 mmm180 -107.81 -12.64 15.16 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.591 0.234 . . . . 0.0 111.603 -179.804 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 376' ' ' GLN . . . . . 0.553 ' HB3' ' HG3' ' B' ' 381' ' ' PRO . 54.0 tt0 -83.25 14.57 3.44 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 121.039 0.447 . . . . 0.0 110.892 -179.727 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 377' ' ' ARG . . . . . 0.438 ' HG2' ' H ' ' B' ' 382' ' ' ASP . 69.8 mtm180 -63.39 -22.16 66.72 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.843 179.9 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 378' ' ' ARG . . . . . . . . . . . . . 27.3 tpt180 -149.55 112.38 4.82 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.077 -0.511 . . . . 0.0 110.745 -179.96 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 379' ' ' ALA . . . . . . . . . . . . . . . -61.64 137.8 58.27 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.001 179.912 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 380' ' ' SER . . . . . . . . . . . . . 58.1 m . . . . . 0 C--O 1.249 1.047 0 CA-C-O 118.26 -0.876 . . . . 0.0 110.941 -179.997 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' B' B ' 295' ' ' SER . . . . . . . . . . . . . 47.7 t . . . . . 0 N--CA 1.485 1.284 0 CA-C-O 120.912 0.387 . . . . 0.0 110.937 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' B' B ' 296' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -92.26 115.09 27.77 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.896 -179.93 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 297' ' ' GLN . . . . . . . . . . . . . 4.7 pt20 -151.25 -14.6 0.21 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.817 179.97 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 298' ' ' ASN . . . . . . . . . . . . . 12.0 m120 58.47 -177.07 0.08 Allowed 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.983 -179.91 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 299' ' ' ASN . . . . . . . . . . . . . 30.4 m-80 -118.63 -65.48 1.17 Allowed 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.85 -179.993 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 300' ' ' GLN . . . . . 0.537 ' H ' ' HD2' ' B' ' 301' ' ' PRO . 35.3 tt0 -169.41 -51.85 0.0 OUTLIER Pre-proline 0 CA--C 1.535 0.368 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.599 -179.947 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 301' ' ' PRO . . . . . 0.537 ' HD2' ' H ' ' B' ' 300' ' ' GLN . 61.1 Cg_endo -73.09 134.23 20.96 Favored 'Trans proline' 0 C--N 1.353 0.786 0 C-N-CA 121.986 1.791 . . . . 0.0 112.443 -179.866 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 302' ' ' VAL . . . . . . . . . . . . . 8.2 p -92.13 -32.06 5.0 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.912 179.809 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 303' ' ' GLU . . . . . . . . . . . . . 18.7 mt-10 -54.48 -81.18 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.629 -0.714 . . . . 0.0 111.709 -179.244 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 304' ' ' PHE . . . . . 0.542 ' HA ' HD13 ' B' ' 308' ' ' ILE . 80.8 t80 -51.07 -50.15 59.25 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.871 -179.199 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 305' ' ' ASN . . . . . . . . . . . . . 27.7 t-20 -50.43 -72.76 0.05 OUTLIER 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 112.634 0.605 . . . . 0.0 112.634 -178.817 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 306' ' ' HIS . . . . . . . . . . . . . 20.1 m-70 -58.95 -55.27 37.33 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 113.024 0.75 . . . . 0.0 113.024 -177.994 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 307' ' ' ALA . . . . . . . . . . . . . . . -50.66 -62.37 1.64 Allowed 'General case' 0 CA--C 1.532 0.277 0 N-CA-C 112.554 0.576 . . . . 0.0 112.554 -178.678 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 308' ' ' ILE . . . . . 0.542 HD13 ' HA ' ' B' ' 304' ' ' PHE . 1.8 mp -57.91 -52.79 53.78 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.219 0 N-CA-C 112.024 0.379 . . . . 0.0 112.024 -179.071 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 309' ' ' ASN . . . . . . . . . . . . . 12.3 m120 -54.33 -28.97 46.24 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.643 0.258 . . . . 0.0 111.427 -179.473 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 310' ' ' TYR . . . . . 0.542 ' O ' ' HG3' ' B' ' 313' ' ' LYS . 43.7 t80 -74.09 -61.26 1.92 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.948 0.404 . . . . 0.0 111.059 -179.674 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 311' ' ' VAL . . . . . . . . . . . . . 58.5 t -58.64 -27.73 35.01 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.428 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.673 179.949 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 312' ' ' ASN . . . . . . . . . . . . . 7.5 t30 -72.49 -56.69 5.01 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.71 -179.148 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 313' ' ' LYS . . . . . 0.542 ' HG3' ' O ' ' B' ' 310' ' ' TYR . 0.0 OUTLIER -56.56 -38.09 71.45 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.648 0.261 . . . . 0.0 111.465 -179.359 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 314' ' ' ILE . . . . . 0.419 HG13 ' O ' ' B' ' 310' ' ' TYR . 11.0 mt -78.08 -31.14 16.4 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.22 0 N-CA-C 111.958 0.355 . . . . 0.0 111.958 -179.409 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 315' ' ' LYS . . . . . 0.406 ' HE3' ' HB3' ' B' ' 315' ' ' LYS . 1.4 tmmt? -70.54 -34.92 72.81 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.61 0.243 . . . . 0.0 111.281 -179.983 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 316' ' ' ASN . . . . . . . . . . . . . 61.5 t30 -86.01 -38.55 17.78 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.478 -0.328 . . . . 0.0 111.746 -179.087 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 317' ' ' ARG . . . . . . . . . . . . . 32.6 tpt180 -75.58 -44.13 44.71 Favored 'General case' 0 C--N 1.327 -0.374 0 N-CA-C 111.733 0.272 . . . . 0.0 111.733 -179.29 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 318' ' ' PHE . . . . . . . . . . . . . 62.9 m-85 -98.0 34.63 1.88 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.537 -0.302 . . . . 0.0 111.394 -179.455 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 319' ' ' GLN . . . . . . . . . . . . . 3.8 pt20 -67.97 -9.13 42.97 Favored 'General case' 0 N--CA 1.447 -0.602 0 CA-C-N 116.443 -0.344 . . . . 0.0 111.068 179.658 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 320' ' ' GLY . . . . . . . . . . . . . . . -96.05 -19.11 29.56 Favored Glycine 0 N--CA 1.451 -0.347 0 C-N-CA 120.845 -0.693 . . . . 0.0 112.711 -179.857 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 321' ' ' GLN . . . . . . . . . . . . . 58.9 mt-30 -108.07 92.27 9.1 Favored Pre-proline 0 C--N 1.33 -0.274 0 CA-C-O 120.473 0.178 . . . . 0.0 111.139 179.935 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 322' ' ' PRO . . . . . . . . . . . . . 93.0 Cg_endo -79.03 -23.57 7.67 Favored 'Trans proline' 0 C--N 1.349 0.601 0 C-N-CA 122.502 2.135 . . . . 0.0 112.355 179.75 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 323' ' ' ASP . . . . . . . . . . . . . 10.0 m-20 -69.36 -52.69 24.67 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.824 179.949 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 324' ' ' ILE . . . . . . . . . . . . . 64.4 mt -69.12 -42.54 81.85 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.98 179.929 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 325' ' ' TYR . . . . . . . . . . . . . 40.3 t80 -58.21 -57.17 14.03 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.697 179.874 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 326' ' ' LYS . . . . . 0.457 ' O ' ' HG2' ' B' ' 330' ' ' GLU . 28.6 mtpp -57.84 -46.8 84.22 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.938 179.789 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 327' ' ' ALA . . . . . . . . . . . . . . . -48.19 -54.14 14.51 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 116.308 -0.405 . . . . 0.0 111.193 -179.916 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 328' ' ' PHE . . . . . . . . . . . . . 84.0 t80 -56.12 -47.29 78.41 Favored 'General case' 0 C--O 1.237 0.405 0 CA-C-O 121.14 0.495 . . . . 0.0 109.903 179.283 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 329' ' ' LEU . . . . . 0.558 HD11 ' HG2' ' A' ' 362' ' ' MET . 91.7 mt -61.36 -26.19 67.66 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.614 -0.721 . . . . 0.0 110.636 179.496 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 330' ' ' GLU . . . . . 0.457 ' HG2' ' O ' ' B' ' 326' ' ' LYS . 16.1 mm-40 -75.63 -32.89 60.42 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.151 -0.477 . . . . 0.0 109.983 179.454 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 331' ' ' ILE . . . . . . . . . . . . . 74.4 mt -67.22 -47.53 81.2 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.191 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.343 179.063 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 332' ' ' LEU . . . . . 0.442 ' HB3' HG23 ' A' ' 369' ' ' VAL . 9.3 mp -69.21 -35.87 76.66 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.755 179.426 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 333' ' ' HIS . . . . . . . . . . . . . 17.0 t-80 -64.05 -52.94 57.03 Favored 'General case' 0 C--O 1.232 0.182 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.37 179.608 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 334' ' ' THR . . . . . . . . . . . . . 84.4 m -60.44 -36.78 79.02 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.036 -0.529 . . . . 0.0 109.838 179.094 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 335' ' ' TYR . . . . . . . . . . . . . 50.9 t80 -61.36 -37.1 82.13 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.516 -0.765 . . . . 0.0 109.933 179.249 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 336' ' ' GLN . . . . . . . . . . . . . 9.8 tt0 -66.01 -51.6 56.87 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 115.798 -0.637 . . . . 0.0 110.492 179.315 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 337' ' ' LYS . . . . . . . . . . . . . 27.1 ttpp -55.36 -39.21 69.8 Favored 'General case' 0 C--O 1.233 0.195 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.936 179.853 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 338' ' ' GLU . . . . . . . . . . . . . 15.6 mm-40 -66.47 -42.29 87.75 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.94 179.881 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 339' ' ' GLN . . . . . . . . . . . . . 74.0 mt-30 -61.45 -42.4 98.71 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.323 -0.398 . . . . 0.0 110.957 179.608 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 340' ' ' ARG . . . . . . . . . . . . . 73.6 mtp180 -62.39 -55.27 29.52 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.901 -179.875 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 341' ' ' ASN . . . . . . . . . . . . . 82.7 m-20 -57.17 -35.01 69.04 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.874 179.912 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 342' ' ' ALA . . . . . . . . . . . . . . . -66.31 -43.24 86.79 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.061 -0.518 . . . . 0.0 111.102 179.92 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 343' ' ' LYS . . . . . . . . . . . . . 14.4 tmtt? -65.03 -46.64 80.44 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.634 -179.979 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 344' ' ' GLU . . . . . . . . . . . . . 12.5 mm-40 -63.98 -32.44 73.98 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.886 -179.999 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 345' ' ' ALA . . . . . . . . . . . . . . . -67.66 -23.13 65.29 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.029 179.938 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 346' ' ' GLY . . . . . . . . . . . . . . . 112.54 -67.66 0.24 Allowed Glycine 0 N--CA 1.452 -0.258 0 C-N-CA 120.728 -0.749 . . . . 0.0 112.529 179.99 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 347' ' ' GLY . . . . . . . . . . . . . . . 172.14 -17.2 0.05 OUTLIER Glycine 0 N--CA 1.452 -0.274 0 C-N-CA 120.772 -0.728 . . . . 0.0 112.454 -179.964 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 348' ' ' ASN . . . . . . . . . . . . . 24.2 t-20 -73.7 -10.37 59.62 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 121.011 0.434 . . . . 0.0 110.513 -179.972 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 349' ' ' TYR . . . . . . . . . . . . . 82.8 t80 -84.44 150.86 25.02 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.961 -0.563 . . . . 0.0 111.058 -179.86 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 350' ' ' THR . . . . . . . . . . . . . 93.3 m -119.87 105.58 42.76 Favored Pre-proline 0 C--N 1.33 -0.282 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.795 179.772 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 351' ' ' PRO . . . . . . . . . . . . . 54.7 Cg_exo -52.39 134.25 51.11 Favored 'Trans proline' 0 C--N 1.349 0.579 0 C-N-CA 122.464 2.109 . . . . 0.0 112.497 -179.956 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 352' ' ' ALA . . . . . . . . . . . . . . . -61.04 -59.43 5.38 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.028 179.936 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 353' ' ' LEU . . . . . 0.414 ' HG ' ' HG2' ' B' ' 357' ' ' GLU . 5.9 mp -89.88 117.6 28.82 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.856 0.36 . . . . 0.0 111.137 179.921 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 354' ' ' THR . . . . . . . . . . . . . 73.1 p -110.62 -171.19 1.78 Allowed 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.088 -0.506 . . . . 0.0 110.551 179.427 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 355' ' ' GLU . . . . . . . . . . . . . 34.8 mt-10 -54.9 -42.55 72.29 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 121.065 0.46 . . . . 0.0 110.406 179.671 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 356' ' ' GLN . . . . . . . . . . . . . 96.5 mt-30 -67.2 -35.86 80.5 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.667 -0.697 . . . . 0.0 111.054 -179.936 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 357' ' ' GLU . . . . . 0.414 ' HG2' ' HG ' ' B' ' 353' ' ' LEU . 5.7 tp10 -62.41 -53.85 48.95 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.528 -0.306 . . . . 0.0 110.877 -179.703 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 358' ' ' VAL . . . . . 0.431 ' O ' HG22 ' B' ' 362' ' ' VAL . 72.6 t -59.83 -57.03 13.49 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.413 -0.358 . . . . 0.0 111.042 179.984 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 359' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -51.85 -35.19 43.9 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.806 0.336 . . . . 0.0 110.932 -179.527 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 360' ' ' ALA . . . . . . . . . . . . . . . -68.38 -59.21 3.34 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.501 -0.318 . . . . 0.0 111.451 -179.904 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 361' ' ' GLN . . . . . . . . . . . . . 13.3 mm100 -53.66 -42.68 68.11 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.993 -179.991 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 362' ' ' VAL . . . . . 0.431 HG22 ' O ' ' B' ' 358' ' ' VAL . 49.0 t -68.96 -37.66 77.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.732 179.82 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 363' ' ' ALA . . . . . 0.608 ' HA ' HD11 ' B' ' 373' ' ' LEU . . . -59.62 -38.25 80.82 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.736 179.687 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 364' ' ' ARG . . . . . . . . . . . . . 77.6 ttt180 -90.33 -18.79 24.92 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.826 -0.624 . . . . 0.0 110.723 179.964 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 365' ' ' LEU . . . . . . . . . . . . . 25.2 tp -55.7 -30.82 61.77 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.531 179.749 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 366' ' ' PHE . . . . . . . . . . . . . 69.3 m-85 -112.63 159.89 18.43 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.31 179.724 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 367' ' ' LYS . . . . . . . . . . . . . 34.5 mmtp -89.34 -75.67 0.43 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.407 -0.36 . . . . 0.0 111.551 -179.31 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 368' ' ' ASN . . . . . . . . . . . . . 29.4 m-80 -115.48 14.95 16.74 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.406 -0.361 . . . . 0.0 111.136 -179.59 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 369' ' ' GLN . . . . . . . . . . . . . 70.9 mt-30 -89.61 90.3 8.19 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.891 179.989 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 370' ' ' GLU . . . . . . . . . . . . . 34.3 mt-10 -91.8 -11.44 36.59 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.755 179.986 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 371' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -58.4 -57.58 12.27 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.83 179.947 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 372' ' ' LEU . . . . . . . . . . . . . 23.1 mt -61.74 -38.59 88.51 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.491 179.75 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 373' ' ' LEU . . . . . 0.608 HD11 ' HA ' ' B' ' 363' ' ' ALA . 1.0 OUTLIER -56.71 -38.93 73.02 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.567 179.866 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 374' ' ' SER . . . . . . . . . . . . . 70.8 m -73.25 -44.87 58.64 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.046 -0.524 . . . . 0.0 110.296 179.417 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 375' ' ' GLU . . . . . . . . . . . . . 28.1 mm-40 -56.76 -34.34 67.49 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.347 179.437 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 376' ' ' PHE . . . . . . . . . . . . . 66.8 t80 -82.58 -30.12 29.8 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.878 -0.601 . . . . 0.0 109.854 179.266 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 377' ' ' GLY . . . . . . . . . . . . . . . -64.59 -31.37 80.67 Favored Glycine 0 N--CA 1.45 -0.389 0 C-N-CA 120.837 -0.697 . . . . 0.0 111.909 179.326 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 378' ' ' GLN . . . . . . . . . . . . . 30.1 mm-40 -56.8 -26.76 58.58 Favored 'General case' 0 C--N 1.333 -0.139 0 CA-C-O 120.953 0.406 . . . . 0.0 110.477 179.553 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 379' ' ' PHE . . . . . 0.414 ' HB3' ' H ' ' B' ' 380' ' ' LEU . 63.6 m-85 -73.12 -148.19 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.627 179.527 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 380' ' ' LEU . . . . . 0.492 ' H ' ' HG2' ' A' ' 373' ' ' MET . 32.7 mt 66.81 131.13 0.03 OUTLIER Pre-proline 0 CA--C 1.531 0.226 0 CA-C-N 116.482 -0.326 . . . . 0.0 110.789 179.991 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 381' ' ' PRO . . . . . 0.553 ' HG3' ' HB3' ' A' ' 376' ' ' GLN . 62.8 Cg_exo -51.55 125.66 17.36 Favored 'Trans proline' 0 C--N 1.349 0.582 0 C-N-CA 122.28 1.986 . . . . 0.0 112.486 179.989 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 382' ' ' ASP . . . . . 0.438 ' H ' ' HG2' ' A' ' 377' ' ' ARG . 3.3 p30 -132.05 -179.69 5.57 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.894 179.952 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 383' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.077 0 CA-C-O 118.225 -0.893 . . . . 0.0 111.026 -179.929 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 358' ' ' ASP . . . . . . . . . . . . . 7.7 m-20 . . . . . 0 N--CA 1.486 1.36 0 CA-C-O 120.789 0.328 . . . . 0.0 110.899 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 359' ' ' PHE . . . . . . . . . . . . . 5.4 t80 -106.04 145.0 31.96 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.676 -179.926 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 360' ' ' THR . . . . . 0.411 ' HB ' ' HD2' ' A' ' 361' ' ' PRO . 43.9 p -58.01 157.66 15.39 Favored Pre-proline 0 C--N 1.33 -0.281 0 CA-C-N 116.178 -0.464 . . . . 0.0 111.346 179.959 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 361' ' ' PRO . . . . . 0.411 ' HD2' ' HB ' ' A' ' 360' ' ' THR . 30.8 Cg_endo -63.67 -5.08 8.05 Favored 'Trans proline' 0 C--N 1.349 0.596 0 C-N-CA 122.532 2.155 . . . . 0.0 112.51 179.858 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 362' ' ' MET . . . . . 0.483 ' HG3' HD11 ' B' ' 329' ' ' LEU . 26.4 mmt -79.04 11.04 2.95 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.735 179.787 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 363' ' ' ASP . . . . . . . . . . . . . 21.8 t70 -83.57 -6.12 59.36 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.871 179.892 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 364' ' ' SER . . . . . . . . . . . . . 48.8 m -141.79 -22.25 0.72 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.798 179.771 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 365' ' ' SER . . . . . . . . . . . . . 46.9 t -73.66 -63.13 1.27 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.738 179.783 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 366' ' ' ALA . . . . . . . . . . . . . . . -64.12 -17.98 63.98 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.09 179.806 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 367' ' ' VAL . . . . . . . . . . . . . 39.9 t -73.22 -31.39 34.21 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.051 -179.995 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 368' ' ' TYR . . . . . . . . . . . . . 49.1 t80 -70.42 -42.77 71.17 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.932 -179.885 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 369' ' ' VAL . . . . . . . . . . . . . 5.7 p -70.56 -46.88 68.05 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.216 0 CA-C-N 116.242 -0.436 . . . . 0.0 111.157 -179.923 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 370' ' ' LEU . . . . . 0.459 HD13 ' HA ' ' B' ' 307' ' ' ALA . 89.8 mt -60.18 -43.85 95.53 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.816 0.341 . . . . 0.0 110.868 179.808 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 371' ' ' SER . . . . . . . . . . . . . 45.2 t -62.01 -57.28 12.25 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.967 179.89 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 372' ' ' SER . . . . . . . . . . . . . 47.3 t -51.59 -50.85 59.36 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.224 -179.77 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 373' ' ' MET . . . . . . . . . . . . . 94.2 mtp -54.18 -45.54 72.14 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.353 -179.768 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 374' ' ' ALA . . . . . . . . . . . . . . . -79.81 -9.81 59.71 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.583 -0.28 . . . . 0.0 111.635 -179.832 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 375' ' ' ARG . . . . . . . . . . . . . 22.3 mmm180 -100.68 -12.13 19.41 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.558 -0.292 . . . . 0.0 111.363 179.871 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 376' ' ' GLN . . . . . 0.537 ' HB2' ' HG3' ' B' ' 381' ' ' PRO . 18.1 mm-40 -78.18 -7.65 57.34 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.511 -0.313 . . . . 0.0 111.084 179.952 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 377' ' ' ARG . . . . . . . . . . . . . 15.0 ptp180 -63.86 121.67 14.61 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.975 0.417 . . . . 0.0 110.978 -179.641 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 378' ' ' ARG . . . . . . . . . . . . . 99.6 mtt180 53.27 25.53 4.49 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.033 -0.531 . . . . 0.0 111.322 179.798 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 379' ' ' ALA . . . . . . . . . . . . . . . -82.25 -16.99 47.56 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.387 -0.37 . . . . 0.0 111.14 -179.995 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 380' ' ' SER . . . . . . . . . . . . . 64.7 p . . . . . 0 C--O 1.249 1.065 0 CA-C-O 118.33 -0.843 . . . . 0.0 110.947 -179.966 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' B' B ' 295' ' ' SER . . . . . . . . . . . . . 61.1 m . . . . . 0 N--CA 1.486 1.351 0 CA-C-O 120.784 0.326 . . . . 0.0 110.917 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' B' B ' 296' ' ' LEU . . . . . . . . . . . . . 62.0 mt -112.83 -4.44 13.99 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.89 -179.927 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 297' ' ' GLN . . . . . . . . . . . . . 47.5 mt-30 -110.63 157.11 20.05 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.319 -0.401 . . . . 0.0 111.061 -179.921 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 298' ' ' ASN . . . . . 0.534 HD21 ' N ' ' B' ' 298' ' ' ASN . 0.9 OUTLIER 58.73 -177.5 0.08 Allowed 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.099 179.896 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 299' ' ' ASN . . . . . . . . . . . . . 17.1 m120 -112.55 -40.85 3.97 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.948 -179.94 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 300' ' ' GLN . . . . . . . . . . . . . 25.5 tp60 -120.42 100.65 47.15 Favored Pre-proline 0 C--N 1.33 -0.278 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.069 -179.869 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 301' ' ' PRO . . . . . . . . . . . . . 40.1 Cg_endo -66.46 114.74 3.19 Favored 'Trans proline' 0 C--N 1.349 0.579 0 C-N-CA 122.301 2.001 . . . . 0.0 112.046 179.776 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 302' ' ' VAL . . . . . . . . . . . . . 10.3 p -83.28 -33.28 9.95 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.147 -179.823 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 303' ' ' GLU . . . . . . . . . . . . . 27.7 mt-10 -52.12 -74.08 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.859 -0.609 . . . . 0.0 112.016 -179.407 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 304' ' ' PHE . . . . . . . . . . . . . 90.3 m-85 -50.07 -66.52 0.38 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.968 -0.56 . . . . 0.0 112.291 -178.96 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 305' ' ' ASN . . . . . . . . . . . . . 16.8 m120 -41.77 -61.91 1.01 Allowed 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 112.798 0.666 . . . . 0.0 112.798 -178.704 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 306' ' ' HIS . . . . . . . . . . . . . 11.2 m170 -60.46 -67.52 0.39 Allowed 'General case' 0 C--N 1.33 -0.246 0 N-CA-C 112.703 0.631 . . . . 0.0 112.703 -178.519 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 307' ' ' ALA . . . . . 0.459 ' HA ' HD13 ' A' ' 370' ' ' LEU . . . -48.64 -58.11 5.23 Favored 'General case' 0 C--N 1.33 -0.27 0 N-CA-C 112.388 0.514 . . . . 0.0 112.388 -178.542 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 308' ' ' ILE . . . . . . . . . . . . . 42.8 mm -53.37 -60.0 1.51 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 N-CA-C 112.001 0.371 . . . . 0.0 112.001 -179.247 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 309' ' ' ASN . . . . . . . . . . . . . 14.0 m120 -57.82 -25.02 60.05 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 120.594 0.235 . . . . 0.0 111.615 -179.298 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 310' ' ' TYR . . . . . . . . . . . . . 36.3 t80 -69.87 -56.27 7.53 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.506 -0.315 . . . . 0.0 111.128 -179.541 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 311' ' ' VAL . . . . . . . . . . . . . 40.7 t -59.29 -44.05 91.33 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.719 179.976 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 312' ' ' ASN . . . . . . . . . . . . . 7.2 t30 -62.01 -39.94 93.98 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.925 179.914 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 313' ' ' LYS . . . . . . . . . . . . . 4.5 ttmm -60.62 -60.17 4.22 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.985 -179.924 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 314' ' ' ILE . . . . . . . . . . . . . 32.3 mt -59.48 -27.71 37.94 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.129 -179.5 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 315' ' ' LYS . . . . . 0.451 ' HB2' ' HH ' ' B' ' 325' ' ' TYR . 23.3 ttmm -70.18 -40.86 74.41 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.534 -0.303 . . . . 0.0 111.031 179.649 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 316' ' ' ASN . . . . . . . . . . . . . 60.3 t30 -88.89 -8.53 54.08 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.352 -0.386 . . . . 0.0 110.976 -179.716 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 317' ' ' ARG . . . . . . . . . . . . . 20.7 tpp180 -95.34 -61.8 1.41 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.084 -179.933 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 318' ' ' PHE . . . . . . . . . . . . . 73.6 m-85 -94.37 34.73 1.26 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.333 -179.767 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 319' ' ' GLN . . . . . . . . . . . . . 20.9 tm0? -61.62 -31.01 71.07 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.37 179.557 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 320' ' ' GLY . . . . . . . . . . . . . . . -60.33 -62.51 5.94 Favored Glycine 0 C--N 1.332 0.312 0 C-N-CA 120.986 -0.626 . . . . 0.0 112.704 -179.858 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 321' ' ' GLN . . . . . . . . . . . . . 15.0 mm100 -79.36 111.75 23.08 Favored Pre-proline 0 CA--C 1.531 0.22 0 CA-C-N 116.513 0.157 . . . . 0.0 110.989 -179.865 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 322' ' ' PRO . . . . . . . . . . . . . 97.1 Cg_endo -83.96 -22.81 3.36 Favored 'Trans proline' 0 C--N 1.349 0.582 0 C-N-CA 122.547 2.165 . . . . 0.0 112.619 179.989 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 323' ' ' ASP . . . . . . . . . . . . . 6.7 m-20 -70.12 -49.06 54.5 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.268 -0.423 . . . . 0.0 111.155 -179.725 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 324' ' ' ILE . . . . . . . . . . . . . 51.5 mt -64.7 -47.58 88.2 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.205 -179.825 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 325' ' ' TYR . . . . . 0.451 ' HH ' ' HB2' ' B' ' 315' ' ' LYS . 23.5 t80 -60.09 -52.4 65.52 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.078 -179.767 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 326' ' ' LYS . . . . . 0.409 ' O ' ' HG3' ' B' ' 330' ' ' GLU . 87.8 tttt -59.36 -36.24 75.38 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.726 179.879 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 327' ' ' ALA . . . . . . . . . . . . . . . -59.9 -52.81 63.82 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.722 179.644 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 328' ' ' PHE . . . . . . . . . . . . . 81.2 t80 -55.51 -49.58 72.21 Favored 'General case' 0 C--O 1.236 0.346 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.74 179.818 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 329' ' ' LEU . . . . . 0.483 HD11 ' HG3' ' A' ' 362' ' ' MET . 89.4 mt -57.54 -38.47 74.77 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.931 -0.577 . . . . 0.0 111.023 179.89 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 330' ' ' GLU . . . . . 0.409 ' HG3' ' O ' ' B' ' 326' ' ' LYS . 44.7 mt-10 -67.08 -35.35 79.62 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.361 -0.381 . . . . 0.0 111.086 -179.845 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 331' ' ' ILE . . . . . . . . . . . . . 94.4 mt -64.67 -50.91 73.45 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-O 120.855 0.359 . . . . 0.0 110.442 179.348 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 332' ' ' LEU . . . . . . . . . . . . . 4.8 mp -65.97 -31.64 72.67 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.769 179.709 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 333' ' ' HIS . . . . . . . . . . . . . 52.9 t-80 -64.28 -58.06 7.63 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.025 179.34 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 334' ' ' THR . . . . . . . . . . . . . 96.7 m -58.22 -32.44 68.3 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.78 -0.645 . . . . 0.0 110.232 179.139 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 335' ' ' TYR . . . . . . . . . . . . . 74.9 t80 -63.04 -44.43 95.9 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 115.701 -0.681 . . . . 0.0 110.062 179.239 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 336' ' ' GLN . . . . . . . . . . . . . 54.0 tt0 -63.35 -39.47 94.63 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.739 -0.664 . . . . 0.0 110.33 179.488 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 337' ' ' LYS . . . . . . . . . . . . . 14.6 tppt? -58.68 -59.5 5.3 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.929 179.544 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 338' ' ' GLU . . . . . . . . . . . . . 13.6 mm-40 -60.67 -31.08 70.34 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.969 -0.56 . . . . 0.0 111.086 -179.819 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 339' ' ' GLN . . . . . . . . . . . . . 53.5 tt0 -64.47 -45.64 86.51 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.896 0.379 . . . . 0.0 110.793 179.895 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 340' ' ' ARG . . . . . . . . . . . . . 65.7 mtt180 -65.42 -51.61 59.04 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.003 -0.544 . . . . 0.0 111.049 -179.979 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 341' ' ' ASN . . . . . . . . . . . . . 25.8 t-20 -56.43 -39.0 72.36 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.11 -0.496 . . . . 0.0 111.032 -179.8 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 342' ' ' ALA . . . . . . . . . . . . . . . -69.62 -38.64 77.32 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.297 -0.41 . . . . 0.0 111.146 -179.905 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 343' ' ' LYS . . . . . . . . . . . . . 62.8 tttm -65.02 -43.63 91.82 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.262 -0.427 . . . . 0.0 110.888 -179.997 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 344' ' ' GLU . . . . . . . . . . . . . 18.3 mm-40 -70.02 -35.92 74.7 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.041 -179.963 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 345' ' ' ALA . . . . . . . . . . . . . . . -62.34 -35.64 79.73 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.188 -179.893 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 346' ' ' GLY . . . . . . . . . . . . . . . 123.01 -73.07 0.39 Allowed Glycine 0 N--CA 1.453 -0.228 0 C-N-CA 120.771 -0.728 . . . . 0.0 112.61 179.936 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 347' ' ' GLY . . . . . . . . . . . . . . . -177.74 -12.12 0.02 OUTLIER Glycine 0 N--CA 1.451 -0.326 0 C-N-CA 120.778 -0.725 . . . . 0.0 112.509 -179.924 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 348' ' ' ASN . . . . . . . . . . . . . 6.9 t30 -79.1 -23.09 44.34 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.81 0.338 . . . . 0.0 110.719 -179.979 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 349' ' ' TYR . . . . . . . . . . . . . 71.5 t80 -69.8 141.96 53.25 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.799 179.903 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 350' ' ' THR . . . . . . . . . . . . . 38.3 m -107.39 103.41 48.48 Favored Pre-proline 0 C--N 1.328 -0.326 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.248 -179.894 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 351' ' ' PRO . . . . . . . . . . . . . 48.8 Cg_exo -56.54 157.26 19.31 Favored 'Trans proline' 0 C--N 1.349 0.569 0 C-N-CA 122.461 2.107 . . . . 0.0 112.284 179.868 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 352' ' ' ALA . . . . . . . . . . . . . . . -86.82 -43.11 12.74 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.177 179.978 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 353' ' ' LEU . . . . . 0.401 ' HG ' ' HG2' ' B' ' 357' ' ' GLU . 6.6 mp -115.64 125.78 53.32 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.954 0.407 . . . . 0.0 111.182 -179.99 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 354' ' ' THR . . . . . . . . . . . . . 74.0 p -114.19 -170.23 1.68 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.509 179.329 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 355' ' ' GLU . . . . . . . . . . . . . 2.8 mp0 -59.81 -33.69 72.07 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.926 0.393 . . . . 0.0 110.511 179.744 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 356' ' ' GLN . . . . . . . . . . . . . 95.8 mt-30 -74.21 -43.93 55.21 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.006 -0.543 . . . . 0.0 111.331 -179.796 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 357' ' ' GLU . . . . . 0.401 ' HG2' ' HG ' ' B' ' 353' ' ' LEU . 6.2 tp10 -57.23 -48.95 77.53 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 120.992 0.425 . . . . 0.0 110.552 -179.981 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 358' ' ' VAL . . . . . . . . . . . . . 73.7 t -64.43 -58.41 7.34 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 115.853 -0.612 . . . . 0.0 111.277 -179.941 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 359' ' ' TYR . . . . . . . . . . . . . 50.1 t80 -53.93 -26.62 26.24 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.598 -0.274 . . . . 0.0 111.159 -179.48 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 360' ' ' ALA . . . . . . . . . . . . . . . -72.48 -60.36 2.27 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.773 0.321 . . . . 0.0 111.147 179.855 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 361' ' ' GLN . . . . . . . . . . . . . 72.7 mt-30 -57.3 -39.44 75.77 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.922 179.886 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 362' ' ' VAL . . . . . . . . . . . . . 58.1 t -68.39 -38.59 79.58 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.638 179.637 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 363' ' ' ALA . . . . . 0.494 ' HA ' HD13 ' B' ' 373' ' ' LEU . . . -59.21 -43.76 92.29 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.457 179.43 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 364' ' ' ARG . . . . . . . . . . . . . 41.8 ttm180 -79.99 -21.62 43.43 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.859 -0.61 . . . . 0.0 110.484 179.742 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 365' ' ' LEU . . . . . . . . . . . . . 7.5 tp -58.73 -25.9 63.41 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.44 179.657 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 366' ' ' PHE . . . . . . . . . . . . . 47.2 m-85 -129.05 169.12 15.11 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.757 -0.656 . . . . 0.0 110.38 179.818 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 367' ' ' LYS . . . . . . . . . . . . . 55.9 mtmt -132.2 -79.58 0.5 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.786 0.327 . . . . 0.0 111.131 179.974 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 368' ' ' ASN . . . . . . . . . . . . . 22.3 t-20 -73.5 -12.44 60.78 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.827 -179.859 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 369' ' ' GLN . . . . . . . . . . . . . 26.8 mm-40 -96.54 84.12 3.62 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.104 -179.941 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 370' ' ' GLU . . . . . . . . . . . . . 17.4 mm-40 -94.13 -8.9 38.19 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.67 179.438 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 371' ' ' ASP . . . . . . . . . . . . . 7.4 m-20 -57.64 -63.65 1.17 Allowed 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.911 -179.984 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 372' ' ' LEU . . . . . 0.464 HD11 ' H ' ' B' ' 373' ' ' LEU . 0.4 OUTLIER -57.87 -23.14 51.72 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.994 179.872 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 373' ' ' LEU . . . . . 0.494 HD13 ' HA ' ' B' ' 363' ' ' ALA . 4.6 tp -72.69 -39.91 66.66 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.253 179.869 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 374' ' ' SER . . . . . . . . . . . . . 47.4 t -69.16 -51.79 34.6 Favored 'General case' 0 C--O 1.235 0.315 0 CA-C-N 116.025 -0.534 . . . . 0.0 109.916 179.058 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 375' ' ' GLU . . . . . . . . . . . . . 43.0 mt-10 -53.23 -43.61 67.44 Favored 'General case' 0 N--CA 1.455 -0.221 0 CA-C-N 115.791 -0.64 . . . . 0.0 109.698 178.915 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 376' ' ' PHE . . . . . . . . . . . . . 70.9 t80 -62.81 -39.63 94.9 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 115.714 -0.675 . . . . 0.0 110.043 179.172 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 377' ' ' GLY . . . . . . . . . . . . . . . -58.83 -34.9 79.91 Favored Glycine 0 N--CA 1.449 -0.498 0 C-N-CA 120.735 -0.745 . . . . 0.0 111.724 179.32 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 378' ' ' GLN . . . . . . . . . . . . . 55.8 mt-30 -62.99 -30.92 71.97 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.654 0.264 . . . . 0.0 110.962 179.534 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 379' ' ' PHE . . . . . . . . . . . . . 50.2 m-85 -61.45 -35.34 77.32 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.354 -0.384 . . . . 0.0 110.74 179.715 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 380' ' ' LEU . . . . . . . . . . . . . 89.4 mt -56.07 138.25 72.92 Favored Pre-proline 0 C--N 1.329 -0.289 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.864 179.884 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 381' ' ' PRO . . . . . 0.537 ' HG3' ' HB2' ' A' ' 376' ' ' GLN . 72.3 Cg_exo -51.34 133.65 43.01 Favored 'Trans proline' 0 C--N 1.347 0.473 0 C-N-CA 122.447 2.098 . . . . 0.0 112.309 179.953 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 382' ' ' ASP . . . . . . . . . . . . . 9.8 m-20 -114.65 109.64 18.54 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.886 -179.947 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 383' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.033 0 CA-C-O 118.225 -0.893 . . . . 0.0 111.235 -179.81 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 358' ' ' ASP . . . . . . . . . . . . . 11.0 m-20 . . . . . 0 N--CA 1.485 1.298 0 CA-C-O 120.852 0.358 . . . . 0.0 110.941 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 359' ' ' PHE . . . . . . . . . . . . . 30.4 p90 -111.97 -173.55 2.27 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.834 -179.981 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 360' ' ' THR . . . . . . . . . . . . . 77.2 p -132.3 148.1 68.38 Favored Pre-proline 0 C--N 1.328 -0.333 0 CA-C-N 116.275 -0.421 . . . . 0.0 111.257 -179.969 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 361' ' ' PRO . . . . . . . . . . . . . 65.2 Cg_endo -73.07 -154.48 0.04 OUTLIER 'Trans proline' 0 C--N 1.347 0.457 0 C-N-CA 122.57 2.18 . . . . 0.0 112.047 179.754 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 362' ' ' MET . . . . . 0.546 ' HG3' HD12 ' B' ' 329' ' ' LEU . 24.7 ttt -56.32 -71.25 0.09 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.339 -0.391 . . . . 0.0 110.885 179.849 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 363' ' ' ASP . . . . . . . . . . . . . 19.0 t70 -169.82 -55.02 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.647 179.969 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 364' ' ' SER . . . . . . . . . . . . . 79.6 p -100.4 31.13 3.54 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.672 179.84 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 365' ' ' SER . . . . . 0.45 ' HB3' HG21 ' A' ' 367' ' ' VAL . 50.9 m 62.24 94.19 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.952 -0.567 . . . . 0.0 111.1 -179.799 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 366' ' ' ALA . . . . . . . . . . . . . . . -71.91 -13.35 61.62 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.89 179.85 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 367' ' ' VAL . . . . . 0.45 HG21 ' HB3' ' A' ' 365' ' ' SER . 26.9 m -51.22 -21.42 1.5 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.209 0 CA-C-N 115.974 -0.557 . . . . 0.0 111.732 -179.871 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 368' ' ' TYR . . . . . . . . . . . . . 45.7 m-85 -65.19 -61.08 2.35 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.58 -0.282 . . . . 0.0 110.836 179.758 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 369' ' ' VAL . . . . . 0.57 HG12 HD21 ' A' ' 370' ' ' LEU . 2.9 p -64.25 -43.63 97.27 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.204 0 CA-C-N 116.551 -0.295 . . . . 0.0 111.541 -179.882 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 370' ' ' LEU . . . . . 0.57 HD21 HG12 ' A' ' 369' ' ' VAL . 4.2 mm? -57.9 -59.59 5.01 Favored 'General case' 0 C--O 1.235 0.295 0 CA-C-O 120.936 0.398 . . . . 0.0 111.254 -179.955 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 371' ' ' SER . . . . . . . . . . . . . 55.2 m -59.84 -32.33 70.57 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.041 -179.844 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 372' ' ' SER . . . . . . . . . . . . . 47.8 t -59.51 -50.08 75.3 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.849 0.357 . . . . 0.0 110.972 179.904 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 373' ' ' MET . . . . . . . . . . . . . 83.8 mtp -67.1 -34.64 78.07 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.48 -179.749 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 374' ' ' ALA . . . . . . . . . . . . . . . -83.66 -12.69 55.61 Favored 'General case' 0 C--N 1.33 -0.267 0 N-CA-C 112.161 0.43 . . . . 0.0 112.161 -179.239 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 375' ' ' ARG . . . . . . . . . . . . . 27.4 tpt180 -108.74 -13.05 14.85 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.75 0.309 . . . . 0.0 111.059 -179.757 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 376' ' ' GLN . . . . . 0.52 ' HB3' ' HG3' ' B' ' 381' ' ' PRO . 34.2 tt0 -72.37 3.08 5.1 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 121.002 0.43 . . . . 0.0 110.573 179.764 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 377' ' ' ARG . . . . . 0.52 ' HG2' ' H ' ' B' ' 382' ' ' ASP . 80.8 mtm180 -55.59 -34.14 64.55 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.903 179.896 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 378' ' ' ARG . . . . . . . . . . . . . 38.9 mmt180 -118.46 -39.22 3.04 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.08 -179.782 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 379' ' ' ALA . . . . . . . . . . . . . . . -79.3 168.75 19.11 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.369 -179.848 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 380' ' ' SER . . . . . . . . . . . . . 73.6 p . . . . . 0 C--O 1.25 1.094 0 CA-C-O 118.132 -0.937 . . . . 0.0 110.941 -179.993 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' B' B ' 295' ' ' SER . . . . . . . . . . . . . 49.3 m . . . . . 0 N--CA 1.485 1.318 0 CA-C-O 120.749 0.309 . . . . 0.0 110.94 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' B' B ' 296' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -87.92 -10.07 51.72 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.126 -179.975 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 297' ' ' GLN . . . . . . . . . . . . . 46.8 mt-30 -83.66 169.27 15.49 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.372 -0.376 . . . . 0.0 110.985 -179.915 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 298' ' ' ASN . . . . . . . . . . . . . 8.3 p30 -144.5 6.81 1.28 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.121 -0.49 . . . . 0.0 111.04 -179.872 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 299' ' ' ASN . . . . . . . . . . . . . 3.6 p30 -141.24 101.49 4.03 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.978 -179.886 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 300' ' ' GLN . . . . . 0.559 ' HB2' ' HD3' ' B' ' 301' ' ' PRO . 73.6 mt-30 -110.77 -51.03 0.06 OUTLIER Pre-proline 0 CA--C 1.534 0.361 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.576 179.978 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 301' ' ' PRO . . . . . 0.559 ' HD3' ' HB2' ' B' ' 300' ' ' GLN . 79.8 Cg_endo -87.81 27.76 0.53 Allowed 'Trans proline' 0 C--N 1.352 0.742 0 C-N-CA 122.301 2.001 . . . . 0.0 112.057 179.764 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 302' ' ' VAL . . . . . . . . . . . . . 12.8 p -55.59 -17.7 3.66 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-N 116.031 -0.531 . . . . 0.0 111.689 -179.47 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 303' ' ' GLU . . . . . . . . . . . . . 44.2 mt-10 -56.8 -87.35 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.404 -0.362 . . . . 0.0 111.638 -179.461 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 304' ' ' PHE . . . . . . . . . . . . . 42.6 p90 -65.61 -21.12 66.55 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.319 -0.401 . . . . 0.0 111.722 -179.176 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 305' ' ' ASN . . . . . . . . . . . . . 6.2 t30 -68.37 -64.68 0.82 Allowed 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.777 0.322 . . . . 0.0 111.032 -179.744 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 306' ' ' HIS . . . . . . . . . . . . . 18.8 t-160 -64.74 -34.44 78.32 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.3 -179.435 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 307' ' ' ALA . . . . . . . . . . . . . . . -64.43 -59.54 4.22 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.497 -0.32 . . . . 0.0 111.456 -179.736 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 308' ' ' ILE . . . . . . . . . . . . . 94.5 mt -56.98 -49.51 79.07 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 CA-C-N 116.53 -0.305 . . . . 0.0 111.406 -179.796 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 309' ' ' ASN . . . . . . . . . . . . . 3.6 m-20 -55.55 -40.93 72.54 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.809 0.338 . . . . 0.0 110.812 179.832 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 310' ' ' TYR . . . . . 0.428 ' O ' HG12 ' B' ' 314' ' ' ILE . 84.1 t80 -62.5 -64.24 0.98 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.902 -179.99 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 311' ' ' VAL . . . . . . . . . . . . . 55.4 t -52.84 -24.03 6.29 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.221 0 CA-C-O 120.873 0.368 . . . . 0.0 110.894 179.986 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 312' ' ' ASN . . . . . . . . . . . . . 44.2 t30 -69.89 -56.82 6.05 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.066 179.855 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 313' ' ' LYS . . . . . 0.432 ' HD3' ' N ' ' B' ' 314' ' ' ILE . 0.0 OUTLIER -66.28 -23.55 66.41 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-O 120.775 0.322 . . . . 0.0 111.152 -179.907 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 314' ' ' ILE . . . . . 0.432 ' N ' ' HD3' ' B' ' 313' ' ' LYS . 31.2 mm -74.65 -43.55 47.57 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 116.392 -0.367 . . . . 0.0 110.754 179.805 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 315' ' ' LYS . . . . . . . . . . . . . 25.5 ttpp -73.42 -27.64 61.55 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.785 179.84 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 316' ' ' ASN . . . . . . . . . . . . . 30.6 t30 -74.32 -50.48 18.61 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.958 179.885 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 317' ' ' ARG . . . . . . . . . . . . . 27.3 mmm180 -61.64 -53.64 53.49 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.142 179.979 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 318' ' ' PHE . . . . . . . . . . . . . 75.6 m-85 -90.77 31.62 1.05 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.082 -179.847 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 319' ' ' GLN . . . . . . . . . . . . . 35.3 tt0 -61.91 -25.64 67.69 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.851 179.936 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 320' ' ' GLY . . . . . . . . . . . . . . . -94.48 -18.38 35.93 Favored Glycine 0 N--CA 1.451 -0.361 0 C-N-CA 120.858 -0.687 . . . . 0.0 112.455 179.971 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 321' ' ' GLN . . . . . . . . . . . . . 8.7 tp-100 -109.83 91.47 10.8 Favored Pre-proline 0 C--N 1.33 -0.273 0 CA-C-O 120.437 0.16 . . . . 0.0 110.731 179.947 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 322' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_endo -76.26 -12.73 19.07 Favored 'Trans proline' 0 C--N 1.348 0.515 0 C-N-CA 122.552 2.168 . . . . 0.0 112.548 -179.891 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 323' ' ' ASP . . . . . . . . . . . . . 20.2 t70 -70.82 -56.32 6.58 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.19 -179.854 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 324' ' ' ILE . . . . . . . . . . . . . 62.1 mt -62.44 -40.63 88.79 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.222 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.096 -179.868 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 325' ' ' TYR . . . . . . . . . . . . . 35.0 t80 -63.22 -48.64 77.42 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.589 179.767 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 326' ' ' LYS . . . . . 0.4 ' O ' ' HG3' ' B' ' 330' ' ' GLU . 41.0 ttmt -60.55 -37.3 80.79 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.706 179.887 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 327' ' ' ALA . . . . . . . . . . . . . . . -62.1 -54.48 40.69 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.133 179.941 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 328' ' ' PHE . . . . . . . . . . . . . 62.7 t80 -53.62 -45.55 70.14 Favored 'General case' 0 C--O 1.234 0.275 0 CA-C-O 121.008 0.432 . . . . 0.0 110.501 179.899 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 329' ' ' LEU . . . . . 0.546 HD12 ' HG3' ' A' ' 362' ' ' MET . 92.1 mt -59.21 -43.34 92.3 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.868 -0.606 . . . . 0.0 110.645 179.56 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 330' ' ' GLU . . . . . 0.4 ' HG3' ' O ' ' B' ' 326' ' ' LYS . 40.6 mt-10 -59.64 -37.79 79.65 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.763 179.713 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 331' ' ' ILE . . . . . . . . . . . . . 76.1 mt -63.47 -56.6 16.08 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.806 179.728 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 332' ' ' LEU . . . . . 0.426 HD21 HD21 ' A' ' 370' ' ' LEU . 7.3 mp -66.28 -19.19 65.75 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.257 -179.984 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 333' ' ' HIS . . . . . . . . . . . . . 34.6 t-80 -71.61 -59.52 2.71 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 121.031 0.443 . . . . 0.0 110.09 179.284 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 334' ' ' THR . . . . . . . . . . . . . 88.7 m -62.41 -29.77 70.74 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.049 179.21 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 335' ' ' TYR . . . . . . . . . . . . . 69.8 t80 -69.14 -41.55 77.18 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 115.729 -0.669 . . . . 0.0 110.488 179.461 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 336' ' ' GLN . . . . . 0.429 ' HB2' ' HB ' ' A' ' 369' ' ' VAL . 26.3 tt0 -68.23 -33.38 74.3 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.693 -179.993 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 337' ' ' LYS . . . . . 0.523 ' O ' ' HG2' ' B' ' 340' ' ' ARG . 1.0 OUTLIER -72.96 -47.95 40.99 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.885 -179.976 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 338' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -65.78 -28.27 68.89 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.034 0.445 . . . . 0.0 109.873 179.434 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 339' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -73.83 -49.39 25.4 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 115.716 -0.675 . . . . 0.0 110.497 179.407 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 340' ' ' ARG . . . . . 0.558 ' HG3' ' N ' ' B' ' 341' ' ' ASN . 14.9 ptm180 -56.46 -51.83 66.97 Favored 'General case' 0 C--N 1.333 -0.138 0 CA-C-O 121.078 0.466 . . . . 0.0 110.742 -179.838 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 341' ' ' ASN . . . . . 0.558 ' N ' ' HG3' ' B' ' 340' ' ' ARG . 2.3 t-20 -58.72 -47.66 83.82 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.62 -0.718 . . . . 0.0 110.732 179.387 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 342' ' ' ALA . . . . . . . . . . . . . . . -63.79 -23.08 67.22 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.022 179.788 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 343' ' ' LYS . . . . . . . . . . . . . 88.0 tttt -78.77 -39.06 37.04 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.799 179.924 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 344' ' ' GLU . . . . . . . . . . . . . 7.0 mm-40 -75.64 -26.97 58.19 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.831 179.829 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 345' ' ' ALA . . . . . . . . . . . . . . . -64.93 -40.17 94.63 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.042 -0.526 . . . . 0.0 111.029 -179.905 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 346' ' ' GLY . . . . . . . . . . . . . . . 87.53 -36.39 3.35 Favored Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.692 -0.766 . . . . 0.0 112.361 -179.86 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 347' ' ' GLY . . . . . . . . . . . . . . . 176.71 179.17 47.0 Favored Glycine 0 N--CA 1.451 -0.35 0 C-N-CA 120.721 -0.752 . . . . 0.0 112.572 179.959 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 348' ' ' ASN . . . . . . . . . . . . . 14.5 t-20 58.89 20.03 7.66 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.898 0.38 . . . . 0.0 110.952 179.842 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 349' ' ' TYR . . . . . . . . . . . . . 57.7 t80 -120.19 136.82 54.5 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.853 -179.867 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 350' ' ' THR . . . . . . . . . . . . . 27.5 m -105.7 106.26 55.83 Favored Pre-proline 0 C--N 1.33 -0.28 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.819 179.998 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 351' ' ' PRO . . . . . . . . . . . . . 34.9 Cg_exo -58.09 177.36 0.27 Allowed 'Trans proline' 0 C--N 1.348 0.542 0 C-N-CA 122.485 2.124 . . . . 0.0 112.638 -179.813 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 352' ' ' ALA . . . . . . . . . . . . . . . -98.27 -73.57 0.61 Allowed 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.453 -179.751 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 353' ' ' LEU . . . . . 0.522 HD21 ' HG2' ' B' ' 357' ' ' GLU . 40.6 mt -99.25 133.32 43.71 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.934 0.397 . . . . 0.0 111.15 -179.778 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 354' ' ' THR . . . . . . . . . . . . . 57.6 p -104.08 -178.31 3.62 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.791 179.842 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 355' ' ' GLU . . . . . . . . . . . . . 41.4 mt-10 -60.65 -39.53 88.67 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.833 0.349 . . . . 0.0 110.786 179.914 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 356' ' ' GLN . . . . . . . . . . . . . 29.1 mm-40 -70.57 -38.82 74.14 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.0 -179.961 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 357' ' ' GLU . . . . . 0.522 ' HG2' HD21 ' B' ' 353' ' ' LEU . 9.6 tp10 -61.55 -49.37 76.94 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.41 -0.359 . . . . 0.0 110.55 179.999 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 358' ' ' VAL . . . . . . . . . . . . . 53.3 t -61.42 -56.67 16.29 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.94 179.688 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 359' ' ' TYR . . . . . . . . . . . . . 2.8 t80 -53.96 -30.36 46.47 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.445 -0.343 . . . . 0.0 110.788 -179.802 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 360' ' ' ALA . . . . . . . . . . . . . . . -66.92 -60.42 2.66 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.165 179.821 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 361' ' ' GLN . . . . . . . . . . . . . 47.0 mt-30 -57.46 -39.01 75.41 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.477 179.865 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 362' ' ' VAL . . . . . . . . . . . . . 94.2 t -66.53 -33.72 65.34 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.198 179.298 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 363' ' ' ALA . . . . . 0.482 ' HA ' HD21 ' B' ' 373' ' ' LEU . . . -63.85 -43.1 97.16 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.174 179.264 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 364' ' ' ARG . . . . . . . . . . . . . 9.6 mpt_? -80.06 -17.45 52.66 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.811 -0.631 . . . . 0.0 110.161 178.896 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 365' ' ' LEU . . . . . . . . . . . . . 14.1 tp -68.78 -40.76 79.51 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.787 -0.642 . . . . 0.0 111.226 -179.917 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 366' ' ' PHE . . . . . 0.648 ' HB3' ' HB2' ' B' ' 369' ' ' GLN . 32.8 m-85 -106.4 -29.84 9.49 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.438 -0.346 . . . . 0.0 111.393 -179.522 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 367' ' ' LYS . . . . . . . . . . . . . 92.0 mttt 54.01 -96.62 0.06 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.209 -0.451 . . . . 0.0 112.19 179.892 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 368' ' ' ASN . . . . . . . . . . . . . 18.5 m120 -54.75 -46.4 74.32 Favored 'General case' 0 N--CA 1.462 0.139 0 CA-C-N 116.541 -0.299 . . . . 0.0 111.561 -179.192 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 369' ' ' GLN . . . . . 0.648 ' HB2' ' HB3' ' B' ' 366' ' ' PHE . 2.4 mp0 -66.4 97.92 0.45 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.429 -0.35 . . . . 0.0 111.035 -179.778 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 370' ' ' GLU . . . . . . . . . . . . . 43.9 tt0 -93.69 -17.8 22.82 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.97 179.907 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 371' ' ' ASP . . . . . . . . . . . . . 6.9 m-20 -54.78 -45.35 74.27 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.31 -0.404 . . . . 0.0 110.676 179.81 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 372' ' ' LEU . . . . . 0.54 HD12 ' HB3' ' B' ' 369' ' ' GLN . 6.4 mp -64.85 -41.83 95.39 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.505 179.51 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 373' ' ' LEU . . . . . 0.482 HD21 ' HA ' ' B' ' 363' ' ' ALA . 1.1 mp -61.13 -32.2 71.9 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.808 179.842 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 374' ' ' SER . . . . . . . . . . . . . 56.0 m -71.61 -52.13 19.67 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.036 179.28 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 375' ' ' GLU . . . . . . . . . . . . . 7.7 tp10 -58.05 -33.05 68.59 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 115.732 -0.667 . . . . 0.0 109.898 179.279 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 376' ' ' PHE . . . . . . . . . . . . . 54.0 t80 -79.4 -27.81 41.81 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.736 -0.665 . . . . 0.0 109.906 179.263 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 377' ' ' GLY . . . . . . . . . . . . . . . -64.29 -41.2 98.32 Favored Glycine 0 N--CA 1.448 -0.546 0 C-N-CA 120.673 -0.775 . . . . 0.0 111.317 179.076 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 378' ' ' GLN . . . . . . . . . . . . . 46.1 mt-30 -71.63 -23.44 61.69 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.915 0.388 . . . . 0.0 110.144 179.095 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 379' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -62.33 -31.8 72.48 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-N 115.813 -0.631 . . . . 0.0 110.576 179.407 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 380' ' ' LEU . . . . . . . . . . . . . 39.8 mt -61.92 147.57 89.58 Favored Pre-proline 0 C--N 1.33 -0.28 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.714 -179.964 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 381' ' ' PRO . . . . . 0.52 ' HG3' ' HB3' ' A' ' 376' ' ' GLN . 52.1 Cg_exo -52.83 135.5 57.6 Favored 'Trans proline' 0 C--N 1.347 0.456 0 C-N-CA 122.391 2.061 . . . . 0.0 112.333 179.946 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 382' ' ' ASP . . . . . 0.52 ' H ' ' HG2' ' A' ' 377' ' ' ARG . 7.8 m-20 -93.35 130.01 39.26 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.308 -0.405 . . . . 0.0 110.958 179.972 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 383' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.045 0 CA-C-O 118.231 -0.89 . . . . 0.0 111.116 -179.861 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 358' ' ' ASP . . . . . . . . . . . . . 18.4 t70 . . . . . 0 N--CA 1.486 1.335 0 CA-C-O 120.761 0.315 . . . . 0.0 110.814 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 359' ' ' PHE . . . . . . . . . . . . . 72.3 t80 -140.08 148.3 41.53 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.803 -179.981 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 360' ' ' THR . . . . . 0.606 ' HB ' ' HD3' ' A' ' 361' ' ' PRO . 66.5 m -155.83 -52.58 0.02 OUTLIER Pre-proline 0 CA--C 1.533 0.31 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.667 179.802 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 361' ' ' PRO . . . . . 0.606 ' HD3' ' HB ' ' A' ' 360' ' ' THR . 73.0 Cg_endo -87.09 129.6 2.87 Favored 'Trans proline' 0 C--N 1.352 0.753 0 C-N-CA 122.204 1.936 . . . . 0.0 112.821 -179.783 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 362' ' ' MET . . . . . . . . . . . . . 4.0 tpt -58.32 -68.61 0.24 Allowed 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.553 179.436 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 363' ' ' ASP . . . . . . . . . . . . . 21.7 t70 -175.82 31.93 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.866 -0.606 . . . . 0.0 110.081 179.907 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 364' ' ' SER . . . . . . . . . . . . . 31.5 t 62.38 38.22 13.13 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.577 -179.697 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 365' ' ' SER . . . . . . . . . . . . . 49.0 m -140.28 -63.21 0.49 Allowed 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.226 -179.818 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 366' ' ' ALA . . . . . . . . . . . . . . . -57.53 -43.82 84.63 Favored 'General case' 0 C--O 1.233 0.223 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.618 -179.628 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 367' ' ' VAL . . . . . . . . . . . . . 35.7 m -54.88 -35.14 32.84 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.925 179.904 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 368' ' ' TYR . . . . . . . . . . . . . 68.7 m-85 -71.04 -24.24 62.31 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.487 179.531 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 369' ' ' VAL . . . . . 0.569 HG23 ' HB2' ' B' ' 336' ' ' GLN . 6.7 t -73.03 -57.73 6.37 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.195 179.383 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 370' ' ' LEU . . . . . 0.422 ' H ' HD22 ' A' ' 370' ' ' LEU . 3.2 mm? -58.56 -37.91 76.74 Favored 'General case' 0 C--O 1.233 0.201 0 CA-C-N 115.763 -0.653 . . . . 0.0 110.443 179.793 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 371' ' ' SER . . . . . 0.62 ' HA ' ' HB2' ' B' ' 303' ' ' GLU . 99.0 p -63.53 -55.87 20.5 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.901 179.928 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 372' ' ' SER . . . . . . . . . . . . . 91.4 p -54.48 -34.37 61.44 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.3 -179.806 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 373' ' ' MET . . . . . . . . . . . . . 56.6 mtt -66.69 -52.26 46.78 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.522 -179.971 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 374' ' ' ALA . . . . . 0.435 ' HB2' ' HB3' ' B' ' 303' ' ' GLU . . . -81.6 -6.74 59.29 Favored 'General case' 0 C--N 1.331 -0.236 0 N-CA-C 112.387 0.514 . . . . 0.0 112.387 -178.973 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 375' ' ' ARG . . . . . . . . . . . . . 18.7 mmt180 -94.82 -42.58 8.63 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.81 0.338 . . . . 0.0 111.164 179.88 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 376' ' ' GLN . . . . . . . . . . . . . 44.2 tt0 -83.32 35.35 0.49 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.046 -0.524 . . . . 0.0 111.077 -179.579 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 377' ' ' ARG . . . . . 0.537 ' HG2' ' HA ' ' B' ' 381' ' ' PRO . 73.0 mtp180 -78.78 4.23 14.47 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.344 -0.389 . . . . 0.0 111.094 179.931 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 378' ' ' ARG . . . . . . . . . . . . . 21.3 tpp180 -99.04 -25.61 14.5 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.308 -0.405 . . . . 0.0 110.906 -179.957 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 379' ' ' ALA . . . . . . . . . . . . . . . -65.98 144.97 56.42 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.145 -179.962 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 380' ' ' SER . . . . . . . . . . . . . 46.6 t . . . . . 0 C--O 1.25 1.108 0 CA-C-O 118.285 -0.864 . . . . 0.0 111.052 -179.902 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' B' B ' 295' ' ' SER . . . . . . . . . . . . . 39.1 t . . . . . 0 N--CA 1.487 1.383 0 CA-C-O 120.853 0.358 . . . . 0.0 110.961 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' B' B ' 296' ' ' LEU . . . . . 0.531 HD11 ' N ' ' B' ' 296' ' ' LEU . 0.0 OUTLIER -134.03 9.5 3.83 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.132 -0.486 . . . . 0.0 111.122 -179.878 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' B' B ' 297' ' ' GLN . . . . . 0.421 ' HG2' ' H ' ' B' ' 299' ' ' ASN . 33.2 tt0 -82.56 156.79 23.78 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.869 179.922 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 298' ' ' ASN . . . . . . . . . . . . . 18.8 m120 -138.91 -0.17 1.91 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.212 -179.988 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 299' ' ' ASN . . . . . 0.421 ' H ' ' HG2' ' B' ' 297' ' ' GLN . 42.5 m-80 -66.59 -49.03 67.67 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.458 -0.337 . . . . 0.0 110.742 179.918 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 300' ' ' GLN . . . . . . . . . . . . . 48.1 mt-30 -77.76 159.71 75.95 Favored Pre-proline 0 C--N 1.33 -0.265 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.656 179.583 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 301' ' ' PRO . . . . . 0.446 ' HB2' ' HB3' ' B' ' 304' ' ' PHE . 89.0 Cg_exo -46.99 156.31 0.72 Allowed 'Trans proline' 0 C--N 1.351 0.696 0 C-N-CA 122.601 2.201 . . . . 0.0 112.373 179.908 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 302' ' ' VAL . . . . . 0.48 HG12 ' H ' ' B' ' 303' ' ' GLU . 2.7 p -90.76 -58.12 3.78 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-N 116.439 -0.346 . . . . 0.0 111.761 -179.409 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 303' ' ' GLU . . . . . 0.62 ' HB2' ' HA ' ' A' ' 371' ' ' SER . 0.1 OUTLIER -62.13 -29.71 70.52 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.404 -0.362 . . . . 0.0 111.769 -179.058 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' B' B ' 304' ' ' PHE . . . . . 0.446 ' HB3' ' HB2' ' B' ' 301' ' ' PRO . 67.3 t80 -63.0 -71.33 0.17 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.77 0.319 . . . . 0.0 111.188 -179.648 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 305' ' ' ASN . . . . . . . . . . . . . 27.2 t-20 -53.68 -42.86 68.39 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.582 -179.413 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 306' ' ' HIS . . . . . . . . . . . . . 8.5 m-70 -62.53 -67.7 0.4 Allowed 'General case' 0 C--N 1.331 -0.22 0 N-CA-C 112.083 0.401 . . . . 0.0 112.083 -179.225 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 307' ' ' ALA . . . . . . . . . . . . . . . -49.89 -52.74 30.59 Favored 'General case' 0 N--CA 1.465 0.289 0 N-CA-C 112.331 0.493 . . . . 0.0 112.331 -178.905 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 308' ' ' ILE . . . . . . . . . . . . . 1.7 mp -54.93 -58.96 2.79 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-O 120.595 0.236 . . . . 0.0 111.439 -179.617 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 309' ' ' ASN . . . . . . . . . . . . . 14.1 m120 -61.52 -19.4 62.07 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.546 -0.297 . . . . 0.0 111.265 -179.646 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 310' ' ' TYR . . . . . . . . . . . . . 24.0 t80 -74.95 -57.28 4.0 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.416 -0.356 . . . . 0.0 111.326 -179.479 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 311' ' ' VAL . . . . . . . . . . . . . 5.8 m -63.19 -33.69 62.42 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.203 0 CA-C-O 120.87 0.367 . . . . 0.0 110.639 -179.818 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 312' ' ' ASN . . . . . . . . . . . . . 6.3 t30 -70.11 -42.88 72.09 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.585 179.751 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 313' ' ' LYS . . . . . . . . . . . . . 4.5 ttmm -60.23 -49.57 77.11 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.035 179.807 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 314' ' ' ILE . . . . . . . . . . . . . 75.8 mt -64.6 -39.59 86.12 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.658 -179.43 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 315' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -65.51 -40.2 92.72 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.744 0.307 . . . . 0.0 111.095 -179.714 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 316' ' ' ASN . . . . . . . . . . . . . 28.2 t-20 -68.77 -51.35 42.06 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.321 -0.399 . . . . 0.0 111.355 -179.479 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 317' ' ' ARG . . . . . 0.458 HH22 HD11 ' B' ' 372' ' ' LEU . 35.7 mtm180 -59.99 -59.08 6.0 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.384 -0.371 . . . . 0.0 111.071 -179.91 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 318' ' ' PHE . . . . . . . . . . . . . 95.1 m-85 -87.65 40.87 0.96 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.917 -179.97 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 319' ' ' GLN . . . . . . . . . . . . . 63.3 tt0 -59.5 -33.64 71.6 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.972 -179.875 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 320' ' ' GLY . . . . . . . . . . . . . . . -80.27 -14.32 80.53 Favored Glycine 0 N--CA 1.452 -0.256 0 C-N-CA 120.853 -0.689 . . . . 0.0 112.261 179.735 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 321' ' ' GLN . . . . . . . . . . . . . 6.1 tp-100 -118.07 83.29 19.18 Favored Pre-proline 0 C--N 1.329 -0.315 0 CA-C-O 120.528 0.204 . . . . 0.0 110.802 -179.998 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 322' ' ' PRO . . . . . . . . . . . . . 76.5 Cg_endo -77.71 -10.17 17.06 Favored 'Trans proline' 0 C--N 1.346 0.404 0 C-N-CA 122.386 2.058 . . . . 0.0 112.338 179.844 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 323' ' ' ASP . . . . . . . . . . . . . 9.5 m-20 -70.08 -52.78 21.07 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.07 -0.514 . . . . 0.0 111.191 -179.742 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 324' ' ' ILE . . . . . . . . . . . . . 71.3 mt -63.89 -46.34 94.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.425 -0.352 . . . . 0.0 111.246 -179.904 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 325' ' ' TYR . . . . . . . . . . . . . 68.8 t80 -58.15 -58.27 9.21 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.155 179.982 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 326' ' ' LYS . . . . . . . . . . . . . 39.4 ttmt -56.95 -41.47 78.35 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.121 -179.728 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 327' ' ' ALA . . . . . . . . . . . . . . . -57.02 -48.29 78.85 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.907 0.384 . . . . 0.0 111.148 -179.997 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 328' ' ' PHE . . . . . . . . . . . . . 45.7 t80 -58.56 -53.87 53.43 Favored 'General case' 0 C--O 1.237 0.435 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.664 179.931 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 329' ' ' LEU . . . . . . . . . . . . . 10.4 mp -60.82 -26.71 67.51 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.979 -179.844 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 330' ' ' GLU . . . . . . . . . . . . . 28.4 mt-10 -70.38 -42.32 71.89 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.852 0.358 . . . . 0.0 110.207 179.306 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 331' ' ' ILE . . . . . 0.494 HG23 HG23 ' B' ' 358' ' ' VAL . 93.8 mt -61.03 -48.03 90.92 Favored 'Isoleucine or valine' 0 C--O 1.233 0.224 0 CA-C-N 116.126 -0.488 . . . . 0.0 109.956 179.085 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 332' ' ' LEU . . . . . . . . . . . . . 10.8 mp -64.81 -33.66 76.52 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 115.813 -0.631 . . . . 0.0 110.512 179.427 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 333' ' ' HIS . . . . . . . . . . . . . 43.3 t60 -60.83 -54.15 48.67 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.057 -0.52 . . . . 0.0 109.956 179.297 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 334' ' ' THR . . . . . . . . . . . . . 62.8 m -61.35 -30.48 70.54 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.687 -0.688 . . . . 0.0 110.338 179.238 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 335' ' ' TYR . . . . . . . . . . . . . 67.8 t80 -60.62 -53.79 53.19 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.844 -0.617 . . . . 0.0 111.158 179.696 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 336' ' ' GLN . . . . . 0.569 ' HB2' HG23 ' A' ' 369' ' ' VAL . 6.4 tp-100 -65.89 -36.64 83.97 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.417 -0.356 . . . . 0.0 111.029 -179.928 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 337' ' ' LYS . . . . . . . . . . . . . 39.8 ttpt -57.89 -56.65 19.27 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.951 0.405 . . . . 0.0 110.995 179.9 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 338' ' ' GLU . . . . . . . . . . . . . 19.5 mm-40 -64.11 -36.25 83.42 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.037 -0.528 . . . . 0.0 111.289 -179.857 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 339' ' ' GLN . . . . . . . . . . . . . 6.5 tp-100 -61.0 -46.07 92.25 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.312 -0.403 . . . . 0.0 110.847 179.968 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 340' ' ' ARG . . . . . . . . . . . . . 96.6 mtt180 -63.87 -51.71 63.32 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.652 179.836 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 341' ' ' ASN . . . . . . . . . . . . . 74.9 m-20 -56.59 -33.44 66.21 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.8 179.706 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 342' ' ' ALA . . . . . . . . . . . . . . . -72.75 -37.05 67.82 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.011 179.885 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 343' ' ' LYS . . . . . . . . . . . . . 64.6 tttp -71.85 -28.07 63.31 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.978 -0.555 . . . . 0.0 110.497 179.803 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 344' ' ' GLU . . . . . . . . . . . . . 17.3 mm-40 -77.9 -41.32 36.95 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.912 -0.585 . . . . 0.0 110.788 179.681 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 345' ' ' ALA . . . . . . . . . . . . . . . -60.63 -32.94 72.08 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.272 179.898 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 346' ' ' GLY . . . . . . . . . . . . . . . 69.1 33.39 74.04 Favored Glycine 0 N--CA 1.451 -0.362 0 C-N-CA 120.712 -0.756 . . . . 0.0 112.387 -179.832 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 347' ' ' GLY . . . . . . . . . . . . . . . 113.07 176.88 19.58 Favored Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.825 -0.702 . . . . 0.0 112.441 -179.993 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 348' ' ' ASN . . . . . . . . . . . . . 63.9 t30 58.47 15.7 3.71 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.908 0.385 . . . . 0.0 111.045 179.965 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 349' ' ' TYR . . . . . . . . . . . . . 73.9 t80 -117.76 144.53 45.22 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.886 -179.954 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 350' ' ' THR . . . . . . . . . . . . . 38.0 m -120.64 97.66 48.48 Favored Pre-proline 0 C--N 1.329 -0.297 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.038 -179.865 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 351' ' ' PRO . . . . . . . . . . . . . 45.9 Cg_exo -56.5 159.26 13.81 Favored 'Trans proline' 0 C--N 1.348 0.529 0 C-N-CA 122.503 2.136 . . . . 0.0 112.325 179.869 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 352' ' ' ALA . . . . . . . . . . . . . . . -70.11 -76.95 0.09 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.133 179.993 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 353' ' ' LEU . . . . . 0.578 ' HB3' ' HG2' ' B' ' 357' ' ' GLU . 0.3 OUTLIER -107.32 154.85 20.66 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 121.095 0.474 . . . . 0.0 111.726 179.965 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' B' B ' 354' ' ' THR . . . . . . . . . . . . . 59.6 p -114.85 -172.91 2.21 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.871 -0.604 . . . . 0.0 110.767 179.586 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 355' ' ' GLU . . . . . . . . . . . . . 7.8 pt-20 -58.92 -42.73 90.4 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 121.309 0.576 . . . . 0.0 110.072 179.577 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 356' ' ' GLN . . . . . . . . . . . . . 28.9 tt0 -64.56 -38.37 90.77 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.394 -0.821 . . . . 0.0 110.97 179.656 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 357' ' ' GLU . . . . . 0.578 ' HG2' ' HB3' ' B' ' 353' ' ' LEU . 4.6 tp10 -61.21 -50.03 74.75 Favored 'General case' 0 C--N 1.333 -0.138 0 CA-C-O 120.807 0.337 . . . . 0.0 110.506 179.948 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 358' ' ' VAL . . . . . 0.494 HG23 HG23 ' B' ' 331' ' ' ILE . 93.5 t -59.09 -60.55 2.25 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.069 -0.514 . . . . 0.0 111.014 179.991 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 359' ' ' TYR . . . . . . . . . . . . . 2.2 t80 -52.0 -33.44 38.21 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.521 -0.309 . . . . 0.0 111.014 -179.325 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 360' ' ' ALA . . . . . . . . . . . . . . . -65.58 -60.59 2.76 Favored 'General case' 0 C--O 1.234 0.246 0 CA-C-N 116.502 -0.317 . . . . 0.0 111.242 179.896 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 361' ' ' GLN . . . . . 0.412 HE21 HD12 ' B' ' 331' ' ' ILE . 25.1 mt-30 -58.15 -36.23 72.7 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.98 0.419 . . . . 0.0 110.414 179.923 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 362' ' ' VAL . . . . . 0.484 HG21 ' O ' ' B' ' 358' ' ' VAL . 66.1 t -70.64 -32.05 48.17 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 115.902 -0.59 . . . . 0.0 109.988 179.246 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 363' ' ' ALA . . . . . 0.543 ' HA ' HD11 ' B' ' 373' ' ' LEU . . . -65.16 -38.87 91.96 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 115.914 -0.585 . . . . 0.0 109.876 179.124 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 364' ' ' ARG . . . . . . . . . . . . . 31.8 ttm180 -80.85 -23.41 39.12 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.574 -0.739 . . . . 0.0 110.109 179.011 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 365' ' ' LEU . . . . . . . . . . . . . 8.3 tp -58.12 -24.84 60.22 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.826 -0.625 . . . . 0.0 110.185 179.523 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 366' ' ' PHE . . . . . 0.45 ' HB3' ' HB2' ' B' ' 369' ' ' GLN . 38.1 m-85 -129.07 179.85 5.52 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.742 -0.663 . . . . 0.0 110.423 179.708 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 367' ' ' LYS . . . . . . . . . . . . . 98.4 mttt -138.49 -80.61 0.33 Allowed 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.584 -0.28 . . . . 0.0 111.246 179.904 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 368' ' ' ASN . . . . . . . . . . . . . 28.0 p30 -79.96 7.67 8.5 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.275 -0.421 . . . . 0.0 110.887 -179.886 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 369' ' ' GLN . . . . . 0.654 ' HB3' HD12 ' B' ' 372' ' ' LEU . 44.5 mt-30 -103.38 91.67 4.16 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.022 -0.536 . . . . 0.0 111.436 -179.788 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 370' ' ' GLU . . . . . . . . . . . . . 42.5 mt-10 -94.54 -20.24 19.81 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.875 179.504 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 371' ' ' ASP . . . . . . . . . . . . . 23.5 t70 -59.09 -45.3 91.2 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.69 179.748 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 372' ' ' LEU . . . . . 0.654 HD12 ' HB3' ' B' ' 369' ' ' GLN . 6.6 mp -62.5 -51.82 65.91 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.731 179.593 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 373' ' ' LEU . . . . . 0.543 HD11 ' HA ' ' B' ' 363' ' ' ALA . 1.1 mp -55.88 -37.47 68.87 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.797 -0.638 . . . . 0.0 111.282 -179.749 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 374' ' ' SER . . . . . . . . . . . . . 70.1 m -69.25 -53.39 20.07 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.676 179.754 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 375' ' ' GLU . . . . . . . . . . . . . 39.4 mm-40 -52.56 -36.76 56.5 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.259 179.485 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 376' ' ' PHE . . . . . . . . . . . . . 91.8 t80 -70.24 -41.09 73.99 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.28 179.429 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 377' ' ' GLY . . . . . . . . . . . . . . . -60.2 -32.59 76.93 Favored Glycine 0 N--CA 1.45 -0.379 0 C-N-CA 120.768 -0.729 . . . . 0.0 112.086 179.536 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 378' ' ' GLN . . . . . . . . . . . . . 23.4 mt-30 -60.31 -29.73 69.04 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.798 0.332 . . . . 0.0 110.614 179.656 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 379' ' ' PHE . . . . . . . . . . . . . 75.1 m-85 -69.9 -34.53 73.64 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.789 179.733 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 380' ' ' LEU . . . . . 0.401 ' HA ' ' HD2' ' B' ' 381' ' ' PRO . 90.8 mt -51.51 113.37 3.93 Favored Pre-proline 0 C--N 1.332 -0.164 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.612 179.861 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 381' ' ' PRO . . . . . 0.537 ' HA ' ' HG2' ' A' ' 377' ' ' ARG . 16.0 Cg_endo -57.35 115.58 2.61 Favored 'Trans proline' 0 C--N 1.349 0.568 0 C-N-CA 122.312 2.008 . . . . 0.0 112.338 -179.726 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 382' ' ' ASP . . . . . . . . . . . . . 4.7 p-10 -136.91 136.7 38.86 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.878 179.85 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 383' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.05 0 CA-C-O 118.21 -0.9 . . . . 0.0 111.211 179.903 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 358' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 . . . . . 0 N--CA 1.486 1.335 0 CA-C-O 120.869 0.366 . . . . 0.0 110.878 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 359' ' ' PHE . . . . . . . . . . . . . 87.9 t80 -124.22 101.63 7.29 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.765 179.898 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 360' ' ' THR . . . . . 0.584 ' HB ' ' HD3' ' A' ' 361' ' ' PRO . 68.6 m -157.93 -49.69 0.01 OUTLIER Pre-proline 0 CA--C 1.534 0.35 0 CA-C-N 116.065 -0.516 . . . . 0.0 111.666 -179.86 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 361' ' ' PRO . . . . . 0.584 ' HD3' ' HB ' ' A' ' 360' ' ' THR . 31.5 Cg_exo -59.32 -50.06 9.35 Favored 'Trans proline' 0 C--N 1.353 0.794 0 C-N-CA 122.105 1.87 . . . . 0.0 112.286 179.837 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 362' ' ' MET . . . . . 0.482 ' HG2' HD12 ' B' ' 329' ' ' LEU . 0.6 OUTLIER -73.47 1.08 10.58 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.35 -179.705 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 363' ' ' ASP . . . . . . . . . . . . . 22.3 t70 -89.05 -5.91 57.53 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.933 0.397 . . . . 0.0 110.521 179.638 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 364' ' ' SER . . . . . . . . . . . . . 78.4 p -145.56 -5.22 0.65 Allowed 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.912 179.94 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 365' ' ' SER . . . . . . . . . . . . . 46.5 t -92.87 -67.7 0.84 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.785 179.958 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 366' ' ' ALA . . . . . . . . . . . . . . . -63.77 -23.26 67.29 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.911 179.866 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 367' ' ' VAL . . . . . . . . . . . . . 18.9 t -67.6 -21.27 27.28 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.788 179.891 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 368' ' ' TYR . . . . . . . . . . . . . 57.9 t80 -73.25 -48.99 30.26 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.977 -179.898 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 369' ' ' VAL . . . . . . . . . . . . . 14.6 m -70.11 -36.48 68.34 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.448 -179.782 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 370' ' ' LEU . . . . . 0.535 HD22 ' HA ' ' B' ' 307' ' ' ALA . 6.5 mp -69.35 -47.43 64.35 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.427 -0.352 . . . . 0.0 111.052 179.721 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 371' ' ' SER . . . . . 0.482 ' HB3' ' HB3' ' B' ' 303' ' ' GLU . 72.1 m -64.27 -38.84 92.48 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.294 -179.962 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 372' ' ' SER . . . . . . . . . . . . . 67.9 m -71.22 -61.33 1.81 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.475 -179.662 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 373' ' ' MET . . . . . 0.454 ' HB3' ' HD3' ' B' ' 381' ' ' PRO . 73.9 mtm -50.38 -41.06 51.3 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.626 -179.459 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 374' ' ' ALA . . . . . . . . . . . . . . . -73.01 -41.8 63.89 Favored 'General case' 0 C--N 1.331 -0.223 0 N-CA-C 112.008 0.373 . . . . 0.0 112.008 -179.426 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 375' ' ' ARG . . . . . 0.416 ' HB2' ' HG2' ' B' ' 303' ' ' GLU . 30.3 tpt180 -70.29 -23.08 62.8 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.692 0.282 . . . . 0.0 111.395 -179.55 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 376' ' ' GLN . . . . . . . . . . . . . 85.4 mm-40 -89.45 13.14 14.48 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.424 -0.353 . . . . 0.0 111.119 -179.768 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 377' ' ' ARG . . . . . . . . . . . . . 73.8 ttt180 -71.02 -65.77 0.7 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.889 -179.971 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 378' ' ' ARG . . . . . . . . . . . . . 40.5 ttm180 -154.06 -78.47 0.1 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.251 -0.432 . . . . 0.0 111.099 -179.738 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 379' ' ' ALA . . . . . . . . . . . . . . . -149.76 -26.88 0.26 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.101 -179.869 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 380' ' ' SER . . . . . . . . . . . . . 49.0 m . . . . . 0 C--O 1.248 1.011 0 CA-C-O 118.31 -0.852 . . . . 0.0 111.08 179.936 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' B' B ' 295' ' ' SER . . . . . . . . . . . . . 47.3 t . . . . . 0 N--CA 1.485 1.306 0 CA-C-O 120.852 0.358 . . . . 0.0 110.964 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' B' B ' 296' ' ' LEU . . . . . . . . . . . . . 85.9 mt -131.54 -21.23 2.54 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.901 -179.985 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 297' ' ' GLN . . . . . . . . . . . . . 81.9 mm-40 -74.09 159.05 33.16 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.898 -179.887 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 298' ' ' ASN . . . . . . . . . . . . . 3.5 p-10 -128.81 175.68 8.43 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.93 179.958 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 299' ' ' ASN . . . . . . . . . . . . . 27.3 t-20 -103.83 123.33 46.9 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.101 -179.907 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 300' ' ' GLN . . . . . . . . . . . . . 29.6 mm-40 -117.55 109.97 41.23 Favored Pre-proline 0 C--N 1.33 -0.27 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.813 179.973 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 301' ' ' PRO . . . . . . . . . . . . . 50.2 Cg_exo -53.44 159.53 6.12 Favored 'Trans proline' 0 C--N 1.351 0.662 0 C-N-CA 122.295 1.997 . . . . 0.0 112.159 179.789 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 302' ' ' VAL . . . . . . . . . . . . . 15.0 p -92.01 -24.27 5.48 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.178 -179.797 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 303' ' ' GLU . . . . . 0.482 ' HB3' ' HB3' ' A' ' 371' ' ' SER . 44.2 mt-10 -57.88 -78.77 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.974 -0.557 . . . . 0.0 111.647 -179.661 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 304' ' ' PHE . . . . . . . . . . . . . 64.7 m-85 -59.06 -31.55 68.97 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.898 -0.592 . . . . 0.0 111.914 -179.217 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 305' ' ' ASN . . . . . . . . . . . . . 26.9 t-20 -62.95 -71.4 0.16 Allowed 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.672 0.272 . . . . 0.0 111.57 -179.417 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 306' ' ' HIS . . . . . . . . . . . . . 4.3 t-160 -53.99 -41.1 67.55 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.36 -0.382 . . . . 0.0 111.509 -179.116 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 307' ' ' ALA . . . . . 0.535 ' HA ' HD22 ' A' ' 370' ' ' LEU . . . -60.72 -54.99 38.53 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.473 -0.33 . . . . 0.0 111.679 -179.564 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 308' ' ' ILE . . . . . . . . . . . . . 21.2 mm -57.09 -52.34 57.46 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.195 0 CA-C-N 116.662 -0.245 . . . . 0.0 111.407 -179.736 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 309' ' ' ASN . . . . . . . . . . . . . 28.5 m-80 -55.52 -34.65 64.85 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.473 -0.331 . . . . 0.0 111.211 -179.74 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 310' ' ' TYR . . . . . . . . . . . . . 80.6 t80 -66.5 -56.54 10.41 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.424 -0.353 . . . . 0.0 111.109 179.971 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 311' ' ' VAL . . . . . . . . . . . . . 61.5 t -56.14 -49.07 77.98 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.213 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.129 -179.832 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 312' ' ' ASN . . . . . . . . . . . . . 28.0 t-20 -61.99 -39.12 91.12 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.77 179.896 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 313' ' ' LYS . . . . . . . . . . . . . 42.9 tttp -55.12 -61.16 2.5 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.687 179.846 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 314' ' ' ILE . . . . . . . . . . . . . 98.2 mt -62.48 -28.07 44.0 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.077 -0.51 . . . . 0.0 111.177 -179.9 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 315' ' ' LYS . . . . . . . . . . . . . 1.6 tmmt? -67.21 -33.84 76.24 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.356 -0.383 . . . . 0.0 110.973 -179.851 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 316' ' ' ASN . . . . . . . . . . . . . 7.1 t30 -87.56 -50.45 6.51 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.454 -179.76 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 317' ' ' ARG . . . . . . . . . . . . . 29.3 mmm180 -57.75 -57.49 12.53 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.088 -179.728 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 318' ' ' PHE . . . . . . . . . . . . . 44.0 m-85 -88.41 39.54 0.91 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.944 -179.913 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 319' ' ' GLN . . . . . . . . . . . . . 9.0 tt0 -65.74 -18.04 65.05 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.594 179.815 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 320' ' ' GLY . . . . . . . . . . . . . . . -91.82 -9.62 62.39 Favored Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.845 -0.693 . . . . 0.0 112.547 -179.979 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 321' ' ' GLN . . . . . 0.565 ' N ' HE21 ' B' ' 321' ' ' GLN . 0.0 OUTLIER -112.42 88.06 10.37 Favored Pre-proline 0 C--N 1.33 -0.25 0 CA-C-O 120.582 0.23 . . . . 0.0 110.877 179.777 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' B' B ' 322' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_endo -77.35 -33.6 2.44 Favored 'Trans proline' 0 C--N 1.347 0.473 0 C-N-CA 122.537 2.158 . . . . 0.0 112.414 -179.976 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 323' ' ' ASP . . . . . . . . . . . . . 5.2 m-20 -65.46 -56.26 13.43 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.13 -0.487 . . . . 0.0 111.167 -179.761 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 324' ' ' ILE . . . . . . . . . . . . . 53.3 mt -59.28 -53.27 50.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.455 -179.713 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 325' ' ' TYR . . . . . . . . . . . . . 16.8 t80 -54.01 -47.07 71.89 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.886 -179.832 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 326' ' ' LYS . . . . . . . . . . . . . 61.7 tttm -60.09 -40.8 90.86 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.879 -179.953 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 327' ' ' ALA . . . . . . . . . . . . . . . -59.02 -53.02 63.14 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.157 -179.88 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 328' ' ' PHE . . . . . . . . . . . . . 84.0 t80 -54.66 -52.36 62.57 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.785 179.962 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 329' ' ' LEU . . . . . 0.482 HD12 ' HG2' ' A' ' 362' ' ' MET . 77.3 mt -55.09 -39.17 69.03 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.986 -179.891 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 330' ' ' GLU . . . . . . . . . . . . . 16.4 mm-40 -63.81 -39.47 94.31 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.782 179.884 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 331' ' ' ILE . . . . . . . . . . . . . 90.4 mt -61.36 -45.71 98.06 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.17 0 CA-C-N 116.31 -0.405 . . . . 0.0 110.402 179.278 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 332' ' ' LEU . . . . . . . . . . . . . 7.7 mp -64.74 -34.7 78.93 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.867 179.533 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 333' ' ' HIS . . . . . . . . . . . . . 59.7 t-80 -62.09 -49.35 76.27 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.994 0.426 . . . . 0.0 110.111 179.502 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 334' ' ' THR . . . . . . . . . . . . . 53.1 m -63.09 -39.37 94.5 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.306 179.404 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 335' ' ' TYR . . . . . . . . . . . . . 55.7 t80 -62.72 -32.74 73.91 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.822 -0.626 . . . . 0.0 110.097 179.356 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 336' ' ' GLN . . . . . . . . . . . . . 8.8 tt0 -70.43 -45.5 65.74 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.593 -0.731 . . . . 0.0 110.64 179.808 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 337' ' ' LYS . . . . . . . . . . . . . 41.4 ttmt -60.88 -40.5 93.24 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.055 179.976 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 338' ' ' GLU . . . . . . . . . . . . . 20.8 mm-40 -67.29 -49.07 65.7 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.447 -179.753 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 339' ' ' GLN . . . . . . . . . . . . . 15.8 mm100 -61.06 -47.36 86.72 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.527 -0.306 . . . . 0.0 111.211 -179.85 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 340' ' ' ARG . . . . . . . . . . . . . 82.7 mtp180 -58.7 -51.98 67.66 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.209 -179.866 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 341' ' ' ASN . . . . . . . . . . . . . 5.6 t30 -59.76 -37.93 80.41 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.063 -179.751 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 342' ' ' ALA . . . . . . . . . . . . . . . -65.39 -35.74 81.87 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.043 179.938 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 343' ' ' LYS . . . . . . . . . . . . . 60.1 tttm -71.83 -38.59 70.13 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.923 179.976 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 344' ' ' GLU . . . . . . . . . . . . . 46.7 mt-10 -73.08 -28.51 62.34 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.145 -179.885 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 345' ' ' ALA . . . . . . . . . . . . . . . -74.34 -22.04 59.42 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.146 -179.88 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 346' ' ' GLY . . . . . . . . . . . . . . . 60.04 61.29 7.32 Favored Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.822 -0.704 . . . . 0.0 112.537 -179.895 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 347' ' ' GLY . . . . . . . . . . . . . . . 74.0 -175.31 48.07 Favored Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.846 -0.692 . . . . 0.0 112.418 -179.828 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 348' ' ' ASN . . . . . . . . . . . . . 63.6 t30 61.25 11.31 3.5 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-O 120.848 0.356 . . . . 0.0 111.155 179.785 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 349' ' ' TYR . . . . . . . . . . . . . 66.6 t80 -124.92 143.63 50.76 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.33 -0.396 . . . . 0.0 110.88 -179.952 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 350' ' ' THR . . . . . . . . . . . . . 22.9 m -116.01 105.32 51.33 Favored Pre-proline 0 CA--C 1.532 0.253 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.25 -179.816 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 351' ' ' PRO . . . . . . . . . . . . . 31.7 Cg_exo -59.7 -179.93 0.23 Allowed 'Trans proline' 0 C--N 1.349 0.581 0 C-N-CA 122.482 2.122 . . . . 0.0 112.425 179.834 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 352' ' ' ALA . . . . . . . . . . . . . . . -105.33 -71.17 0.75 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.38 -179.83 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 353' ' ' LEU . . . . . . . . . . . . . 7.3 mp -85.05 126.65 33.74 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 121.048 0.451 . . . . 0.0 111.332 -179.779 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 354' ' ' THR . . . . . 0.465 ' H ' ' HB2' ' B' ' 357' ' ' GLU . 81.4 p -111.61 -175.76 2.78 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.738 -0.664 . . . . 0.0 110.564 179.43 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 355' ' ' GLU . . . . . . . . . . . . . 8.9 pt-20 -53.06 -44.9 67.83 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.894 0.378 . . . . 0.0 110.933 179.861 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 356' ' ' GLN . . . . . . . . . . . . . 35.9 tt0 -69.53 -34.57 74.44 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.045 -0.525 . . . . 0.0 111.212 -179.701 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 357' ' ' GLU . . . . . 0.465 ' HB2' ' H ' ' B' ' 354' ' ' THR . 4.8 tp10 -60.28 -55.66 30.99 Favored 'General case' 0 C--O 1.233 0.203 0 CA-C-O 120.752 0.311 . . . . 0.0 110.655 -179.849 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 358' ' ' VAL . . . . . 0.459 ' O ' HG21 ' B' ' 362' ' ' VAL . 69.9 t -60.92 -54.51 34.34 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.872 179.825 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 359' ' ' TYR . . . . . . . . . . . . . 1.2 t80 -52.05 -34.36 43.09 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.774 0.321 . . . . 0.0 110.911 -179.661 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 360' ' ' ALA . . . . . . . . . . . . . . . -66.94 -60.43 2.65 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.357 -179.913 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 361' ' ' GLN . . . . . . . . . . . . . 49.1 mt-30 -55.52 -41.51 73.24 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.992 -179.949 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 362' ' ' VAL . . . . . 0.459 HG21 ' O ' ' B' ' 358' ' ' VAL . 50.1 t -67.59 -35.37 72.8 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.545 179.703 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 363' ' ' ALA . . . . . . . . . . . . . . . -62.06 -40.92 97.42 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.464 179.562 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 364' ' ' ARG . . . . . . . . . . . . . 67.3 ttt180 -81.34 -22.61 38.33 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.886 -0.597 . . . . 0.0 110.444 179.544 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 365' ' ' LEU . . . . . . . . . . . . . 6.4 tp -64.08 -23.14 67.21 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.75 179.989 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 366' ' ' PHE . . . . . . . . . . . . . 84.2 m-85 -125.72 165.72 18.09 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.643 179.811 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 367' ' ' LYS . . . . . . . . . . . . . 63.3 mttp -128.38 -77.32 0.56 Allowed 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.352 -0.386 . . . . 0.0 111.016 -179.859 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 368' ' ' ASN . . . . . . . . . . . . . 38.5 m-80 -85.17 7.9 20.21 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.847 179.951 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 369' ' ' GLN . . . . . . . . . . . . . 14.7 mm100 -112.22 56.33 0.66 Allowed 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.065 -179.842 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 370' ' ' GLU . . . . . . . . . . . . . 6.3 tm-20 -69.0 -23.23 64.08 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.511 179.753 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 371' ' ' ASP . . . . . . . . . . . . . 13.1 m-20 -52.66 -32.64 43.26 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.866 179.949 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 372' ' ' LEU . . . . . . . . . . . . . 78.1 mt -73.53 -35.74 65.59 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.68 179.717 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 373' ' ' LEU . . . . . . . . . . . . . 48.8 mt -65.5 -38.59 90.15 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.441 179.75 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 374' ' ' SER . . . . . . . . . . . . . 87.7 p -70.48 -54.45 12.21 Favored 'General case' 0 C--O 1.234 0.256 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.608 179.559 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 375' ' ' GLU . . . . . . . . . . . . . 16.4 mm-40 -53.24 -39.65 63.98 Favored 'General case' 0 C--N 1.333 -0.144 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.292 179.451 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 376' ' ' PHE . . . . . . . . . . . . . 88.4 t80 -69.29 -36.44 77.04 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.042 -0.526 . . . . 0.0 109.795 179.087 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 377' ' ' GLY . . . . . . . . . . . . . . . -61.87 -31.0 76.79 Favored Glycine 0 N--CA 1.448 -0.512 0 C-N-CA 120.896 -0.669 . . . . 0.0 111.607 179.234 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 378' ' ' GLN . . . . . . . . . . . . . 23.4 mt-30 -58.51 -32.0 68.42 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.836 0.35 . . . . 0.0 110.287 179.252 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 379' ' ' PHE . . . . . . . . . . . . . 97.6 m-85 -75.62 -31.0 59.71 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.221 179.244 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 380' ' ' LEU . . . . . . . . . . . . . 5.7 tp -59.05 127.67 84.05 Favored Pre-proline 0 C--N 1.328 -0.364 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.654 -179.97 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 381' ' ' PRO . . . . . 0.454 ' HD3' ' HB3' ' A' ' 373' ' ' MET . 51.4 Cg_exo -52.58 162.55 2.28 Favored 'Trans proline' 0 C--N 1.348 0.514 0 C-N-CA 122.348 2.032 . . . . 0.0 112.322 -179.71 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 382' ' ' ASP . . . . . . . . . . . . . 12.2 m-20 -142.3 154.96 45.13 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.345 -0.388 . . . . 0.0 110.951 179.947 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 383' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.047 0 CA-C-O 118.198 -0.906 . . . . 0.0 111.267 179.856 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 358' ' ' ASP . . . . . . . . . . . . . 4.4 p30 . . . . . 0 N--CA 1.484 1.266 0 CA-C-O 120.815 0.34 . . . . 0.0 110.744 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 359' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -158.58 -141.38 0.09 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.592 -179.885 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 360' ' ' THR . . . . . . . . . . . . . 13.7 m 67.05 128.03 0.03 OUTLIER Pre-proline 0 CA--C 1.53 0.197 0 CA-C-N 116.504 -0.316 . . . . 0.0 111.182 -179.927 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 361' ' ' PRO . . . . . . . . . . . . . 60.0 Cg_endo -71.65 -160.69 0.09 OUTLIER 'Trans proline' 0 C--N 1.349 0.604 0 C-N-CA 122.338 2.025 . . . . 0.0 112.181 -179.913 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 362' ' ' MET . . . . . 0.605 ' HB2' HD22 ' B' ' 329' ' ' LEU . 12.2 tpt -57.69 -71.56 0.1 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.548 179.868 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 363' ' ' ASP . . . . . . . . . . . . . 29.5 t70 -180.0 68.69 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.89 -0.596 . . . . 0.0 110.305 179.895 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 364' ' ' SER . . . . . . . . . . . . . 55.8 m 56.34 21.12 5.16 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.678 -179.609 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 365' ' ' SER . . . . . . . . . . . . . 41.2 t -111.63 -61.18 1.74 Allowed 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 115.884 -0.598 . . . . 0.0 111.327 -179.657 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 366' ' ' ALA . . . . . . . . . . . . . . . -54.96 -43.29 73.32 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.811 -179.423 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 367' ' ' VAL . . . . . . . . . . . . . 20.8 m -65.35 -37.93 81.3 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 CA-C-N 116.465 -0.334 . . . . 0.0 111.558 -179.515 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 368' ' ' TYR . . . . . . . . . . . . . 80.4 t80 -68.75 -53.02 24.36 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.355 -0.384 . . . . 0.0 111.539 -179.422 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 369' ' ' VAL . . . . . 0.573 HG12 ' HB3' ' B' ' 332' ' ' LEU . 5.1 p -57.62 -50.2 78.12 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.203 0 CA-C-N 116.611 -0.268 . . . . 0.0 111.513 -179.58 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 370' ' ' LEU . . . . . 0.572 ' HB3' ' HB2' ' B' ' 307' ' ' ALA . 8.1 mp -63.55 -35.73 81.46 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.689 0.28 . . . . 0.0 111.22 -179.866 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 371' ' ' SER . . . . . 0.51 ' HA ' ' HB2' ' B' ' 303' ' ' GLU . 34.6 t -62.41 -61.78 2.21 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 120.828 0.347 . . . . 0.0 111.107 179.85 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 372' ' ' SER . . . . . . . . . . . . . 40.4 t -62.43 -25.6 68.05 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.283 -179.515 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 373' ' ' MET . . . . . . . . . . . . . 56.0 ttm -66.38 -52.14 49.91 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.318 -0.401 . . . . 0.0 111.492 -179.628 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 374' ' ' ALA . . . . . . . . . . . . . . . -88.06 -8.86 54.93 Favored 'General case' 0 C--N 1.33 -0.281 0 N-CA-C 112.419 0.526 . . . . 0.0 112.419 -179.051 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 375' ' ' ARG . . . . . . . . . . . . . 10.4 ttp180 -94.09 -30.14 14.82 Favored 'General case' 0 C--N 1.33 -0.268 0 C-N-CA 120.962 -0.295 . . . . 0.0 111.515 -179.855 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 376' ' ' GLN . . . . . . . . . . . . . 24.0 tp60 -62.53 -74.93 0.08 Allowed 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.615 0.245 . . . . 0.0 111.004 -179.837 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 377' ' ' ARG . . . . . . . . . . . . . 70.9 mtm180 61.35 108.87 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.159 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.264 179.873 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 378' ' ' ARG . . . . . . . . . . . . . 81.1 mtm180 57.47 94.56 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.1 179.758 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 379' ' ' ALA . . . . . . . . . . . . . . . -97.54 -174.23 2.86 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.215 179.983 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 380' ' ' SER . . . . . . . . . . . . . 46.4 t . . . . . 0 C--O 1.249 1.036 0 CA-C-O 118.223 -0.894 . . . . 0.0 110.838 179.967 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' B' B ' 295' ' ' SER . . . . . . . . . . . . . 53.0 m . . . . . 0 N--CA 1.486 1.362 0 CA-C-O 120.798 0.333 . . . . 0.0 110.849 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' B' B ' 296' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -101.81 117.68 35.36 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.908 179.991 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 297' ' ' GLN . . . . . 0.449 ' C ' HD21 ' B' ' 298' ' ' ASN . 54.4 tt0 -161.55 86.75 0.67 Allowed 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.852 179.872 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 298' ' ' ASN . . . . . 0.54 ' N ' HD21 ' B' ' 298' ' ' ASN . 0.9 OUTLIER -112.43 -42.26 3.71 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.738 179.892 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' B' B ' 299' ' ' ASN . . . . . . . . . . . . . 3.0 t-20 -135.64 131.58 35.96 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.725 -179.901 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 300' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -78.13 148.78 75.4 Favored Pre-proline 0 C--N 1.33 -0.263 0 CA-C-N 116.507 -0.315 . . . . 0.0 110.967 -179.68 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 301' ' ' PRO . . . . . . . . . . . . . 52.4 Cg_exo -55.66 176.9 0.14 Allowed 'Trans proline' 0 C--N 1.348 0.526 0 C-N-CA 122.63 2.22 . . . . 0.0 112.611 179.968 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 302' ' ' VAL . . . . . 0.549 HG21 ' H ' ' B' ' 303' ' ' GLU . 3.3 m -85.78 -60.35 2.27 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.541 -179.848 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 303' ' ' GLU . . . . . 0.549 ' H ' HG21 ' B' ' 302' ' ' VAL . 0.0 OUTLIER -59.67 -16.0 23.34 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.412 -0.358 . . . . 0.0 111.073 -179.791 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' B' B ' 304' ' ' PHE . . . . . . . . . . . . . 82.3 t80 -64.13 -75.64 0.08 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.519 179.786 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 305' ' ' ASN . . . . . . . . . . . . . 25.7 t-20 -61.49 -29.44 69.98 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.995 -179.92 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 306' ' ' HIS . . . . . . . . . . . . . 2.3 m-70 -62.36 -69.33 0.26 Allowed 'General case' 0 C--O 1.233 0.202 0 CA-C-N 116.41 -0.359 . . . . 0.0 111.494 179.875 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 307' ' ' ALA . . . . . 0.572 ' HB2' ' HB3' ' A' ' 370' ' ' LEU . . . -55.56 -42.31 74.5 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.961 -179.217 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 308' ' ' ILE . . . . . . . . . . . . . 97.7 mt -60.34 -63.83 0.7 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.181 0 CA-C-O 120.672 0.272 . . . . 0.0 111.214 -179.853 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 309' ' ' ASN . . . . . . . . . . . . . 2.9 m-20 -54.76 -24.76 23.93 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.321 -0.399 . . . . 0.0 110.704 179.942 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 310' ' ' TYR . . . . . 0.438 ' O ' ' HG3' ' B' ' 313' ' ' LYS . 19.2 t80 -65.7 -57.18 8.67 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.31 179.51 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 311' ' ' VAL . . . . . . . . . . . . . 59.5 t -60.24 -31.05 47.34 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.748 179.557 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 312' ' ' ASN . . . . . . . . . . . . . 51.1 t-20 -66.26 -57.06 8.37 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.97 -0.559 . . . . 0.0 111.58 -179.696 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 313' ' ' LYS . . . . . 0.438 ' HG3' ' O ' ' B' ' 310' ' ' TYR . 0.0 OUTLIER -61.79 -30.56 70.89 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.61 -0.268 . . . . 0.0 111.633 -179.187 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' B' B ' 314' ' ' ILE . . . . . . . . . . . . . 89.3 mt -76.78 -31.69 19.64 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.206 0 CA-C-O 120.878 0.371 . . . . 0.0 110.998 179.542 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 315' ' ' LYS . . . . . . . . . . . . . 23.8 ttmm -78.49 -26.47 46.02 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.298 -179.717 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 316' ' ' ASN . . . . . . . . . . . . . 26.6 t-20 -88.95 -46.08 9.17 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.423 -0.353 . . . . 0.0 111.427 -179.607 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 317' ' ' ARG . . . . . . . . . . . . . 32.0 tpt180 -65.17 -60.41 3.03 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.432 -0.349 . . . . 0.0 111.203 -179.742 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 318' ' ' PHE . . . . . . . . . . . . . 95.4 m-85 -80.94 25.68 0.45 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.242 -0.435 . . . . 0.0 111.27 -179.655 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 319' ' ' GLN . . . . . . . . . . . . . 56.7 tt0 -62.6 -23.88 67.28 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.658 179.775 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 320' ' ' GLY . . . . . . . . . . . . . . . -72.8 -46.08 31.58 Favored Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 120.886 -0.673 . . . . 0.0 112.689 -179.915 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 321' ' ' GLN . . . . . . . . . . . . . 8.4 tt0 -108.0 92.95 9.96 Favored Pre-proline 0 C--N 1.329 -0.301 0 CA-C-O 120.462 0.172 . . . . 0.0 110.828 179.964 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 322' ' ' PRO . . . . . . . . . . . . . 57.9 Cg_endo -71.34 -4.43 14.95 Favored 'Trans proline' 0 C--N 1.348 0.507 0 C-N-CA 122.433 2.089 . . . . 0.0 112.333 179.931 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 323' ' ' ASP . . . . . . . . . . . . . 16.2 t70 -68.97 -56.09 8.87 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.914 179.876 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 324' ' ' ILE . . . . . . . . . . . . . 63.8 mt -60.98 -46.25 96.97 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.938 179.887 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 325' ' ' TYR . . . . . . . . . . . . . 30.0 t80 -57.72 -47.88 81.15 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.989 -0.551 . . . . 0.0 110.887 179.936 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 326' ' ' LYS . . . . . . . . . . . . . 23.6 ttmm -57.3 -52.39 65.52 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.022 -179.977 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 327' ' ' ALA . . . . . . . . . . . . . . . -51.21 -47.13 62.37 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.053 179.964 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 328' ' ' PHE . . . . . . . . . . . . . 59.6 t80 -56.09 -48.71 75.61 Favored 'General case' 0 C--O 1.235 0.296 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.387 179.672 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 329' ' ' LEU . . . . . 0.605 HD22 ' HB2' ' A' ' 362' ' ' MET . 77.9 mt -58.29 -34.67 70.79 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.844 -0.617 . . . . 0.0 110.813 179.584 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 330' ' ' GLU . . . . . . . . . . . . . 48.1 mt-10 -68.71 -37.07 79.22 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.934 -0.575 . . . . 0.0 110.825 -179.903 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 331' ' ' ILE . . . . . . . . . . . . . 75.8 mt -65.71 -45.28 92.35 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.229 0 CA-C-N 116.38 -0.373 . . . . 0.0 110.697 179.769 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 332' ' ' LEU . . . . . 0.573 ' HB3' HG12 ' A' ' 369' ' ' VAL . 25.0 mt -69.0 -32.44 71.99 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.972 -179.972 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 333' ' ' HIS . . . . . . . . . . . . . 49.7 t60 -66.58 -53.79 30.58 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.927 0.394 . . . . 0.0 110.543 179.649 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 334' ' ' THR . . . . . . . . . . . . . 89.3 m -62.03 -35.86 79.84 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.825 179.751 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 335' ' ' TYR . . . . . . . . . . . . . 71.7 t80 -64.74 -41.77 95.68 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.511 179.727 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 336' ' ' GLN . . . . . . . . . . . . . 6.8 tt0 -65.9 -38.04 87.68 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.881 -0.599 . . . . 0.0 110.798 179.816 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 337' ' ' LYS . . . . . . . . . . . . . 38.1 ttpt -64.88 -50.3 67.11 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.284 -0.416 . . . . 0.0 111.115 179.941 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 338' ' ' GLU . . . . . . . . . . . . . 21.5 mm-40 -63.3 -35.4 80.25 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.978 -179.854 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 339' ' ' GLN . . . . . . . . . . . . . 28.5 tt0 -64.17 -53.03 55.76 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.669 179.873 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 340' ' ' ARG . . . . . . . . . . . . . 99.1 mtt180 -57.94 -47.07 83.98 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.856 179.819 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 341' ' ' ASN . . . . . . . . . . . . . 49.2 t-20 -56.4 -46.04 80.34 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.481 179.513 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 342' ' ' ALA . . . . . . . . . . . . . . . -66.38 -27.2 67.68 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.064 -0.517 . . . . 0.0 110.707 179.757 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 343' ' ' LYS . . . . . . . . . . . . . 22.3 tptm -71.87 -46.52 57.59 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.809 179.781 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 344' ' ' GLU . . . . . . . . . . . . . 10.9 mm-40 -67.31 -34.84 78.2 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.868 -0.605 . . . . 0.0 110.919 -179.935 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 345' ' ' ALA . . . . . . . . . . . . . . . -71.16 -19.51 62.41 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.132 179.872 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 346' ' ' GLY . . . . . . . . . . . . . . . 104.61 -64.39 0.33 Allowed Glycine 0 N--CA 1.45 -0.376 0 C-N-CA 120.875 -0.678 . . . . 0.0 112.501 -179.97 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 347' ' ' GLY . . . . . . . . . . . . . . . 175.09 -13.77 0.04 OUTLIER Glycine 0 N--CA 1.452 -0.238 0 C-N-CA 120.78 -0.724 . . . . 0.0 112.485 179.898 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 348' ' ' ASN . . . . . . . . . . . . . 32.7 m-80 -77.8 3.22 14.79 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.865 0.364 . . . . 0.0 110.774 -179.975 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 349' ' ' TYR . . . . . . . . . . . . . 83.3 t80 -88.28 152.77 21.72 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.92 -179.906 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 350' ' ' THR . . . . . . . . . . . . . 84.9 m -110.2 94.66 18.87 Favored Pre-proline 0 C--N 1.329 -0.299 0 CA-C-N 115.971 -0.558 . . . . 0.0 111.023 179.797 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 351' ' ' PRO . . . . . . . . . . . . . 40.5 Cg_exo -57.26 169.93 1.9 Allowed 'Trans proline' 0 C--N 1.35 0.632 0 C-N-CA 122.44 2.093 . . . . 0.0 112.053 179.745 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 352' ' ' ALA . . . . . . . . . . . . . . . -103.27 -51.5 3.22 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.319 -0.4 . . . . 0.0 111.496 -179.606 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 353' ' ' LEU . . . . . 0.43 ' HG ' ' HG2' ' B' ' 357' ' ' GLU . 7.0 mp -108.87 126.28 52.89 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 121.106 0.479 . . . . 0.0 111.521 -179.529 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 354' ' ' THR . . . . . . . . . . . . . 40.4 p -111.93 -176.85 3.03 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.703 -0.68 . . . . 0.0 110.382 179.264 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 355' ' ' GLU . . . . . . . . . . . . . 8.4 pt-20 -53.44 -41.71 66.36 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.112 0.482 . . . . 0.0 110.483 179.558 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 356' ' ' GLN . . . . . . . . . . . . . 53.5 tt0 -67.57 -39.36 84.9 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.698 -0.683 . . . . 0.0 110.964 179.904 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 357' ' ' GLU . . . . . 0.43 ' HG2' ' HG ' ' B' ' 353' ' ' LEU . 4.8 tp10 -60.43 -54.07 49.97 Favored 'General case' 0 C--N 1.333 -0.136 0 CA-C-O 120.826 0.346 . . . . 0.0 110.976 -179.895 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 358' ' ' VAL . . . . . 0.443 ' O ' HG23 ' B' ' 362' ' ' VAL . 75.6 t -59.36 -59.63 3.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.104 -179.988 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 359' ' ' TYR . . . . . . . . . . . . . 78.2 t80 -51.04 -31.9 19.94 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.565 -0.289 . . . . 0.0 111.326 -179.466 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 360' ' ' ALA . . . . . . . . . . . . . . . -67.39 -60.37 2.64 Favored 'General case' 0 C--O 1.234 0.285 0 CA-C-O 120.849 0.356 . . . . 0.0 110.987 179.688 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 361' ' ' GLN . . . . . . . . . . . . . 45.1 mt-30 -57.56 -35.25 70.1 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.682 179.948 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 362' ' ' VAL . . . . . 0.443 HG23 ' O ' ' B' ' 358' ' ' VAL . 67.7 t -70.71 -34.7 57.7 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.336 179.456 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 363' ' ' ALA . . . . . 0.573 ' HA ' HD23 ' B' ' 373' ' ' LEU . . . -64.01 -39.42 94.06 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.132 179.212 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 364' ' ' ARG . . . . . . . . . . . . . 80.8 mtp180 -82.37 -22.19 35.58 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.701 -0.682 . . . . 0.0 110.325 179.193 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 365' ' ' LEU . . . . . 0.429 ' HB2' ' HA ' ' B' ' 362' ' ' VAL . 2.4 tp -60.14 -26.98 66.7 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 115.936 -0.574 . . . . 0.0 110.335 179.883 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 366' ' ' PHE . . . . . . . . . . . . . 45.3 m-85 -122.68 -176.29 3.35 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.447 179.659 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 367' ' ' LYS . . . . . 0.572 ' HB2' ' HZ3' ' B' ' 367' ' ' LYS . 0.0 OUTLIER -141.0 -75.95 0.31 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.424 -0.353 . . . . 0.0 110.885 -179.98 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' B' B ' 368' ' ' ASN . . . . . . . . . . . . . 6.6 t30 -81.12 -16.77 52.07 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.528 179.893 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 369' ' ' GLN . . . . . 0.559 ' HB3' HD13 ' B' ' 372' ' ' LEU . 12.7 mm100 -83.69 84.78 7.42 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.866 -179.939 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 370' ' ' GLU . . . . . . . . . . . . . 38.2 tt0 -93.75 -17.88 22.68 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.874 0.369 . . . . 0.0 110.519 179.81 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 371' ' ' ASP . . . . . . . . . . . . . 25.2 t70 -56.81 -40.28 75.69 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.625 179.722 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 372' ' ' LEU . . . . . 0.559 HD13 ' HB3' ' B' ' 369' ' ' GLN . 6.5 mp -65.86 -44.81 84.32 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.597 179.483 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 373' ' ' LEU . . . . . 0.573 HD23 ' HA ' ' B' ' 363' ' ' ALA . 1.3 mp -57.44 -43.33 83.8 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.76 -0.655 . . . . 0.0 111.417 -179.718 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 374' ' ' SER . . . . . . . . . . . . . 80.9 p -69.2 -53.23 21.04 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.959 0.409 . . . . 0.0 110.518 179.818 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 375' ' ' GLU . . . . . . . . . . . . . 40.0 tt0 -59.54 -24.57 63.81 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.969 -0.559 . . . . 0.0 110.509 179.776 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 376' ' ' PHE . . . . . . . . . . . . . 76.0 t80 -83.34 -34.01 25.75 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.12 179.378 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 377' ' ' GLY . . . . . . . . . . . . . . . -67.72 -32.46 78.15 Favored Glycine 0 N--CA 1.449 -0.436 0 C-N-CA 120.812 -0.708 . . . . 0.0 111.867 179.463 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 378' ' ' GLN . . . . . . . . . . . . . 54.7 mt-30 -61.75 -24.63 66.95 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.819 0.342 . . . . 0.0 110.547 179.442 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 379' ' ' PHE . . . . . . . . . . . . . 22.3 m-85 -72.06 -40.36 68.37 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.541 179.663 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 380' ' ' LEU . . . . . . . . . . . . . 75.8 mt -49.64 144.13 9.95 Favored Pre-proline 0 C--N 1.33 -0.256 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.294 179.72 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 381' ' ' PRO . . . . . . . . . . . . . 72.5 Cg_exo -48.38 147.82 8.42 Favored 'Trans proline' 0 C--N 1.347 0.465 0 C-N-CA 122.418 2.079 . . . . 0.0 112.417 -179.462 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 382' ' ' ASP . . . . . . . . . . . . . 17.2 t70 -57.6 128.67 38.24 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.894 -179.97 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 383' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.103 0 CA-C-O 118.187 -0.911 . . . . 0.0 111.16 179.964 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 358' ' ' ASP . . . . . . . . . . . . . 16.0 m-20 . . . . . 0 N--CA 1.485 1.287 0 CA-C-O 120.864 0.364 . . . . 0.0 110.926 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 359' ' ' PHE . . . . . . . . . . . . . 32.0 p90 -160.56 135.94 7.98 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.921 -179.975 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 360' ' ' THR . . . . . 0.53 ' N ' ' HD3' ' A' ' 361' ' ' PRO . 80.3 p -140.88 50.96 2.21 Favored Pre-proline 0 CA--C 1.532 0.27 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.774 179.631 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 361' ' ' PRO . . . . . 0.53 ' HD3' ' N ' ' A' ' 360' ' ' THR . 73.1 Cg_endo -86.74 -75.8 0.0 OUTLIER 'Trans proline' 0 N--CA 1.457 -0.657 0 C-N-CA 122.306 2.004 . . . . 0.0 112.22 179.594 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 362' ' ' MET . . . . . 0.519 ' HG2' HD23 ' B' ' 329' ' ' LEU . 0.0 OUTLIER -118.66 11.46 12.79 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.641 179.56 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 363' ' ' ASP . . . . . . . . . . . . . 17.8 t70 -67.34 -11.19 57.01 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.659 179.867 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 364' ' ' SER . . . . . . . . . . . . . 80.3 p -135.74 21.17 3.31 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.635 179.816 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 365' ' ' SER . . . . . . . . . . . . . 48.1 t -131.87 -59.95 0.93 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.841 -179.928 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 366' ' ' ALA . . . . . . . . . . . . . . . -69.27 -18.54 63.87 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.973 179.922 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 367' ' ' VAL . . . . . . . . . . . . . 16.5 m -58.74 -35.62 56.54 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 116.03 -0.532 . . . . 0.0 111.115 179.913 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 368' ' ' TYR . . . . . . . . . . . . . 94.1 m-85 -64.65 -40.85 96.16 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.389 -0.368 . . . . 0.0 110.624 179.745 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 369' ' ' VAL . . . . . 0.57 HG22 ' HB2' ' B' ' 336' ' ' GLN . 21.9 t -63.99 -59.6 4.01 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-N 116.002 -0.544 . . . . 0.0 111.075 -179.897 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 370' ' ' LEU . . . . . 0.441 ' HB2' ' HB3' ' B' ' 307' ' ' ALA . 88.0 mt -57.81 -35.95 71.56 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.999 -0.546 . . . . 0.0 111.413 -179.604 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 371' ' ' SER . . . . . . . . . . . . . 47.3 t -61.83 -60.86 3.02 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.295 -0.412 . . . . 0.0 111.32 -179.558 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 372' ' ' SER . . . . . . . . . . . . . 79.4 p -56.93 -42.95 80.92 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.772 -179.368 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 373' ' ' MET . . . . . . . . . . . . . 90.2 mtp -57.29 -47.37 81.65 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.381 -0.372 . . . . 0.0 111.818 -179.355 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 374' ' ' ALA . . . . . 0.587 ' HB2' ' HB3' ' B' ' 303' ' ' GLU . . . -84.22 -17.93 38.21 Favored 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 112.044 0.387 . . . . 0.0 112.044 -179.341 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 375' ' ' ARG . . . . . . . . . . . . . 29.8 tpt180 -80.39 -26.49 38.52 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.769 0.319 . . . . 0.0 110.787 -179.881 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 376' ' ' GLN . . . . . . . . . . . . . 8.5 tt0 -62.62 -83.14 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.132 -179.748 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 377' ' ' ARG . . . . . . . . . . . . . 99.7 mtt180 60.19 -85.06 0.02 OUTLIER 'General case' 0 C--O 1.231 0.131 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.197 -179.732 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 378' ' ' ARG . . . . . . . . . . . . . 23.8 mmm180 -96.15 -167.61 1.61 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.452 -0.34 . . . . 0.0 110.943 -179.924 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 379' ' ' ALA . . . . . . . . . . . . . . . 60.11 25.17 14.46 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.067 179.883 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 380' ' ' SER . . . . . . . . . . . . . 71.1 p . . . . . 0 C--O 1.247 0.971 0 CA-C-O 118.235 -0.888 . . . . 0.0 110.941 179.966 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' B' B ' 295' ' ' SER . . . . . . . . . . . . . 83.5 p . . . . . 0 N--CA 1.486 1.339 0 CA-C-O 120.792 0.33 . . . . 0.0 110.895 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' B' B ' 296' ' ' LEU . . . . . . . . . . . . . 78.9 mt -134.69 114.37 12.63 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.756 179.986 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 297' ' ' GLN . . . . . . . . . . . . . 8.9 tt0 -82.59 -29.35 30.27 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.099 -0.5 . . . . 0.0 111.078 -179.771 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 298' ' ' ASN . . . . . . . . . . . . . 39.2 m-80 -121.45 124.4 44.39 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.341 -0.391 . . . . 0.0 111.064 179.971 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 299' ' ' ASN . . . . . . . . . . . . . 63.0 t30 -123.14 3.96 9.26 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.492 179.719 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 300' ' ' GLN . . . . . . . . . . . . . 6.1 tp-100 60.21 75.96 0.45 Allowed Pre-proline 0 C--N 1.331 -0.232 0 CA-C-N 115.879 -0.6 . . . . 0.0 111.174 179.842 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 301' ' ' PRO . . . . . 0.418 ' HB2' ' HB3' ' B' ' 304' ' ' PHE . 91.8 Cg_endo -86.49 96.65 0.52 Allowed 'Trans proline' 0 N--CA 1.458 -0.583 0 C-N-CA 122.459 2.106 . . . . 0.0 112.185 179.615 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 302' ' ' VAL . . . . . 0.55 HG21 ' H ' ' B' ' 303' ' ' GLU . 3.9 m -92.13 -59.77 2.8 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.353 -179.917 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 303' ' ' GLU . . . . . 0.587 ' HB3' ' HB2' ' A' ' 374' ' ' ALA . 3.3 mm-40 -69.12 -23.73 64.02 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.611 -179.749 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 304' ' ' PHE . . . . . 0.418 ' HB3' ' HB2' ' B' ' 301' ' ' PRO . 68.9 t80 -67.5 -54.48 19.76 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.188 179.433 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 305' ' ' ASN . . . . . . . . . . . . . 24.6 t-20 -60.29 -48.7 80.61 Favored 'General case' 0 C--O 1.233 0.228 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.471 179.408 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 306' ' ' HIS . . . . . . . . . . . . . 18.5 t-80 -54.72 -42.99 72.18 Favored 'General case' 0 C--O 1.234 0.264 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.24 179.494 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 307' ' ' ALA . . . . . 0.441 ' HB3' ' HB2' ' A' ' 370' ' ' LEU . . . -59.4 -44.98 92.72 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.635 179.548 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 308' ' ' ILE . . . . . 0.406 HG13 ' O ' ' B' ' 304' ' ' PHE . 85.3 mt -54.87 -51.96 47.56 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.215 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.593 179.358 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 309' ' ' ASN . . . . . . . . . . . . . 19.1 m120 -55.48 -38.17 68.78 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.731 179.788 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 310' ' ' TYR . . . . . 0.422 ' O ' ' HG3' ' B' ' 313' ' ' LYS . 15.0 t80 -61.49 -48.49 80.84 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.093 -0.503 . . . . 0.0 111.056 179.785 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 311' ' ' VAL . . . . . . . . . . . . . 40.0 t -62.57 -32.37 55.15 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.224 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.041 179.931 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 312' ' ' ASN . . . . . . . . . . . . . 31.4 t30 -67.68 -55.44 13.21 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.559 -179.652 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 313' ' ' LYS . . . . . 0.422 ' HG3' ' O ' ' B' ' 310' ' ' TYR . 0.0 OUTLIER -59.65 -36.94 77.4 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.382 -0.372 . . . . 0.0 111.784 -179.109 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' B' B ' 314' ' ' ILE . . . . . . . . . . . . . 68.3 mt -70.27 -40.1 77.53 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.162 0 C-N-CA 120.85 -0.34 . . . . 0.0 110.866 179.601 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 315' ' ' LYS . . . . . . . . . . . . . 12.9 ttpp -61.11 -47.29 86.95 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.324 -179.715 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 316' ' ' ASN . . . . . . . . . . . . . 57.6 t30 -67.51 -50.99 56.33 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.414 -179.329 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 317' ' ' ARG . . . . . . . . . . . . . 6.8 tpm_? -56.18 -61.26 2.52 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.186 -179.571 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 318' ' ' PHE . . . . . . . . . . . . . 66.9 m-85 -88.61 37.58 0.84 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.362 -179.686 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 319' ' ' GLN . . . . . . . . . . . . . 9.0 tt0 -68.66 -28.83 67.22 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.365 -0.38 . . . . 0.0 110.782 179.981 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 320' ' ' GLY . . . . . . . . . . . . . . . -82.84 -14.69 74.78 Favored Glycine 0 N--CA 1.452 -0.289 0 C-N-CA 120.847 -0.692 . . . . 0.0 112.451 179.856 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 321' ' ' GLN . . . . . . . . . . . . . 25.8 mp0 -110.21 88.53 7.29 Favored Pre-proline 0 C--N 1.33 -0.258 0 CA-C-O 120.451 0.167 . . . . 0.0 110.754 179.948 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 322' ' ' PRO . . . . . 0.429 ' HB2' ' HZ3' ' B' ' 326' ' ' LYS . 70.2 Cg_endo -73.89 -30.8 8.84 Favored 'Trans proline' 0 C--N 1.348 0.537 0 C-N-CA 122.374 2.049 . . . . 0.0 112.391 -179.996 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 323' ' ' ASP . . . . . . . . . . . . . 8.7 m-20 -63.7 -50.74 68.0 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.03 -179.884 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 324' ' ' ILE . . . . . . . . . . . . . 58.7 mt -67.03 -49.16 76.11 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.266 -179.798 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 325' ' ' TYR . . . . . . . . . . . . . 11.3 t80 -52.91 -50.79 63.23 Favored 'General case' 0 C--O 1.234 0.26 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.694 179.956 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 326' ' ' LYS . . . . . 0.463 ' O ' ' HG3' ' B' ' 330' ' ' GLU . 47.5 mttp -57.46 -53.95 52.31 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.774 179.423 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 327' ' ' ALA . . . . . 0.423 ' O ' HG13 ' B' ' 331' ' ' ILE . . . -46.31 -49.16 17.9 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.36 -179.935 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 328' ' ' PHE . . . . . . . . . . . . . 70.8 t80 -57.46 -55.26 37.09 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.747 179.844 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 329' ' ' LEU . . . . . 0.519 HD23 ' HG2' ' A' ' 362' ' ' MET . 62.1 mt -58.65 -26.97 64.31 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.723 179.853 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 330' ' ' GLU . . . . . 0.463 ' HG3' ' O ' ' B' ' 326' ' ' LYS . 45.5 mt-10 -73.91 -36.5 64.72 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.409 179.583 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 331' ' ' ILE . . . . . 0.423 HG13 ' O ' ' B' ' 327' ' ' ALA . 91.7 mt -64.44 -50.5 75.91 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.204 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.135 179.235 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 332' ' ' LEU . . . . . . . . . . . . . 8.9 mp -65.58 -34.33 77.99 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.58 179.411 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 333' ' ' HIS . . . . . . . . . . . . . 50.2 t-80 -59.96 -57.41 13.0 Favored 'General case' 0 C--O 1.233 0.216 0 CA-C-O 120.975 0.417 . . . . 0.0 110.312 179.155 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 334' ' ' THR . . . . . . . . . . . . . 58.0 m -59.18 -33.13 70.58 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.855 -0.611 . . . . 0.0 110.555 179.421 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 335' ' ' TYR . . . . . . . . . . . . . 59.3 t80 -59.84 -51.46 69.62 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.732 179.883 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 336' ' ' GLN . . . . . 0.57 ' HB2' HG22 ' A' ' 369' ' ' VAL . 0.0 OUTLIER -62.33 -40.51 96.58 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.605 179.87 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' B' B ' 337' ' ' LYS . . . . . . . . . . . . . 25.0 ttmm -57.19 -47.82 80.29 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.747 179.712 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 338' ' ' GLU . . . . . 0.407 ' HG3' ' HB3' ' B' ' 352' ' ' ALA . 22.5 mm-40 -64.92 -37.58 88.12 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.795 179.797 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 339' ' ' GLN . . . . . . . . . . . . . 59.1 tp60 -61.7 -41.58 97.78 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.465 179.751 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 340' ' ' ARG . . . . . . . . . . . . . 72.6 mtp180 -64.17 -52.9 56.77 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.335 179.462 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 341' ' ' ASN . . . . . . . . . . . . . 3.2 m-20 -56.93 -31.01 64.51 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.002 -0.544 . . . . 0.0 110.276 179.237 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 342' ' ' ALA . . . . . . . . . . . . . . . -70.19 -40.25 74.75 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.581 179.453 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 343' ' ' LYS . . . . . . . . . . . . . 59.7 tttm -70.78 -28.74 64.89 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.723 179.62 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 344' ' ' GLU . . . . . . . . . . . . . 20.1 mm-40 -79.27 -33.6 43.32 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.105 -179.776 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 345' ' ' ALA . . . . . . . . . . . . . . . -59.28 -28.69 66.99 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.379 -179.825 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 346' ' ' GLY . . . . . . . . . . . . . . . 87.45 -17.33 44.47 Favored Glycine 0 N--CA 1.452 -0.237 0 C-N-CA 120.715 -0.755 . . . . 0.0 112.544 179.991 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 347' ' ' GLY . . . . . . . . . . . . . . . 146.75 177.21 21.17 Favored Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.79 -0.719 . . . . 0.0 112.449 -179.964 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 348' ' ' ASN . . . . . . . . . . . . . 19.7 t-20 60.28 17.88 7.45 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.842 0.353 . . . . 0.0 110.771 179.947 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 349' ' ' TYR . . . . . . . . . . . . . 59.2 t80 -117.06 124.88 50.34 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.908 179.967 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 350' ' ' THR . . . . . . . . . . . . . 88.5 m -100.56 111.73 63.3 Favored Pre-proline 0 C--N 1.329 -0.306 0 CA-C-N 116.059 -0.518 . . . . 0.0 110.923 179.698 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 351' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_exo -52.06 147.88 25.53 Favored 'Trans proline' 0 C--N 1.351 0.669 0 C-N-CA 122.354 2.036 . . . . 0.0 112.258 179.815 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 352' ' ' ALA . . . . . 0.407 ' HB3' ' HG3' ' B' ' 338' ' ' GLU . . . -67.05 -55.03 16.07 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.389 -179.64 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 353' ' ' LEU . . . . . 0.499 HD22 ' HG2' ' B' ' 357' ' ' GLU . 22.0 mt -106.12 130.92 53.92 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.86 0.362 . . . . 0.0 111.192 -179.709 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 354' ' ' THR . . . . . . . . . . . . . 73.8 p -113.79 -170.63 1.74 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.905 179.69 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 355' ' ' GLU . . . . . . . . . . . . . 37.5 mt-10 -60.77 -44.3 96.94 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.97 179.912 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 356' ' ' GLN . . . . . . . . . . . . . 27.7 mm-40 -68.17 -38.18 81.8 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.028 -0.533 . . . . 0.0 111.335 -179.661 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 357' ' ' GLU . . . . . 0.499 ' HG2' HD22 ' B' ' 353' ' ' LEU . 8.8 tp10 -63.05 -54.37 39.17 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.535 -0.302 . . . . 0.0 111.018 -179.714 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 358' ' ' VAL . . . . . 0.41 ' O ' HG23 ' B' ' 362' ' ' VAL . 54.2 t -59.07 -54.05 39.48 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 116.449 -0.341 . . . . 0.0 110.909 179.817 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 359' ' ' TYR . . . . . . . . . . . . . 72.8 t80 -54.66 -32.86 59.87 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.467 -0.333 . . . . 0.0 110.885 -179.819 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 360' ' ' ALA . . . . . . . . . . . . . . . -68.03 -59.58 3.15 Favored 'General case' 0 C--N 1.332 -0.196 0 CA-C-N 116.376 -0.374 . . . . 0.0 111.012 179.701 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 361' ' ' GLN . . . . . . . . . . . . . 24.4 mt-30 -55.63 -35.21 65.64 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.81 179.822 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 362' ' ' VAL . . . . . 0.41 HG23 ' O ' ' B' ' 358' ' ' VAL . 98.3 t -74.65 -34.49 34.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.509 179.541 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 363' ' ' ALA . . . . . . . . . . . . . . . -64.21 -33.9 76.87 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.059 -0.518 . . . . 0.0 110.232 179.484 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 364' ' ' ARG . . . . . . . . . . . . . 71.1 ttt180 -90.54 -22.03 21.5 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.188 179.374 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 365' ' ' LEU . . . . . . . . . . . . . 18.4 tp -55.17 -31.67 61.55 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.708 -0.678 . . . . 0.0 110.716 179.775 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 366' ' ' PHE . . . . . . . . . . . . . 52.3 m-85 -111.81 179.99 3.86 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.954 -0.567 . . . . 0.0 110.496 179.85 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 367' ' ' LYS . . . . . . . . . . . . . 64.9 tttm -123.44 -75.63 0.6 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.701 0.286 . . . . 0.0 111.313 -179.722 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 368' ' ' ASN . . . . . . . . . . . . . 20.1 m120 -98.91 6.31 46.83 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.254 -179.669 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 369' ' ' GLN . . . . . 0.531 ' HB3' HD11 ' B' ' 372' ' ' LEU . 21.8 mp0 -100.26 87.8 3.53 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.38 -0.373 . . . . 0.0 110.754 179.842 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 370' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -93.56 -16.37 24.48 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.749 179.962 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 371' ' ' ASP . . . . . . . . . . . . . 17.4 t70 -55.96 -37.15 68.64 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.766 179.856 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 372' ' ' LEU . . . . . 0.531 HD11 ' HB3' ' B' ' 369' ' ' GLN . 6.4 mp -69.98 -36.7 75.38 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.307 179.945 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 373' ' ' LEU . . . . . . . . . . . . . 24.4 mt -65.1 -38.27 90.16 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.442 -0.344 . . . . 0.0 110.26 179.811 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 374' ' ' SER . . . . . . . . . . . . . 57.9 m -69.15 -53.31 20.82 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.477 179.359 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 375' ' ' GLU . . . . . . . . . . . . . 22.6 mm-40 -54.21 -44.39 71.58 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.305 179.638 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 376' ' ' PHE . . . . . . . . . . . . . 70.5 t80 -68.8 -33.81 74.47 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.063 179.232 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 377' ' ' GLY . . . . . . . . . . . . . . . -61.11 -34.84 89.52 Favored Glycine 0 N--CA 1.451 -0.364 0 C-N-CA 120.78 -0.724 . . . . 0.0 111.663 179.38 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 378' ' ' GLN . . . . . . . . . . . . . 27.1 mt-30 -62.14 -31.22 71.67 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.692 0.282 . . . . 0.0 110.596 179.427 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 379' ' ' PHE . . . . . . . . . . . . . 60.7 m-85 -66.42 -31.1 71.65 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.773 179.74 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 380' ' ' LEU . . . . . . . . . . . . . 97.6 mt -60.48 134.52 91.45 Favored Pre-proline 0 C--N 1.329 -0.322 0 CA-C-N 116.356 -0.384 . . . . 0.0 110.657 179.91 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 381' ' ' PRO . . . . . . . . . . . . . 79.6 Cg_exo -46.46 125.08 8.74 Favored 'Trans proline' 0 C--N 1.351 0.673 0 C-N-CA 122.638 2.226 . . . . 0.0 112.933 -179.641 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 382' ' ' ASP . . . . . . . . . . . . . 7.5 m-20 -78.25 175.32 10.32 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.972 -179.98 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 383' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.056 0 CA-C-O 118.286 -0.864 . . . . 0.0 111.095 179.969 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 358' ' ' ASP . . . . . . . . . . . . . 8.1 m-20 . . . . . 0 N--CA 1.485 1.325 0 CA-C-O 120.673 0.273 . . . . 0.0 110.889 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 359' ' ' PHE . . . . . . . . . . . . . 83.3 t80 -74.1 122.78 23.25 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.613 179.862 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 360' ' ' THR . . . . . . . . . . . . . 4.9 t -113.29 142.03 26.78 Favored Pre-proline 0 C--N 1.331 -0.235 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.249 -179.95 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 361' ' ' PRO . . . . . . . . . . . . . 96.9 Cg_endo -78.03 -156.71 0.07 OUTLIER 'Trans proline' 0 C--N 1.349 0.591 0 C-N-CA 122.479 2.12 . . . . 0.0 112.02 179.892 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 362' ' ' MET . . . . . 0.597 ' HG3' HD13 ' B' ' 329' ' ' LEU . 22.5 ttt -55.66 -71.51 0.09 Allowed 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.806 179.795 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 363' ' ' ASP . . . . . . . . . . . . . 17.7 t70 -174.44 -22.27 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.971 -0.558 . . . . 0.0 110.482 179.952 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 364' ' ' SER . . . . . . . . . . . . . 34.8 p -129.28 -74.53 0.56 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.832 -179.992 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 365' ' ' SER . . . . . . . . . . . . . 69.0 m -161.67 76.66 0.51 Allowed 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.426 -0.352 . . . . 0.0 111.335 -179.956 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 366' ' ' ALA . . . . . . . . . . . . . . . -78.48 -34.96 47.17 Favored 'General case' 0 C--O 1.234 0.259 0 CA-C-O 121.015 0.436 . . . . 0.0 110.7 179.472 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 367' ' ' VAL . . . . . . . . . . . . . 39.4 t -55.97 -34.47 38.05 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.214 0 CA-C-N 115.733 -0.667 . . . . 0.0 110.653 179.495 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 368' ' ' TYR . . . . . . . . . . . . . 62.6 t80 -65.66 -37.14 85.68 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.561 179.735 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 369' ' ' VAL . . . . . 0.457 HG22 ' HB2' ' B' ' 336' ' ' GLN . 11.1 t -65.89 -56.52 14.49 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.201 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.511 179.671 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 370' ' ' LEU . . . . . . . . . . . . . 95.0 mt -61.64 -31.74 71.85 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.817 -0.629 . . . . 0.0 110.939 179.958 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 371' ' ' SER . . . . . 0.418 ' HA ' ' HB2' ' B' ' 303' ' ' GLU . 40.7 t -64.76 -52.76 55.26 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.299 -0.409 . . . . 0.0 110.379 179.517 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 372' ' ' SER . . . . . . . . . . . . . 50.3 m -60.59 -32.01 71.13 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.33 179.517 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 373' ' ' MET . . . . . 0.5 ' HG3' ' HD3' ' B' ' 381' ' ' PRO . 54.9 tpp -61.35 -60.63 3.43 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.804 -0.635 . . . . 0.0 110.837 179.622 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 374' ' ' ALA . . . . . . . . . . . . . . . -60.12 -34.17 73.14 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.596 -179.641 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 375' ' ' ARG . . . . . . . . . . . . . 18.9 tpt180 -75.76 -22.43 56.48 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.47 -0.332 . . . . 0.0 110.882 -179.688 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 376' ' ' GLN . . . . . . . . . . . . . 6.2 tp-100 -70.75 -9.44 57.3 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 121.029 0.442 . . . . 0.0 110.431 179.566 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 377' ' ' ARG . . . . . 0.522 ' HG3' ' H ' ' B' ' 382' ' ' ASP . 61.3 ttp180 -60.47 -29.03 68.79 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.862 -0.608 . . . . 0.0 110.92 179.908 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 378' ' ' ARG . . . . . . . . . . . . . 35.2 mmt180 -72.4 -25.26 61.42 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.016 -179.856 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 379' ' ' ALA . . . . . . . . . . . . . . . 58.95 -171.68 0.11 Allowed 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.284 179.975 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 380' ' ' SER . . . . . . . . . . . . . 47.3 t . . . . . 0 C--O 1.25 1.103 0 CA-C-O 118.164 -0.922 . . . . 0.0 110.843 -179.985 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' B' B ' 295' ' ' SER . . . . . . . . . . . . . 47.0 t . . . . . 0 N--CA 1.484 1.267 0 CA-C-O 120.739 0.304 . . . . 0.0 110.845 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' B' B ' 296' ' ' LEU . . . . . . . . . . . . . 5.1 mp 57.48 96.61 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.201 -179.886 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 297' ' ' GLN . . . . . . . . . . . . . 7.5 tp60 59.65 98.65 0.02 OUTLIER 'General case' 0 C--N 1.333 -0.147 0 CA-C-N 116.027 -0.533 . . . . 0.0 111.015 -179.913 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 298' ' ' ASN . . . . . . . . . . . . . 2.9 p-10 -135.96 157.83 45.89 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.066 -179.884 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 299' ' ' ASN . . . . . . . . . . . . . 17.3 m120 -136.86 179.71 6.21 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.086 -0.507 . . . . 0.0 110.969 -179.915 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 300' ' ' GLN . . . . . 0.542 ' HB3' ' HD3' ' B' ' 301' ' ' PRO . 8.9 tt0 -95.46 -48.31 0.26 Allowed Pre-proline 0 CA--C 1.534 0.347 0 CA-C-N 116.277 -0.42 . . . . 0.0 111.646 -179.907 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 301' ' ' PRO . . . . . 0.542 ' HD3' ' HB3' ' B' ' 300' ' ' GLN . 6.2 Cg_exo -78.69 36.74 0.61 Allowed 'Trans proline' 0 C--N 1.352 0.763 0 C-N-CA 122.493 2.129 . . . . 0.0 112.149 179.913 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 302' ' ' VAL . . . . . . . . . . . . . 27.7 m -64.26 -40.63 89.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.596 -179.885 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 303' ' ' GLU . . . . . 0.418 ' HB2' ' HA ' ' A' ' 371' ' ' SER . 5.1 pt-20 -69.42 -46.98 65.51 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.533 -179.505 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 304' ' ' PHE . . . . . . . . . . . . . 89.4 m-85 -64.36 -49.2 72.59 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.776 0.322 . . . . 0.0 111.309 -179.629 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 305' ' ' ASN . . . . . . . . . . . . . 3.4 t-20 -59.89 -53.17 61.05 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.768 -179.322 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 306' ' ' HIS . . . . . . . . . . . . . 10.5 m-70 -60.7 -56.48 20.79 Favored 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 111.781 0.289 . . . . 0.0 111.781 -179.33 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 307' ' ' ALA . . . . . . . . . . . . . . . -51.9 -61.09 2.48 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 112.16 0.429 . . . . 0.0 112.16 -179.286 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 308' ' ' ILE . . . . . . . . . . . . . 46.9 mm -53.0 -56.68 6.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.504 -0.316 . . . . 0.0 111.841 -179.258 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 309' ' ' ASN . . . . . . . . . . . . . 2.7 t-20 -57.55 -29.22 64.22 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.483 -0.326 . . . . 0.0 111.482 -179.573 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 310' ' ' TYR . . . . . 0.524 ' HH ' ' HB2' ' B' ' 376' ' ' PHE . 11.8 t80 -69.34 -59.94 2.67 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.359 -0.382 . . . . 0.0 111.266 -179.451 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 311' ' ' VAL . . . . . . . . . . . . . 36.2 t -62.17 -26.79 41.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.289 -179.483 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 312' ' ' ASN . . . . . . . . . . . . . 6.8 t30 -72.46 -56.68 5.03 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.477 -179.537 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 313' ' ' LYS . . . . . 0.453 ' NZ ' ' HB2' ' B' ' 313' ' ' LYS . 0.0 OUTLIER -61.31 -32.34 72.2 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.38 -0.373 . . . . 0.0 111.551 -179.452 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' B' B ' 314' ' ' ILE . . . . . . . . . . . . . 98.0 mt -76.89 -39.72 30.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.563 -0.29 . . . . 0.0 111.639 -179.74 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 315' ' ' LYS . . . . . 0.408 ' HE3' ' HB3' ' B' ' 315' ' ' LYS . 1.4 tmmt? -65.64 -38.62 89.87 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.522 -0.308 . . . . 0.0 110.937 -179.853 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 316' ' ' ASN . . . . . . . . . . . . . 42.6 t30 -76.31 -51.8 11.24 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.518 -179.466 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 317' ' ' ARG . . . . . . . . . . . . . 19.0 tpp180 -60.27 -62.93 1.5 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.368 -179.6 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 318' ' ' PHE . . . . . . . . . . . . . 66.7 m-85 -86.38 38.43 0.78 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.209 -179.672 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 319' ' ' GLN . . . . . . . . . . . . . 58.1 tt0 -65.54 -29.61 70.26 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.9 179.933 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 320' ' ' GLY . . . . . . . . . . . . . . . -84.82 -2.31 88.62 Favored Glycine 0 N--CA 1.453 -0.23 0 C-N-CA 120.763 -0.732 . . . . 0.0 112.624 -179.732 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 321' ' ' GLN . . . . . . . . . . . . . 24.2 mp0 -109.98 91.73 11.56 Favored Pre-proline 0 C--N 1.33 -0.245 0 CA-C-O 120.502 0.191 . . . . 0.0 110.884 179.944 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 322' ' ' PRO . . . . . . . . . . . . . 97.6 Cg_endo -78.6 -29.03 3.9 Favored 'Trans proline' 0 C--N 1.348 0.511 0 C-N-CA 122.41 2.074 . . . . 0.0 112.59 -179.857 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 323' ' ' ASP . . . . . . . . . . . . . 25.4 t70 -69.15 -46.0 68.66 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.413 -0.358 . . . . 0.0 111.053 -179.829 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 324' ' ' ILE . . . . . . . . . . . . . 75.5 mt -70.87 -42.04 77.26 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.013 179.928 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 325' ' ' TYR . . . . . . . . . . . . . 46.0 t80 -62.96 -50.62 70.06 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.042 -0.527 . . . . 0.0 110.92 179.955 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 326' ' ' LYS . . . . . 0.63 ' HZ2' ' HB3' ' B' ' 326' ' ' LYS . 6.5 ttpm? -61.55 -49.94 74.66 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.101 -179.862 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 327' ' ' ALA . . . . . 0.41 ' HB1' HD12 ' B' ' 365' ' ' LEU . . . -54.33 -47.23 72.73 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.365 -0.379 . . . . 0.0 110.987 179.937 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 328' ' ' PHE . . . . . . . . . . . . . 53.0 t80 -56.5 -51.1 69.79 Favored 'General case' 0 C--O 1.236 0.357 0 CA-C-N 115.969 -0.56 . . . . 0.0 110.633 179.875 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 329' ' ' LEU . . . . . 0.597 HD13 ' HG3' ' A' ' 362' ' ' MET . 92.8 mt -56.45 -34.54 66.95 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.541 179.534 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 330' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -67.65 -37.89 83.04 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.711 179.652 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 331' ' ' ILE . . . . . . . . . . . . . 79.9 mt -62.96 -51.62 69.64 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.161 0 CA-C-N 116.407 -0.36 . . . . 0.0 110.427 179.552 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 332' ' ' LEU . . . . . . . . . . . . . 17.7 mt -66.87 -26.7 67.02 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.73 179.784 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 333' ' ' HIS . . . . . 0.532 ' HB2' ' HE3' ' A' ' 362' ' ' MET . 57.0 t-80 -64.12 -60.02 3.73 Favored 'General case' 0 C--O 1.234 0.256 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.199 179.481 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 334' ' ' THR . . . . . . . . . . . . . 80.0 m -58.94 -37.25 76.28 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.253 179.285 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 335' ' ' TYR . . . . . . . . . . . . . 56.4 t80 -60.59 -36.83 79.51 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.091 179.312 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 336' ' ' GLN . . . . . 0.457 ' HB2' HG22 ' A' ' 369' ' ' VAL . 24.7 tt0 -67.9 -51.44 47.99 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.781 179.771 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 337' ' ' LYS . . . . . . . . . . . . . 39.5 ttpt -51.8 -51.67 54.69 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.14 -179.824 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 338' ' ' GLU . . . . . 0.415 ' HG3' ' HB3' ' B' ' 352' ' ' ALA . 27.2 mm-40 -62.75 -39.86 95.45 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.986 -179.886 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 339' ' ' GLN . . . . . 0.441 ' HG3' ' HE2' ' B' ' 343' ' ' LYS . 8.7 tp-100 -61.45 -39.39 90.67 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 121.023 0.439 . . . . 0.0 110.652 179.718 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 340' ' ' ARG . . . . . . . . . . . . . 64.9 mtp180 -64.1 -54.16 38.37 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.589 179.757 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 341' ' ' ASN . . . . . . . . . . . . . 43.7 t-20 -56.7 -32.42 65.47 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.356 179.555 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 342' ' ' ALA . . . . . . . . . . . . . . . -66.3 -46.6 76.37 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.801 179.75 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 343' ' ' LYS . . . . . 0.441 ' HE2' ' HG3' ' B' ' 339' ' ' GLN . 68.5 mttm -66.53 -29.2 69.23 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.845 179.763 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 344' ' ' GLU . . . . . . . . . . . . . 23.9 mm-40 -69.99 -62.01 1.55 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.085 179.941 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 345' ' ' ALA . . . . . . . . . . . . . . . -57.87 -41.78 83.18 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.016 179.943 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 346' ' ' GLY . . . . . . . . . . . . . . . 47.62 38.05 14.35 Favored Glycine 0 C--N 1.331 0.271 0 C-N-CA 121.122 -0.561 . . . . 0.0 112.553 -179.965 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 347' ' ' GLY . . . . . . . . . . . . . . . -134.61 -117.97 1.8 Allowed Glycine 0 N--CA 1.451 -0.334 0 C-N-CA 120.594 -0.812 . . . . 0.0 112.955 -179.638 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 348' ' ' ASN . . . . . . . . . . . . . 18.1 m120 -92.91 2.39 56.81 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.677 0.275 . . . . 0.0 111.444 -179.466 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 349' ' ' TYR . . . . . . . . . . . . . 64.6 t80 -60.95 118.1 6.3 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.411 -0.358 . . . . 0.0 110.961 -179.774 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 350' ' ' THR . . . . . . . . . . . . . 49.1 m -101.76 117.15 62.3 Favored Pre-proline 0 C--N 1.329 -0.311 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.966 179.931 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 351' ' ' PRO . . . . . . . . . . . . . 32.3 Cg_exo -57.74 161.22 12.96 Favored 'Trans proline' 0 C--N 1.349 0.586 0 C-N-CA 122.317 2.011 . . . . 0.0 112.074 179.822 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 352' ' ' ALA . . . . . 0.415 ' HB3' ' HG3' ' B' ' 338' ' ' GLU . . . -86.2 -55.89 3.71 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.211 179.994 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 353' ' ' LEU . . . . . 0.463 HD21 ' HG2' ' B' ' 357' ' ' GLU . 13.6 mt -91.34 125.33 36.06 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.957 0.408 . . . . 0.0 111.241 -179.854 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 354' ' ' THR . . . . . . . . . . . . . 75.2 p -113.27 -173.44 2.26 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.855 -0.612 . . . . 0.0 110.593 179.668 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 355' ' ' GLU . . . . . . . . . . . . . 7.1 pt-20 -60.61 -41.42 94.75 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.951 0.405 . . . . 0.0 110.613 179.585 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 356' ' ' GLN . . . . . . . . . . . . . 14.5 mm100 -71.61 -38.87 70.79 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.866 -0.607 . . . . 0.0 111.225 -179.98 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 357' ' ' GLU . . . . . 0.463 ' HG2' HD21 ' B' ' 353' ' ' LEU . 9.2 tp10 -60.65 -53.85 52.4 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.518 -0.31 . . . . 0.0 110.851 -179.859 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 358' ' ' VAL . . . . . . . . . . . . . 59.8 t -62.52 -50.57 79.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.112 -179.936 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 359' ' ' TYR . . . . . . . . . . . . . 65.4 t80 -58.2 -31.01 66.91 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.63 0.253 . . . . 0.0 111.178 -179.719 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 360' ' ' ALA . . . . . . . . . . . . . . . -69.57 -59.7 2.8 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.369 -0.378 . . . . 0.0 111.044 -179.976 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 361' ' ' GLN . . . . . . . . . . . . . 21.7 mt-30 -56.78 -40.59 76.16 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.579 179.861 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 362' ' ' VAL . . . . . . . . . . . . . 74.0 t -66.82 -35.43 74.74 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 115.892 -0.595 . . . . 0.0 110.602 179.708 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 363' ' ' ALA . . . . . 0.51 ' HA ' HD23 ' B' ' 373' ' ' LEU . . . -62.39 -50.2 72.49 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.766 179.742 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 364' ' ' ARG . . . . . . . . . . . . . 57.5 mtp180 -73.54 -21.91 60.24 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.523 179.655 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 365' ' ' LEU . . . . . 0.41 HD12 ' HB1' ' B' ' 327' ' ' ALA . 13.9 tp -61.12 -60.89 3.06 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.86 179.978 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 366' ' ' PHE . . . . . 0.585 ' HB3' ' HB2' ' B' ' 369' ' ' GLN . 47.8 m-85 -74.34 -44.85 50.65 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.989 -179.927 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 367' ' ' LYS . . . . . 0.528 ' C ' ' H ' ' B' ' 369' ' ' GLN . 58.9 tttm 65.37 120.9 0.02 OUTLIER 'General case' 0 N--CA 1.465 0.277 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.706 179.359 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 368' ' ' ASN . . . . . . . . . . . . . 12.1 m120 70.3 -34.04 0.28 Allowed 'General case' 0 N--CA 1.463 0.19 0 CA-C-N 116.048 -0.523 . . . . 0.0 111.31 179.707 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 369' ' ' GLN . . . . . 0.585 ' HB2' ' HB3' ' B' ' 366' ' ' PHE . 15.3 mm100 -66.52 90.57 0.16 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.885 0.374 . . . . 0.0 110.532 179.635 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 370' ' ' GLU . . . . . . . . . . . . . 44.1 mt-10 -90.01 -6.21 55.83 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.996 -0.547 . . . . 0.0 111.012 -179.673 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 371' ' ' ASP . . . . . . . . . . . . . 21.4 t70 -67.09 -47.3 71.63 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.073 0.463 . . . . 0.0 110.258 179.494 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 372' ' ' LEU . . . . . . . . . . . . . 5.6 mp -72.82 -40.53 65.71 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.779 -0.646 . . . . 0.0 110.111 179.358 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 373' ' ' LEU . . . . . 0.51 HD23 ' HA ' ' B' ' 363' ' ' ALA . 1.1 mp -62.3 -36.1 81.09 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.605 -0.725 . . . . 0.0 110.61 179.647 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 374' ' ' SER . . . . . . . . . . . . . 92.0 p -71.02 -48.93 50.19 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.086 179.433 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 375' ' ' GLU . . . . . . . . . . . . . 43.3 mt-10 -62.97 -23.15 67.29 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.143 179.011 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 376' ' ' PHE . . . . . 0.524 ' HB2' ' HH ' ' B' ' 310' ' ' TYR . 76.9 t80 -85.13 -29.05 25.13 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.696 -0.684 . . . . 0.0 110.163 179.529 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 377' ' ' GLY . . . . . . . . . . . . . . . -71.45 -41.89 57.26 Favored Glycine 0 C--N 1.331 0.257 0 C-N-CA 120.836 -0.697 . . . . 0.0 112.006 179.465 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 378' ' ' GLN . . . . . . . . . . . . . 4.3 pt20 -70.69 -28.01 64.44 Favored 'General case' 0 C--N 1.331 -0.196 0 N-CA-C 109.224 -0.658 . . . . 0.0 109.224 179.22 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 379' ' ' PHE . . . . . . . . . . . . . 3.7 t80 -82.34 -22.03 35.74 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 114.926 -1.034 . . . . 0.0 109.744 179.05 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 380' ' ' LEU . . . . . . . . . . . . . 18.8 tp -67.79 141.78 95.16 Favored Pre-proline 0 C--N 1.329 -0.306 0 CA-C-N 115.307 -0.86 . . . . 0.0 110.333 179.483 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 381' ' ' PRO . . . . . 0.5 ' HD3' ' HG3' ' A' ' 373' ' ' MET . 74.0 Cg_exo -48.26 149.34 6.44 Favored 'Trans proline' 0 C--N 1.35 0.637 0 C-N-CA 122.187 1.925 . . . . 0.0 112.115 179.911 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 382' ' ' ASP . . . . . 0.522 ' H ' ' HG3' ' A' ' 377' ' ' ARG . 15.6 t70 -82.84 137.99 34.1 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.893 -179.898 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 383' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 1.001 0 CA-C-O 118.248 -0.882 . . . . 0.0 111.069 179.963 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 358' ' ' ASP . . . . . . . . . . . . . 20.7 t70 . . . . . 0 N--CA 1.486 1.325 0 CA-C-O 120.799 0.333 . . . . 0.0 111.065 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 359' ' ' PHE . . . . . . . . . . . . . 71.9 t80 -110.63 142.2 42.81 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.042 -179.801 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 360' ' ' THR . . . . . 0.553 ' H ' ' HD2' ' A' ' 361' ' ' PRO . 62.6 m -155.53 -53.68 0.02 OUTLIER Pre-proline 0 CA--C 1.534 0.341 0 CA-C-N 116.048 -0.524 . . . . 0.0 111.431 179.716 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 361' ' ' PRO . . . . . 0.553 ' HD2' ' H ' ' A' ' 360' ' ' THR . 90.0 Cg_endo -80.7 126.04 5.77 Favored 'Trans proline' 0 C--N 1.353 0.767 0 C-N-CA 122.06 1.84 . . . . 0.0 112.418 179.878 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 362' ' ' MET . . . . . . . . . . . . . 18.3 ttt -68.11 -71.49 0.21 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.758 179.962 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 363' ' ' ASP . . . . . . . . . . . . . 15.6 t70 -173.97 -39.49 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.304 -179.804 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 364' ' ' SER . . . . . . . . . . . . . 54.3 m -106.8 -73.47 0.69 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.792 -0.64 . . . . 0.0 110.463 179.665 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 365' ' ' SER . . . . . 0.413 ' HB2' ' HB2' ' A' ' 368' ' ' TYR . 80.3 p -173.36 77.26 0.04 OUTLIER 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.141 179.737 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 366' ' ' ALA . . . . . . . . . . . . . . . -78.5 -41.26 32.89 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.81 179.646 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 367' ' ' VAL . . . . . . . . . . . . . 23.5 t -65.58 -20.76 27.98 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.697 179.747 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 368' ' ' TYR . . . . . 0.413 ' HB2' ' HB2' ' A' ' 365' ' ' SER . 25.7 t80 -71.01 -49.64 42.88 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.017 -179.808 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 369' ' ' VAL . . . . . 0.462 HG23 ' HE2' ' A' ' 373' ' ' MET . 6.5 p -68.46 -44.46 83.2 Favored 'Isoleucine or valine' 0 C--O 1.233 0.217 0 CA-C-N 116.433 -0.349 . . . . 0.0 110.881 179.908 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 370' ' ' LEU . . . . . . . . . . . . . 90.4 mt -60.43 -42.34 95.88 Favored 'General case' 0 C--O 1.233 0.236 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.887 179.807 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 371' ' ' SER . . . . . . . . . . . . . 87.6 p -72.64 -34.94 67.63 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.772 179.863 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 372' ' ' SER . . . . . 0.412 ' HG ' HE22 ' B' ' 339' ' ' GLN . 45.8 t -61.14 -42.81 99.23 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.341 -0.39 . . . . 0.0 111.185 -179.679 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 373' ' ' MET . . . . . 0.462 ' HE2' HG23 ' A' ' 369' ' ' VAL . 22.4 ptp -76.71 -38.4 54.41 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.432 -0.349 . . . . 0.0 111.722 -179.419 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 374' ' ' ALA . . . . . 0.436 ' HB1' ' OE1' ' B' ' 303' ' ' GLU . . . -78.62 -13.15 59.97 Favored 'General case' 0 C--N 1.33 -0.25 0 N-CA-C 112.015 0.376 . . . . 0.0 112.015 -179.421 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 375' ' ' ARG . . . . . . . . . . . . . 22.3 ttp180 -100.5 -32.62 10.7 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.823 0.345 . . . . 0.0 110.768 179.635 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 376' ' ' GLN . . . . . . . . . . . . . 6.5 tp-100 -58.69 -24.84 62.1 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.121 -0.491 . . . . 0.0 111.181 -179.94 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 377' ' ' ARG . . . . . 0.626 ' HB3' ' HA ' ' B' ' 381' ' ' PRO . 16.5 ptm180 -62.04 -34.39 76.14 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.885 0.374 . . . . 0.0 110.695 -179.955 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 378' ' ' ARG . . . . . . . . . . . . . 20.5 tpp180 -156.75 107.19 2.33 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.641 179.862 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 379' ' ' ALA . . . . . . . . . . . . . . . -130.5 130.6 44.4 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.082 -0.508 . . . . 0.0 111.129 -179.835 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 380' ' ' SER . . . . . . . . . . . . . 50.9 m . . . . . 0 C--O 1.248 1.023 0 CA-C-O 118.256 -0.878 . . . . 0.0 110.922 179.866 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' B' B ' 295' ' ' SER . . . . . . . . . . . . . 44.8 t . . . . . 0 N--CA 1.486 1.334 0 CA-C-O 120.798 0.332 . . . . 0.0 110.943 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' B' B ' 296' ' ' LEU . . . . . . . . . . . . . 61.7 tp -155.37 -30.41 0.1 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.977 -179.806 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 297' ' ' GLN . . . . . . . . . . . . . 48.2 tt0 -73.41 -36.42 65.99 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.904 179.951 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 298' ' ' ASN . . . . . . . . . . . . . 38.3 m-80 -130.98 101.87 5.8 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.964 -179.976 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 299' ' ' ASN . . . . . . . . . . . . . 2.9 t-20 -166.02 -74.33 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.75 179.874 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 300' ' ' GLN . . . . . . . . . . . . . 3.5 pt20 -169.71 69.45 0.63 Allowed Pre-proline 0 C--N 1.331 -0.215 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.363 179.839 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 301' ' ' PRO . . . . . . . . . . . . . 63.5 Cg_endo -73.35 116.86 4.85 Favored 'Trans proline' 0 C--N 1.346 0.409 0 C-N-CA 122.451 2.101 . . . . 0.0 112.07 179.718 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 302' ' ' VAL . . . . . . . . . . . . . 15.0 p -88.07 -39.52 12.85 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.232 0 CA-C-N 116.323 -0.398 . . . . 0.0 111.293 -179.727 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 303' ' ' GLU . . . . . 0.436 ' OE1' ' HB1' ' A' ' 374' ' ' ALA . 55.3 mm-40 -65.04 -51.13 63.27 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.169 -0.468 . . . . 0.0 111.402 -179.465 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 304' ' ' PHE . . . . . . . . . . . . . 85.6 m-85 -59.99 -57.39 13.07 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.329 -179.815 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 305' ' ' ASN . . . . . . . . . . . . . 6.6 t30 -51.07 -55.16 19.0 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.874 -179.279 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 306' ' ' HIS . . . . . . . . . . . . . 12.2 m-70 -61.24 -64.1 1.07 Allowed 'General case' 0 C--N 1.33 -0.267 0 N-CA-C 112.357 0.503 . . . . 0.0 112.357 -178.947 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 307' ' ' ALA . . . . . . . . . . . . . . . -53.08 -57.13 11.47 Favored 'General case' 0 N--CA 1.464 0.245 0 N-CA-C 112.468 0.544 . . . . 0.0 112.468 -178.736 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 308' ' ' ILE . . . . . 0.499 HG23 HG21 ' A' ' 360' ' ' THR . 87.4 mt -53.58 -53.57 24.5 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 N-CA-C 111.985 0.365 . . . . 0.0 111.985 -179.298 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 309' ' ' ASN . . . . . . . . . . . . . 3.0 t-20 -59.46 -30.44 68.52 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.811 0.338 . . . . 0.0 110.951 -179.706 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 310' ' ' TYR . . . . . . . . . . . . . 74.8 t80 -66.99 -51.57 53.43 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.021 -179.78 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 311' ' ' VAL . . . . . . . . . . . . . 46.2 t -61.19 -52.14 64.89 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.224 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.065 -179.832 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 312' ' ' ASN . . . . . . . . . . . . . 27.6 t-20 -59.37 -34.3 72.24 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.339 -0.392 . . . . 0.0 110.976 -179.951 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 313' ' ' LYS . . . . . . . . . . . . . 39.8 tttp -62.41 -63.14 1.32 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.978 179.957 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 314' ' ' ILE . . . . . . . . . . . . . 97.9 mt -60.28 -27.79 40.35 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.352 -179.792 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 315' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -66.5 -46.34 76.6 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.413 -0.358 . . . . 0.0 110.741 -179.969 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 316' ' ' ASN . . . . . . . . . . . . . 6.7 t30 -72.48 -47.45 48.58 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.264 -179.732 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 317' ' ' ARG . . . . . . . . . . . . . 1.4 tmt_? -62.8 -63.9 1.08 Allowed 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.031 -179.836 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 318' ' ' PHE . . . . . . . . . . . . . 87.0 m-85 -85.11 40.93 0.85 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.121 -0.49 . . . . 0.0 111.043 -179.991 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 319' ' ' GLN . . . . . . . . . . . . . 35.0 tt0 -70.07 -22.61 63.04 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.885 -179.981 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 320' ' ' GLY . . . . . . . . . . . . . . . -86.59 -13.61 67.23 Favored Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.833 -0.699 . . . . 0.0 112.726 -179.793 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 321' ' ' GLN . . . . . . . . . . . . . 22.3 mp0 -110.28 93.41 15.69 Favored Pre-proline 0 C--N 1.329 -0.324 0 CA-C-O 120.416 0.151 . . . . 0.0 110.921 -179.928 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 322' ' ' PRO . . . . . . . . . . . . . 92.1 Cg_endo -79.73 -22.86 7.41 Favored 'Trans proline' 0 C--N 1.348 0.517 0 C-N-CA 122.548 2.165 . . . . 0.0 112.38 179.833 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 323' ' ' ASP . . . . . . . . . . . . . 6.0 m-20 -71.09 -48.01 54.89 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.29 -179.569 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 324' ' ' ILE . . . . . . . . . . . . . 64.0 mt -70.23 -43.07 78.98 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.415 -0.357 . . . . 0.0 111.251 -179.881 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 325' ' ' TYR . . . . . . . . . . . . . 30.8 t80 -62.1 -48.14 81.47 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 120.902 0.382 . . . . 0.0 110.75 179.984 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 326' ' ' LYS . . . . . . . . . . . . . 87.3 tttt -62.02 -50.11 73.35 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.824 179.896 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 327' ' ' ALA . . . . . 0.404 ' O ' ' HB2' ' B' ' 330' ' ' GLU . . . -54.45 -43.55 71.74 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.185 179.946 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 328' ' ' PHE . . . . . . . . . . . . . 84.5 t80 -59.39 -57.03 14.79 Favored 'General case' 0 C--O 1.235 0.331 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.569 179.927 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 329' ' ' LEU . . . . . . . . . . . . . 91.3 mt -56.85 -28.52 61.78 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.428 179.658 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 330' ' ' GLU . . . . . 0.404 ' HB2' ' O ' ' B' ' 327' ' ' ALA . 22.5 mm-40 -66.52 -44.47 82.37 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.175 179.217 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 331' ' ' ILE . . . . . . . . . . . . . 71.1 mt -61.33 -39.8 83.94 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.12 0 N-CA-C 109.78 -0.452 . . . . 0.0 109.78 178.828 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 332' ' ' LEU . . . . . . . . . . . . . 1.1 mm? -66.61 -36.22 82.07 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.533 -0.758 . . . . 0.0 110.646 179.5 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 333' ' ' HIS . . . . . . . . . . . . . 47.2 t-80 -67.52 -56.44 9.51 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.671 179.731 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 334' ' ' THR . . . . . . . . . . . . . 35.0 m -59.36 -37.78 78.74 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.805 179.697 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 335' ' ' TYR . . . . . . . . . . . . . 32.2 t80 -60.35 -48.34 82.17 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.473 179.554 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 336' ' ' GLN . . . . . 0.452 ' HB2' ' HB ' ' A' ' 369' ' ' VAL . 54.8 tp60 -60.94 -40.22 92.47 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.477 179.535 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 337' ' ' LYS . . . . . 0.566 ' HB3' ' HZ1' ' B' ' 337' ' ' LYS . 4.7 ttpm? -60.11 -47.7 84.8 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.643 179.683 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 338' ' ' GLU . . . . . . . . . . . . . 61.6 mm-40 -58.78 -42.02 88.03 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.627 179.572 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 339' ' ' GLN . . . . . 0.49 ' HG3' ' HZ3' ' B' ' 343' ' ' LYS . 29.1 tt0 -61.94 -44.79 96.03 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.707 179.844 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 340' ' ' ARG . . . . . . . . . . . . . 99.7 mtt180 -57.05 -53.78 54.25 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.673 179.825 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 341' ' ' ASN . . . . . . . . . . . . . 45.5 t-20 -55.52 -39.89 71.1 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.557 179.86 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 342' ' ' ALA . . . . . . . . . . . . . . . -60.23 -41.99 94.3 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.843 179.863 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 343' ' ' LYS . . . . . 0.49 ' HZ3' ' HG3' ' B' ' 339' ' ' GLN . 14.5 mptt -74.7 -27.19 60.29 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.847 179.706 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 344' ' ' GLU . . . . . . . . . . . . . 20.2 mm-40 -67.94 -40.05 83.37 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.69 179.556 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 345' ' ' ALA . . . . . . . . . . . . . . . -72.38 -10.03 59.27 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.008 179.748 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 346' ' ' GLY . . . . . . . . . . . . . . . 69.78 32.7 70.47 Favored Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.878 -0.677 . . . . 0.0 112.547 179.947 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 347' ' ' GLY . . . . . . . . . . . . . . . 101.88 -176.98 26.4 Favored Glycine 0 N--CA 1.452 -0.249 0 C-N-CA 120.751 -0.737 . . . . 0.0 112.499 179.997 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 348' ' ' ASN . . . . . . . . . . . . . 56.2 t30 64.39 3.01 1.7 Allowed 'General case' 0 N--CA 1.464 0.238 0 CA-C-O 120.701 0.286 . . . . 0.0 111.335 179.87 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 349' ' ' TYR . . . . . . . . . . . . . 61.8 t80 -103.1 147.71 26.64 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.769 0.319 . . . . 0.0 110.692 179.896 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 350' ' ' THR . . . . . . . . . . . . . 30.5 m -115.38 101.99 54.41 Favored Pre-proline 0 C--N 1.33 -0.279 0 CA-C-N 116.233 -0.439 . . . . 0.0 111.121 -179.919 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 351' ' ' PRO . . . . . . . . . . . . . 58.7 Cg_exo -52.67 141.6 53.07 Favored 'Trans proline' 0 C--N 1.347 0.486 0 C-N-CA 122.52 2.147 . . . . 0.0 112.297 179.75 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 352' ' ' ALA . . . . . . . . . . . . . . . -68.12 -23.17 64.87 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.894 179.848 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 353' ' ' LEU . . . . . 0.486 ' HG ' ' HG2' ' B' ' 357' ' ' GLU . 4.7 mp -131.93 124.11 28.77 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.119 -0.492 . . . . 0.0 111.225 179.848 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 354' ' ' THR . . . . . . . . . . . . . 75.6 p -114.76 -170.73 1.8 Allowed 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.716 -0.675 . . . . 0.0 109.594 178.66 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 355' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 -57.87 -35.98 71.71 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.093 0.473 . . . . 0.0 110.063 179.271 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 356' ' ' GLN . . . . . . . . . . . . . 5.9 tp-100 -73.1 -42.6 62.78 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 115.719 -0.673 . . . . 0.0 111.127 179.97 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 357' ' ' GLU . . . . . 0.486 ' HG2' ' HG ' ' B' ' 353' ' ' LEU . 9.4 tp10 -58.97 -56.14 26.14 Favored 'General case' 0 C--O 1.232 0.176 0 CA-C-N 116.479 -0.328 . . . . 0.0 110.893 -179.779 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 358' ' ' VAL . . . . . . . . . . . . . 47.1 t -59.61 -55.1 26.11 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.115 179.912 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 359' ' ' TYR . . . . . . . . . . . . . 67.2 t80 -54.92 -29.71 56.86 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.566 -0.288 . . . . 0.0 111.457 -179.551 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 360' ' ' ALA . . . . . . . . . . . . . . . -70.38 -60.83 2.04 Favored 'General case' 0 C--O 1.234 0.281 0 CA-C-N 116.439 -0.346 . . . . 0.0 111.494 -179.745 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 361' ' ' GLN . . . . . . . . . . . . . 97.6 mt-30 -55.79 -40.48 72.73 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.925 0.393 . . . . 0.0 110.792 -179.892 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 362' ' ' VAL . . . . . . . . . . . . . 91.2 t -66.38 -38.25 81.39 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.71 179.616 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 363' ' ' ALA . . . . . . . . . . . . . . . -59.42 -42.73 92.53 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 116.257 -0.428 . . . . 0.0 110.383 179.296 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 364' ' ' ARG . . . . . . . . . . . . . 36.3 ttm180 -77.78 -21.99 50.82 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.834 -0.621 . . . . 0.0 110.367 179.264 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 365' ' ' LEU . . . . . . . . . . . . . 10.4 tp -64.26 -29.81 70.89 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.75 -0.659 . . . . 0.0 110.919 179.909 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 366' ' ' PHE . . . . . 0.632 ' HB3' ' HB2' ' B' ' 369' ' ' GLN . 69.4 m-85 -118.32 -59.41 1.89 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.174 -179.824 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 367' ' ' LYS . . . . . . . . . . . . . 39.7 ttpt 68.55 -80.53 0.04 OUTLIER 'General case' 0 N--CA 1.463 0.184 0 CA-C-N 115.948 -0.569 . . . . 0.0 111.595 179.79 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 368' ' ' ASN . . . . . . . . . . . . . 31.2 p-10 -58.47 -17.63 22.44 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.223 -179.477 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 369' ' ' GLN . . . . . 0.632 ' HB2' ' HB3' ' B' ' 366' ' ' PHE . 15.3 mm100 -109.58 97.54 7.08 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.964 -179.999 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 370' ' ' GLU . . . . . . . . . . . . . 44.9 mt-10 -93.91 -11.53 30.81 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.057 179.714 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 371' ' ' ASP . . . . . . . . . . . . . 13.6 m-20 -57.93 -64.12 1.02 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.935 -179.758 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 372' ' ' LEU . . . . . 0.454 HD13 ' H ' ' B' ' 373' ' ' LEU . 0.4 OUTLIER -61.98 -22.57 65.77 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.965 179.824 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' B' B ' 373' ' ' LEU . . . . . 0.454 ' H ' HD13 ' B' ' 372' ' ' LEU . 4.3 tp -68.76 -43.15 76.42 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.3 179.918 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 374' ' ' SER . . . . . . . . . . . . . 53.1 m -69.12 -48.25 62.97 Favored 'General case' 0 C--O 1.236 0.373 0 N-CA-C 109.676 -0.491 . . . . 0.0 109.676 179.053 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 375' ' ' GLU . . . . . . . . . . . . . 42.0 tt0 -56.47 -32.53 65.07 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 115.747 -0.66 . . . . 0.0 109.701 178.989 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 376' ' ' PHE . . . . . . . . . . . . . 93.3 t80 -78.12 -33.44 50.54 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 115.804 -0.635 . . . . 0.0 110.066 179.014 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 377' ' ' GLY . . . . . . . . . . . . . . . -60.52 -36.49 91.45 Favored Glycine 0 N--CA 1.449 -0.467 0 C-N-CA 120.725 -0.75 . . . . 0.0 111.632 179.506 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 378' ' ' GLN . . . . . . . . . . . . . 54.5 mt-30 -56.55 -30.76 63.48 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.666 0.269 . . . . 0.0 110.823 179.464 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 379' ' ' PHE . . . . . . . . . . . . . 78.6 m-85 -66.87 -45.06 79.3 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.392 -0.367 . . . . 0.0 110.85 179.871 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 380' ' ' LEU . . . . . . . . . . . . . 92.5 mt -53.63 132.57 55.4 Favored Pre-proline 0 C--N 1.33 -0.268 0 CA-C-N 116.373 -0.376 . . . . 0.0 110.193 179.451 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 381' ' ' PRO . . . . . 0.626 ' HA ' ' HB3' ' A' ' 377' ' ' ARG . 53.4 Cg_exo -52.33 171.06 0.21 Allowed 'Trans proline' 0 C--N 1.348 0.528 0 C-N-CA 122.263 1.975 . . . . 0.0 112.55 -179.581 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 382' ' ' ASP . . . . . . . . . . . . . 28.5 m-20 -64.18 169.29 4.62 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.943 -179.998 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 383' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.087 0 CA-C-O 118.284 -0.865 . . . . 0.0 111.341 -179.89 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 358' ' ' ASP . . . . . . . . . . . . . 5.3 p-10 . . . . . 0 N--CA 1.487 1.378 0 CA-C-O 120.817 0.341 . . . . 0.0 110.82 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 359' ' ' PHE . . . . . . . . . . . . . 24.7 m-85 -100.22 104.79 16.31 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.145 -179.975 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 360' ' ' THR . . . . . 0.473 ' N ' ' HB2' ' A' ' 364' ' ' SER . 35.7 p -62.31 161.15 27.14 Favored Pre-proline 0 C--N 1.329 -0.305 0 CA-C-N 115.894 -0.594 . . . . 0.0 110.918 179.848 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 361' ' ' PRO . . . . . 0.431 ' O ' ' HB3' ' A' ' 365' ' ' SER . 89.6 Cg_exo -42.95 -67.16 0.13 Allowed 'Trans proline' 0 C--N 1.35 0.625 0 C-N-CA 122.965 2.444 . . . . 0.0 113.613 -179.667 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 362' ' ' MET . . . . . . . . . . . . . 22.6 ptt? -118.59 -26.46 6.16 Favored 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 111.724 0.268 . . . . 0.0 111.724 -179.474 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 363' ' ' ASP . . . . . 0.439 ' HB2' ' OG1' ' A' ' 360' ' ' THR . 5.7 m-20 -67.62 0.04 3.52 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.571 -0.286 . . . . 0.0 111.175 -179.699 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 364' ' ' SER . . . . . 0.473 ' HB2' ' N ' ' A' ' 360' ' ' THR . 65.8 m -158.15 -23.48 0.08 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.365 -0.38 . . . . 0.0 111.057 179.685 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 365' ' ' SER . . . . . 0.431 ' HB3' ' O ' ' A' ' 361' ' ' PRO . 32.7 t -120.22 44.68 2.38 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.495 -0.32 . . . . 0.0 111.593 -179.498 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 366' ' ' ALA . . . . . 0.54 ' H ' HG12 ' B' ' 311' ' ' VAL . . . -62.47 -10.96 13.38 Favored 'General case' 0 C--O 1.234 0.268 0 CA-C-O 121.127 0.489 . . . . 0.0 110.551 179.036 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 367' ' ' VAL . . . . . 0.642 HG22 ' HB3' ' B' ' 307' ' ' ALA . 8.5 p -47.58 -22.99 0.56 Allowed 'Isoleucine or valine' 0 C--O 1.226 -0.178 0 CA-C-N 115.519 -0.764 . . . . 0.0 111.464 -179.969 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 368' ' ' TYR . . . . . . . . . . . . . 85.6 t80 -61.34 -66.09 0.59 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.896 0.379 . . . . 0.0 110.568 179.548 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 369' ' ' VAL . . . . . 0.496 HG12 ' HB3' ' B' ' 332' ' ' LEU . 4.3 p -58.42 -39.21 73.91 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.622 179.609 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 370' ' ' LEU . . . . . 0.464 HD23 ' HA ' ' B' ' 307' ' ' ALA . 2.7 mp -64.78 -35.91 82.63 Favored 'General case' 0 C--O 1.233 0.222 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.152 179.918 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 371' ' ' SER . . . . . . . . . . . . . 37.6 m -66.56 -44.99 80.82 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.387 -0.369 . . . . 0.0 110.856 -179.935 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 372' ' ' SER . . . . . . . . . . . . . 43.6 t -65.19 -36.28 83.69 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.389 -0.369 . . . . 0.0 110.869 179.724 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 373' ' ' MET . . . . . . . . . . . . . 51.4 ttm -66.0 -43.78 86.74 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.888 -179.42 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 374' ' ' ALA . . . . . . . . . . . . . . . -79.56 -42.16 25.65 Favored 'General case' 0 C--N 1.33 -0.245 0 N-CA-C 112.591 0.589 . . . . 0.0 112.591 -179.023 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 375' ' ' ARG . . . . . 0.46 ' HG2' ' HG2' ' B' ' 303' ' ' GLU . 18.1 mmm180 -66.96 -35.72 80.61 Favored 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 111.905 0.335 . . . . 0.0 111.905 -179.163 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 376' ' ' GLN . . . . . 0.406 ' HG3' ' H ' ' A' ' 378' ' ' ARG . 24.1 tp60 -51.34 -82.45 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.617 -0.265 . . . . 0.0 111.478 -179.554 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 377' ' ' ARG . . . . . 0.413 ' H ' ' HB3' ' B' ' 381' ' ' PRO . 99.5 mtt180 52.24 44.95 29.25 Favored 'General case' 0 C--O 1.232 0.159 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.928 -179.607 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 378' ' ' ARG . . . . . 0.406 ' H ' ' HG3' ' A' ' 376' ' ' GLN . 31.3 tpt180 63.07 -85.15 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 115.804 -0.635 . . . . 0.0 111.175 179.989 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 379' ' ' ALA . . . . . . . . . . . . . . . -145.59 170.7 15.93 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.821 0.343 . . . . 0.0 111.327 -179.843 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 380' ' ' SER . . . . . . . . . . . . . 39.8 t . . . . . 0 C--O 1.25 1.124 0 CA-C-O 118.258 -0.877 . . . . 0.0 111.076 179.903 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' B' B ' 295' ' ' SER . . . . . . . . . . . . . 50.6 m . . . . . 0 N--CA 1.485 1.28 0 CA-C-O 120.597 0.236 . . . . 0.0 110.882 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' B' B ' 296' ' ' LEU . . . . . . . . . . . . . 60.6 tp 62.28 105.47 0.03 OUTLIER 'General case' 0 C--N 1.332 -0.162 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.09 179.987 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 297' ' ' GLN . . . . . . . . . . . . . 14.8 mm100 60.35 -174.58 0.11 Allowed 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.979 179.926 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 298' ' ' ASN . . . . . . . . . . . . . 27.4 t-20 -85.34 108.62 17.91 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.878 179.936 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 299' ' ' ASN . . . . . . . . . . . . . 64.1 t30 -163.63 137.61 5.79 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.666 -179.95 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 300' ' ' GLN . . . . . 0.474 ' N ' ' HD2' ' B' ' 301' ' ' PRO . 15.2 mm100 -80.91 -52.21 0.88 Allowed Pre-proline 0 CA--C 1.534 0.329 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.606 -179.822 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 301' ' ' PRO . . . . . 0.474 ' HD2' ' N ' ' B' ' 300' ' ' GLN . 56.2 Cg_endo -69.78 127.62 14.84 Favored 'Trans proline' 0 C--N 1.352 0.754 0 C-N-CA 122.068 1.845 . . . . 0.0 112.217 179.983 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 302' ' ' VAL . . . . . 0.441 HG13 ' N ' ' B' ' 303' ' ' GLU . 4.0 p -91.41 -53.15 9.23 Favored 'Isoleucine or valine' 0 C--O 1.234 0.286 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.319 -179.776 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 303' ' ' GLU . . . . . 0.46 ' HG2' ' HG2' ' A' ' 375' ' ' ARG . 0.0 OUTLIER -58.78 -21.84 56.82 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.675 -179.499 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' B' B ' 304' ' ' PHE . . . . . 0.437 ' HB2' ' HB2' ' B' ' 301' ' ' PRO . 73.4 t80 -55.96 -82.22 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.518 -0.31 . . . . 0.0 110.839 -179.763 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 305' ' ' ASN . . . . . . . . . . . . . 8.7 p30 -62.21 -33.58 74.83 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.459 -179.48 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 306' ' ' HIS . . . . . . . . . . . . . 7.8 t-160 -63.31 -71.02 0.18 Allowed 'General case' 0 C--O 1.233 0.221 0 CA-C-O 120.661 0.267 . . . . 0.0 111.651 -179.163 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 307' ' ' ALA . . . . . 0.642 ' HB3' HG22 ' A' ' 367' ' ' VAL . . . -55.51 -47.93 75.45 Favored 'General case' 0 C--N 1.33 -0.266 0 N-CA-C 112.003 0.372 . . . . 0.0 112.003 -179.062 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 308' ' ' ILE . . . . . . . . . . . . . 22.4 mm -53.07 -57.57 4.41 Favored 'Isoleucine or valine' 0 C--O 1.233 0.226 0 CA-C-O 120.669 0.271 . . . . 0.0 111.444 -179.759 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 309' ' ' ASN . . . . . . . . . . . . . 14.0 m120 -61.27 -26.19 67.6 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.404 -0.362 . . . . 0.0 111.236 -179.623 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 310' ' ' TYR . . . . . 0.656 ' HH ' ' HA ' ' B' ' 372' ' ' LEU . 0.3 OUTLIER -71.4 -50.52 31.18 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.567 -0.288 . . . . 0.0 111.327 -179.838 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' B' B ' 311' ' ' VAL . . . . . 0.54 HG12 ' H ' ' A' ' 366' ' ' ALA . 15.2 t -63.46 -39.0 83.69 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.225 0 CA-C-N 116.506 -0.315 . . . . 0.0 111.071 -179.546 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 312' ' ' ASN . . . . . . . . . . . . . 6.7 t30 -69.39 -41.93 75.82 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.145 -179.95 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 313' ' ' LYS . . . . . 0.456 ' NZ ' ' HB3' ' B' ' 313' ' ' LYS . 0.0 OUTLIER -61.32 -46.42 90.36 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.018 -0.537 . . . . 0.0 111.746 -179.631 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' B' B ' 314' ' ' ILE . . . . . . . . . . . . . 79.9 mt -74.71 -36.45 40.37 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 N-CA-C 111.827 0.306 . . . . 0.0 111.827 -179.248 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 315' ' ' LYS . . . . . . . . . . . . . 1.6 tmmt? -67.24 -30.56 70.5 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.551 -0.295 . . . . 0.0 111.243 -179.656 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 316' ' ' ASN . . . . . . . . . . . . . 46.9 t-20 -88.85 -45.04 10.05 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.52 -0.309 . . . . 0.0 111.086 -179.854 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 317' ' ' ARG . . . . . 0.404 ' C ' ' H ' ' B' ' 319' ' ' GLN . 22.5 tpp180 -68.79 -63.86 0.98 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.423 -0.353 . . . . 0.0 111.124 -179.757 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 318' ' ' PHE . . . . . . . . . . . . . 97.2 m-85 -80.13 27.87 0.31 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.139 -179.827 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 319' ' ' GLN . . . . . 0.404 ' H ' ' C ' ' B' ' 317' ' ' ARG . 7.8 tt0 -61.46 -32.23 72.22 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.914 179.992 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 320' ' ' GLY . . . . . . . . . . . . . . . -74.35 -15.85 80.09 Favored Glycine 0 N--CA 1.45 -0.385 0 C-N-CA 120.873 -0.68 . . . . 0.0 112.637 -179.877 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 321' ' ' GLN . . . . . 0.427 ' HG2' HD11 ' B' ' 324' ' ' ILE . 24.2 tp60 -109.75 92.68 12.81 Favored Pre-proline 0 C--N 1.33 -0.239 0 CA-C-O 120.401 0.143 . . . . 0.0 110.803 179.914 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 322' ' ' PRO . . . . . . . . . . . . . 90.9 Cg_endo -79.66 -19.01 10.25 Favored 'Trans proline' 0 C--N 1.346 0.426 0 C-N-CA 122.604 2.203 . . . . 0.0 112.723 -179.921 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 323' ' ' ASP . . . . . 0.402 ' H ' HE21 ' B' ' 321' ' ' GLN . 25.9 m-20 -70.05 -54.51 12.78 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.389 -0.369 . . . . 0.0 111.217 -179.652 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 324' ' ' ILE . . . . . 0.427 HD11 ' HG2' ' B' ' 321' ' ' GLN . 56.0 mt -62.05 -47.82 91.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.253 -0.43 . . . . 0.0 111.338 -179.871 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 325' ' ' TYR . . . . . . . . . . . . . 18.0 t80 -59.35 -51.6 69.24 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.275 -0.42 . . . . 0.0 111.278 -179.51 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 326' ' ' LYS . . . . . . . . . . . . . 87.8 tttt -55.7 -50.41 70.38 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.37 -0.377 . . . . 0.0 111.28 -179.868 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 327' ' ' ALA . . . . . . . . . . . . . . . -52.75 -50.13 64.08 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.083 -179.998 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 328' ' ' PHE . . . . . . . . . . . . . 51.4 t80 -54.59 -43.72 72.37 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.481 179.893 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 329' ' ' LEU . . . . . . . . . . . . . 86.4 mt -63.07 -36.32 83.18 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.862 -0.608 . . . . 0.0 110.865 179.635 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 330' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -65.09 -37.7 88.35 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.702 179.74 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 331' ' ' ILE . . . . . . . . . . . . . 72.9 mt -66.91 -52.24 46.41 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.12 179.818 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 332' ' ' LEU . . . . . 0.496 ' HB3' HG12 ' A' ' 369' ' ' VAL . 8.4 mp -64.45 -32.89 74.71 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.233 -0.439 . . . . 0.0 111.339 -179.86 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 333' ' ' HIS . . . . . . . . . . . . . 56.7 t-80 -66.02 -57.81 6.93 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.059 0.457 . . . . 0.0 110.032 179.38 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 334' ' ' THR . . . . . . . . . . . . . 10.8 m -60.1 -26.23 66.05 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.252 179.402 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 335' ' ' TYR . . . . . . . . . . . . . 77.4 t80 -65.98 -49.6 67.28 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.011 179.205 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 336' ' ' GLN . . . . . . . . . . . . . 47.6 mm-40 -62.53 -33.57 75.17 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.203 179.088 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 337' ' ' LYS . . . . . . . . . . . . . 37.2 ttpt -63.35 -58.98 5.33 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.986 -0.552 . . . . 0.0 111.251 179.682 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 338' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -63.97 -28.91 70.14 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.35 -0.386 . . . . 0.0 111.383 -179.535 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 339' ' ' GLN . . . . . . . . . . . . . 65.5 tt0 -68.16 -49.83 58.44 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.938 0.399 . . . . 0.0 110.573 179.885 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 340' ' ' ARG . . . . . . . . . . . . . 83.1 mtp180 -63.94 -51.72 63.09 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.74 179.781 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 341' ' ' ASN . . . . . . . . . . . . . 4.6 m-20 -52.32 -47.45 65.99 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.076 -0.511 . . . . 0.0 111.06 179.757 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 342' ' ' ALA . . . . . . . . . . . . . . . -67.84 -31.22 70.9 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.892 179.857 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 343' ' ' LYS . . . . . . . . . . . . . 87.3 tttt -75.9 -20.51 57.97 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.611 179.896 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 344' ' ' GLU . . . . . . . . . . . . . 18.5 mm-40 -84.25 -44.26 14.06 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.966 -0.561 . . . . 0.0 111.06 179.949 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 345' ' ' ALA . . . . . . . . . . . . . . . -63.38 -41.93 98.81 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.982 179.929 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 346' ' ' GLY . . . . . . . . . . . . . . . 42.8 47.95 6.11 Favored Glycine 0 C--N 1.333 0.385 0 CA-C-N 115.989 -0.55 . . . . 0.0 112.826 179.874 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 347' ' ' GLY . . . . . . . . . . . . . . . -150.1 -123.74 1.2 Allowed Glycine 0 N--CA 1.45 -0.372 0 C-N-CA 120.585 -0.817 . . . . 0.0 112.974 -179.742 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 348' ' ' ASN . . . . . . . . . . . . . 7.8 t30 -82.34 -14.42 55.34 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.621 0.248 . . . . 0.0 111.488 -179.475 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 349' ' ' TYR . . . . . . . . . . . . . 59.6 t80 -54.52 140.25 35.21 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.84 0.353 . . . . 0.0 111.097 -179.812 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 350' ' ' THR . . . . . . . . . . . . . 43.2 m -117.65 128.86 25.73 Favored Pre-proline 0 C--N 1.329 -0.297 0 CA-C-N 116.055 -0.521 . . . . 0.0 110.593 179.563 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 351' ' ' PRO . . . . . . . . . . . . . 36.2 Cg_exo -59.17 176.31 0.53 Allowed 'Trans proline' 0 C--N 1.349 0.589 0 C-N-CA 122.332 2.021 . . . . 0.0 112.228 -179.624 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 352' ' ' ALA . . . . . . . . . . . . . . . -111.97 -55.66 2.48 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.683 -179.612 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 353' ' ' LEU . . . . . . . . . . . . . 5.3 mp -105.99 111.04 23.51 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.902 0.382 . . . . 0.0 111.491 -179.542 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 354' ' ' THR . . . . . . . . . . . . . 60.9 p -95.94 -170.05 2.05 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.259 179.259 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 355' ' ' GLU . . . . . . . . . . . . . 41.2 mt-10 -62.03 -30.05 70.7 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 120.999 0.428 . . . . 0.0 110.38 179.659 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 356' ' ' GLN . . . . . . . . . . . . . 1.6 mp0 -72.9 -43.29 62.64 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.785 -0.643 . . . . 0.0 111.361 -179.889 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 357' ' ' GLU . . . . . . . . . . . . . 8.4 tp10 -55.98 -48.5 75.72 Favored 'General case' 0 C--O 1.233 0.194 0 CA-C-O 120.903 0.382 . . . . 0.0 110.839 -179.636 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 358' ' ' VAL . . . . . 0.413 ' O ' HG21 ' B' ' 362' ' ' VAL . 86.5 t -68.19 -59.0 4.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.019 -0.537 . . . . 0.0 111.559 -179.63 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 359' ' ' TYR . . . . . . . . . . . . . 40.2 t80 -52.43 -29.67 25.62 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.632 -0.258 . . . . 0.0 111.655 -179.01 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 360' ' ' ALA . . . . . . . . . . . . . . . -74.09 -60.68 2.15 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.847 0.356 . . . . 0.0 111.178 -179.943 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 361' ' ' GLN . . . . . . . . . . . . . 49.9 mt-30 -54.25 -36.96 64.15 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.466 179.842 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 362' ' ' VAL . . . . . 0.413 HG21 ' O ' ' B' ' 358' ' ' VAL . 87.9 t -72.06 -37.79 61.38 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-N 115.868 -0.605 . . . . 0.0 110.341 179.332 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 363' ' ' ALA . . . . . 0.555 ' HA ' HD13 ' B' ' 373' ' ' LEU . . . -57.86 -38.36 75.56 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.572 179.694 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 364' ' ' ARG . . . . . . . . . . . . . 63.3 mtm180 -90.73 -19.35 23.64 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.861 -0.609 . . . . 0.0 110.779 179.519 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 365' ' ' LEU . . . . . . . . . . . . . 24.4 tp -58.16 -37.76 75.32 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.049 -0.523 . . . . 0.0 111.511 -179.705 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 366' ' ' PHE . . . . . . . . . . . . . 75.5 m-85 -98.13 164.25 12.41 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.918 0.39 . . . . 0.0 111.425 -179.504 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 367' ' ' LYS . . . . . 0.451 ' C ' ' H ' ' B' ' 369' ' ' GLN . 65.7 mttm -96.06 87.71 4.64 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.951 -179.893 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 368' ' ' ASN . . . . . . . . . . . . . 2.4 m-20 62.05 -0.49 0.46 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.683 179.675 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 369' ' ' GLN . . . . . 0.451 ' H ' ' C ' ' B' ' 367' ' ' LYS . 8.5 tp60 -63.69 102.84 0.49 Allowed 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.827 0.346 . . . . 0.0 110.158 179.752 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 370' ' ' GLU . . . . . . . . . . . . . 46.3 tt0 -91.82 -25.56 18.94 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.132 -0.485 . . . . 0.0 111.823 -179.048 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 371' ' ' ASP . . . . . . . . . . . . . 19.0 m-20 -49.36 -63.51 1.08 Allowed 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.879 0.371 . . . . 0.0 110.812 -179.989 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 372' ' ' LEU . . . . . 0.656 ' HA ' ' HH ' ' B' ' 310' ' ' TYR . 7.4 mp -55.44 -45.66 76.78 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.695 179.273 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 373' ' ' LEU . . . . . 0.555 HD13 ' HA ' ' B' ' 363' ' ' ALA . 1.2 mp -59.22 -27.13 65.46 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.74 -0.664 . . . . 0.0 111.459 -179.729 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 374' ' ' SER . . . . . . . . . . . . . 67.4 m -77.92 -57.84 3.58 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.84 0.352 . . . . 0.0 110.82 -179.83 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 375' ' ' GLU . . . . . 0.46 ' HB2' ' OH ' ' B' ' 310' ' ' TYR . 10.8 mm-40 -59.87 -28.67 67.74 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.077 -0.511 . . . . 0.0 110.309 179.807 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 376' ' ' PHE . . . . . 0.516 ' HA ' ' HB2' ' B' ' 379' ' ' PHE . 79.2 t80 -83.1 -33.44 26.35 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.144 179.3 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 377' ' ' GLY . . . . . . . . . . . . . . . -60.1 -43.16 98.58 Favored Glycine 0 N--CA 1.45 -0.417 0 C-N-CA 120.747 -0.739 . . . . 0.0 111.384 179.249 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 378' ' ' GLN . . . . . . . . . . . . . 25.2 mm-40 -79.53 -18.04 52.73 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.105 0.479 . . . . 0.0 109.988 179.075 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 379' ' ' PHE . . . . . 0.516 ' HB2' ' HA ' ' B' ' 376' ' ' PHE . 0.6 OUTLIER -63.78 -29.33 70.55 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.642 -0.708 . . . . 0.0 110.287 179.621 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' B' B ' 380' ' ' LEU . . . . . . . . . . . . . 42.2 mt -62.93 153.0 81.95 Favored Pre-proline 0 C--N 1.33 -0.242 0 CA-C-N 115.715 -0.675 . . . . 0.0 110.989 -179.87 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 381' ' ' PRO . . . . . 0.413 ' HB3' ' H ' ' A' ' 377' ' ' ARG . 55.0 Cg_endo -70.0 116.27 4.51 Favored 'Trans proline' 0 C--N 1.347 0.474 0 C-N-CA 122.544 2.163 . . . . 0.0 112.301 179.97 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 382' ' ' ASP . . . . . . . . . . . . . 17.5 t70 -87.18 121.61 29.86 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.814 179.983 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 383' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.087 0 CA-C-O 118.219 -0.896 . . . . 0.0 111.054 -179.957 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 358' ' ' ASP . . . . . . . . . . . . . 19.7 t70 . . . . . 0 N--CA 1.486 1.344 0 CA-C-O 120.827 0.346 . . . . 0.0 111.008 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 359' ' ' PHE . . . . . . . . . . . . . 83.6 t80 -135.64 134.62 39.43 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.905 179.909 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 360' ' ' THR . . . . . 0.406 ' HA ' ' HD2' ' A' ' 361' ' ' PRO . 69.2 p -129.75 104.69 17.15 Favored Pre-proline 0 C--N 1.33 -0.27 0 CA-C-N 116.112 -0.495 . . . . 0.0 111.066 -179.991 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 361' ' ' PRO . . . . . 0.406 ' HD2' ' HA ' ' A' ' 360' ' ' THR . 23.4 Cg_endo -61.06 -177.04 0.17 Allowed 'Trans proline' 0 C--N 1.347 0.484 0 C-N-CA 122.558 2.172 . . . . 0.0 112.506 179.971 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 362' ' ' MET . . . . . 0.481 ' SD ' HD11 ' B' ' 329' ' ' LEU . 6.9 tpt -60.67 -71.31 0.14 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.868 179.978 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 363' ' ' ASP . . . . . . . . . . . . . 15.0 t70 -172.45 -55.39 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.606 -179.914 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 364' ' ' SER . . . . . . . . . . . . . 47.2 t -102.08 -76.45 0.57 Allowed 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.978 -0.555 . . . . 0.0 110.709 179.828 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 365' ' ' SER . . . . . . . . . . . . . 70.4 m -160.71 82.64 0.67 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.083 179.852 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 366' ' ' ALA . . . . . . . . . . . . . . . -78.3 -42.65 30.2 Favored 'General case' 0 C--O 1.234 0.269 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.735 179.637 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 367' ' ' VAL . . . . . . . . . . . . . 41.4 t -57.88 -30.2 37.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 115.797 -0.638 . . . . 0.0 110.648 179.688 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 368' ' ' TYR . . . . . . . . . . . . . 84.1 t80 -67.36 -37.11 82.71 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.099 -0.501 . . . . 0.0 110.464 179.578 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 369' ' ' VAL . . . . . . . . . . . . . 10.9 t -68.63 -56.57 11.82 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 115.87 -0.605 . . . . 0.0 110.788 179.704 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 370' ' ' LEU . . . . . 0.486 ' HB2' ' HB3' ' B' ' 307' ' ' ALA . 94.5 mt -58.21 -40.42 81.55 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.925 -0.58 . . . . 0.0 111.092 -179.854 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 371' ' ' SER . . . . . 0.528 ' HA ' ' HB3' ' B' ' 303' ' ' GLU . 84.1 p -60.97 -59.12 5.88 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.092 -179.913 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 372' ' ' SER . . . . . . . . . . . . . 47.1 t -54.54 -33.87 60.82 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.789 0.328 . . . . 0.0 111.201 -179.835 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 373' ' ' MET . . . . . . . . . . . . . 53.9 ttm -64.14 -48.31 76.54 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.515 -179.811 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 374' ' ' ALA . . . . . 0.532 ' HB1' ' HG3' ' B' ' 303' ' ' GLU . . . -87.05 -6.14 58.82 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.488 -0.324 . . . . 0.0 111.852 -179.519 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 375' ' ' ARG . . . . . 0.538 ' HB2' ' HG2' ' B' ' 303' ' ' GLU . 29.6 ttt180 -91.94 -31.17 15.74 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.874 0.369 . . . . 0.0 110.932 -179.861 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 376' ' ' GLN . . . . . . . . . . . . . 52.4 tt0 -67.82 -21.41 65.21 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.004 -0.544 . . . . 0.0 111.779 -179.31 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 377' ' ' ARG . . . . . 0.516 ' HB3' ' HA ' ' B' ' 381' ' ' PRO . 16.1 ptm180 -57.73 -22.45 46.63 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.868 0.366 . . . . 0.0 110.849 -179.95 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 378' ' ' ARG . . . . . . . . . . . . . 41.5 ttm180 -124.82 -66.79 0.95 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.61 179.797 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 379' ' ' ALA . . . . . . . . . . . . . . . 54.82 92.55 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.011 -0.54 . . . . 0.0 111.315 179.926 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 380' ' ' SER . . . . . . . . . . . . . 46.9 t . . . . . 0 C--O 1.25 1.113 0 CA-C-O 118.239 -0.886 . . . . 0.0 110.899 -179.951 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' B' B ' 295' ' ' SER . . . . . . . . . . . . . 44.9 t . . . . . 0 N--CA 1.486 1.369 0 CA-C-O 120.83 0.348 . . . . 0.0 110.911 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' B' B ' 296' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -89.89 -40.09 12.63 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.809 179.95 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 297' ' ' GLN . . . . . . . . . . . . . 49.3 mt-30 -115.0 151.33 34.37 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.95 179.974 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 298' ' ' ASN . . . . . . . . . . . . . 6.2 t30 -133.36 99.96 4.68 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.906 -179.893 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 299' ' ' ASN . . . . . . . . . . . . . 6.4 t30 58.64 92.83 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.752 -179.762 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 300' ' ' GLN . . . . . . . . . . . . . 27.7 mt-30 -63.22 139.3 97.53 Favored Pre-proline 0 C--N 1.33 -0.261 0 CA-C-N 116.13 -0.487 . . . . 0.0 111.2 -179.717 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 301' ' ' PRO . . . . . 0.579 ' HB2' ' HB2' ' B' ' 304' ' ' PHE . 73.7 Cg_endo -75.83 138.81 21.52 Favored 'Trans proline' 0 C--N 1.348 0.534 0 C-N-CA 122.381 2.054 . . . . 0.0 112.244 179.786 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 302' ' ' VAL . . . . . 0.436 HG12 ' N ' ' B' ' 303' ' ' GLU . 2.5 p -92.13 -51.72 11.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.108 -0.497 . . . . 0.0 111.4 -179.865 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 303' ' ' GLU . . . . . 0.538 ' HG2' ' HB2' ' A' ' 375' ' ' ARG . 2.4 mp0 -73.7 -43.75 58.41 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.259 -0.428 . . . . 0.0 112.134 -179.244 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 304' ' ' PHE . . . . . 0.579 ' HB2' ' HB2' ' B' ' 301' ' ' PRO . 54.6 m-85 -62.18 -39.92 94.29 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.712 0.292 . . . . 0.0 111.365 -179.589 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 305' ' ' ASN . . . . . . . . . . . . . 6.8 t30 -71.54 -47.31 55.91 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.48 -179.626 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 306' ' ' HIS . . . . . . . . . . . . . 18.5 t-160 -65.51 -40.76 93.38 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.792 0.33 . . . . 0.0 111.214 -179.559 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 307' ' ' ALA . . . . . 0.486 ' HB3' ' HB2' ' A' ' 370' ' ' LEU . . . -65.95 -51.8 55.36 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.685 -179.406 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 308' ' ' ILE . . . . . 0.415 HD11 ' O ' ' B' ' 308' ' ' ILE . 0.0 OUTLIER -58.93 -43.08 87.81 Favored 'Isoleucine or valine' 0 C--O 1.233 0.23 0 CA-C-O 120.724 0.297 . . . . 0.0 110.685 -179.827 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' B' B ' 309' ' ' ASN . . . . . . . . . . . . . 27.0 t-20 -67.32 -30.04 69.77 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.619 179.622 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 310' ' ' TYR . . . . . 0.612 ' HH ' ' HB2' ' B' ' 376' ' ' PHE . 56.8 t80 -66.11 -52.01 52.65 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.806 179.872 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 311' ' ' VAL . . . . . . . . . . . . . 47.3 t -61.53 -44.0 97.86 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.2 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.83 179.798 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 312' ' ' ASN . . . . . . . . . . . . . 23.5 t-20 -63.74 -33.8 76.47 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.817 179.777 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 313' ' ' LYS . . . . . 0.512 ' HZ3' ' HB3' ' B' ' 372' ' ' LEU . 1.1 tmmt? -64.96 -50.7 65.37 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.895 -179.975 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 314' ' ' ILE . . . . . . . . . . . . . 66.4 mt -71.76 -25.2 23.94 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.264 -179.881 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 315' ' ' LYS . . . . . 0.575 ' HB2' ' HH ' ' B' ' 325' ' ' TYR . 1.5 tmmt? -71.73 -39.74 69.89 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.875 -179.884 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 316' ' ' ASN . . . . . . . . . . . . . 27.2 t-20 -80.67 -41.68 23.34 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.293 -179.882 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 317' ' ' ARG . . . . . . . . . . . . . 29.1 tpt180 -68.68 -61.89 1.62 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.04 -179.806 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 318' ' ' PHE . . . . . . . . . . . . . 76.4 m-85 -83.67 31.56 0.47 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.089 -179.938 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 319' ' ' GLN . . . . . . . . . . . . . 6.5 tp-100 -62.1 -20.63 64.25 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.264 -0.426 . . . . 0.0 110.646 179.779 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 320' ' ' GLY . . . . . . . . . . . . . . . -92.52 -13.33 57.2 Favored Glycine 0 C--N 1.33 0.204 0 C-N-CA 120.928 -0.653 . . . . 0.0 112.502 179.968 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 321' ' ' GLN . . . . . . . . . . . . . 15.9 mm100 -108.79 92.75 10.96 Favored Pre-proline 0 C--N 1.329 -0.292 0 CA-C-O 120.548 0.213 . . . . 0.0 110.637 179.819 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 322' ' ' PRO . . . . . . . . . . . . . 98.3 Cg_endo -78.97 -26.57 5.24 Favored 'Trans proline' 0 C--N 1.347 0.48 0 C-N-CA 122.537 2.158 . . . . 0.0 112.603 -179.792 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 323' ' ' ASP . . . . . . . . . . . . . 15.7 t70 -68.9 -54.9 12.96 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.123 -179.715 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 324' ' ' ILE . . . . . . . . . . . . . 80.2 mt -64.18 -43.74 97.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.37 -179.949 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 325' ' ' TYR . . . . . 0.575 ' HH ' ' HB2' ' B' ' 315' ' ' LYS . 16.3 t80 -60.4 -44.67 95.45 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.718 -179.975 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 326' ' ' LYS . . . . . . . . . . . . . 63.8 tttp -63.29 -50.89 68.33 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.969 179.977 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 327' ' ' ALA . . . . . . . . . . . . . . . -51.86 -49.77 62.25 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.134 -179.951 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 328' ' ' PHE . . . . . . . . . . . . . 69.8 t80 -56.02 -52.92 62.51 Favored 'General case' 0 C--O 1.237 0.401 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.519 179.826 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 329' ' ' LEU . . . . . 0.481 HD11 ' SD ' ' A' ' 362' ' ' MET . 89.9 mt -61.12 -24.19 66.07 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.815 -0.629 . . . . 0.0 110.754 179.8 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 330' ' ' GLU . . . . . . . . . . . . . 16.3 mm-40 -75.92 -34.27 59.89 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.562 179.49 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 331' ' ' ILE . . . . . . . . . . . . . 80.9 mt -68.89 -44.2 81.84 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.207 0 CA-C-N 116.204 -0.453 . . . . 0.0 109.995 179.183 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 332' ' ' LEU . . . . . . . . . . . . . 45.7 mt -69.31 -39.32 78.33 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.802 -0.636 . . . . 0.0 111.007 179.684 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 333' ' ' HIS . . . . . . . . . . . . . 68.9 t60 -63.69 -51.61 64.29 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.762 179.96 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 334' ' ' THR . . . . . 0.461 HG23 ' HZ3' ' B' ' 337' ' ' LYS . 42.1 m -62.28 -35.58 79.46 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.732 179.793 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 335' ' ' TYR . . . . . . . . . . . . . 61.0 t80 -59.31 -62.36 1.94 Allowed 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.075 -0.512 . . . . 0.0 110.825 179.731 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 336' ' ' GLN . . . . . . . . . . . . . 26.0 tp60 -54.15 -42.93 70.14 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.121 -0.49 . . . . 0.0 111.391 -179.683 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 337' ' ' LYS . . . . . 0.625 ' HB3' ' HZ1' ' B' ' 337' ' ' LYS . 6.4 ttpm? -53.83 -54.62 35.86 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.892 0.377 . . . . 0.0 111.005 -179.816 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 338' ' ' GLU . . . . . . . . . . . . . 41.6 mt-10 -62.76 -31.58 72.56 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.032 -179.8 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 339' ' ' GLN . . . . . . . . . . . . . 15.8 mm100 -64.99 -47.67 76.7 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.846 0.355 . . . . 0.0 110.546 179.55 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 340' ' ' ARG . . . . . . . . . . . . . 96.0 mtt180 -59.59 -51.39 70.03 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.269 179.38 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 341' ' ' ASN . . . . . . . . . . . . . 2.3 m-20 -59.51 -31.94 69.84 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.366 179.568 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 342' ' ' ALA . . . . . . . . . . . . . . . -70.68 -33.32 70.79 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.938 179.896 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 343' ' ' LYS . . . . . . . . . . . . . 61.3 mttp -79.03 -27.81 43.24 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.882 179.843 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 344' ' ' GLU . . . . . . . . . . . . . 19.9 mm-40 -74.99 -45.31 42.84 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.048 -179.924 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 345' ' ' ALA . . . . . . . . . . . . . . . -66.61 -42.11 87.34 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.991 179.989 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 346' ' ' GLY . . . . . . . . . . . . . . . 46.53 32.68 5.65 Favored Glycine 0 C--N 1.333 0.374 0 C-N-CA 121.135 -0.555 . . . . 0.0 112.81 179.883 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 347' ' ' GLY . . . . . . . . . . . . . . . -127.65 -107.36 1.42 Allowed Glycine 0 N--CA 1.45 -0.368 0 C-N-CA 120.692 -0.766 . . . . 0.0 112.949 -179.701 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 348' ' ' ASN . . . . . . . . . . . . . 62.0 t30 -106.29 -0.75 24.14 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.673 0.273 . . . . 0.0 111.208 -179.459 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 349' ' ' TYR . . . . . . . . . . . . . 41.5 t80 -55.9 116.99 3.28 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.817 -179.887 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 350' ' ' THR . . . . . . . . . . . . . 89.6 m -115.43 114.38 42.76 Favored Pre-proline 0 C--N 1.329 -0.312 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.137 -179.815 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 351' ' ' PRO . . . . . . . . . . . . . 51.6 Cg_exo -53.7 157.8 9.33 Favored 'Trans proline' 0 C--N 1.35 0.657 0 C-N-CA 122.364 2.042 . . . . 0.0 112.218 179.76 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 352' ' ' ALA . . . . . . . . . . . . . . . -81.1 -61.4 1.97 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.564 -179.539 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 353' ' ' LEU . . . . . 0.479 ' HB2' ' HB3' ' B' ' 357' ' ' GLU . 0.2 OUTLIER -106.68 131.6 53.63 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 121.012 0.434 . . . . 0.0 111.414 -179.588 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' B' B ' 354' ' ' THR . . . . . . . . . . . . . 65.2 p -113.84 -160.84 0.74 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.827 -0.624 . . . . 0.0 110.662 179.868 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 355' ' ' GLU . . . . . . . . . . . . . 41.5 mt-10 -57.17 -28.02 62.43 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.412 -0.358 . . . . 0.0 110.876 179.755 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 356' ' ' GLN . . . . . . . . . . . . . 23.6 tm0? -69.86 -50.01 46.82 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.044 -0.525 . . . . 0.0 111.008 -179.77 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 357' ' ' GLU . . . . . 0.479 ' HB3' ' HB2' ' B' ' 353' ' ' LEU . 7.1 tp10 -64.43 -36.97 85.91 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.484 -0.325 . . . . 0.0 110.979 -179.673 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 358' ' ' VAL . . . . . . . . . . . . . 48.7 t -64.12 -59.85 3.63 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.981 179.973 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 359' ' ' TYR . . . . . . . . . . . . . 37.3 t80 -59.59 -30.1 68.43 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.474 -0.33 . . . . 0.0 111.331 -179.534 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 360' ' ' ALA . . . . . . . . . . . . . . . -69.75 -60.49 2.28 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.69 0.281 . . . . 0.0 111.324 -179.646 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 361' ' ' GLN . . . . . . . . . . . . . 76.8 mt-30 -56.19 -44.88 79.86 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.235 -0.438 . . . . 0.0 110.903 179.99 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 362' ' ' VAL . . . . . . . . . . . . . 64.2 t -64.63 -35.39 74.62 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.716 179.759 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 363' ' ' ALA . . . . . 0.509 ' HA ' HD13 ' B' ' 373' ' ' LEU . . . -61.69 -42.83 99.46 Favored 'General case' 0 CA--C 1.521 -0.171 0 CA-C-O 120.955 0.407 . . . . 0.0 110.263 179.327 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 364' ' ' ARG . . . . . . . . . . . . . 68.2 ttt180 -81.55 -18.23 45.65 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.877 -0.601 . . . . 0.0 110.201 179.42 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 365' ' ' LEU . . . . . . . . . . . . . 8.1 tp -60.96 -25.52 66.88 Favored 'General case' 0 C--O 1.232 0.164 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.381 179.659 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 366' ' ' PHE . . . . . . . . . . . . . 60.4 m-85 -125.97 162.21 25.75 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.142 179.546 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 367' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -115.61 -87.8 0.59 Allowed 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 120.753 0.311 . . . . 0.0 111.596 -179.408 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 368' ' ' ASN . . . . . 0.554 ' N ' HD21 ' B' ' 368' ' ' ASN . 0.8 OUTLIER -79.74 -0.95 36.42 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.443 -0.344 . . . . 0.0 111.276 -179.513 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' B' B ' 369' ' ' GLN . . . . . . . . . . . . . 46.9 mt-30 -98.44 84.24 3.17 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.393 -0.367 . . . . 0.0 111.218 -179.896 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 370' ' ' GLU . . . . . . . . . . . . . 44.7 mt-10 -93.9 -6.01 46.6 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.759 179.671 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 371' ' ' ASP . . . . . . . . . . . . . 19.9 t70 -57.71 -62.03 2.09 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.004 -179.812 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 372' ' ' LEU . . . . . 0.512 ' HB3' ' HZ3' ' B' ' 313' ' ' LYS . 0.3 OUTLIER -64.32 -22.51 66.97 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.257 -0.428 . . . . 0.0 111.114 179.87 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' B' B ' 373' ' ' LEU . . . . . 0.509 HD13 ' HA ' ' B' ' 363' ' ' ALA . 5.3 tp -71.53 -38.12 71.11 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.535 -179.793 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 374' ' ' SER . . . . . . . . . . . . . 48.9 m -73.66 -48.27 33.59 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.08 -0.509 . . . . 0.0 109.767 179.074 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 375' ' ' GLU . . . . . . . . . . . . . 8.5 tp10 -55.58 -38.52 69.48 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.677 -0.692 . . . . 0.0 109.813 179.133 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 376' ' ' PHE . . . . . 0.612 ' HB2' ' HH ' ' B' ' 310' ' ' TYR . 76.0 t80 -75.2 -32.73 61.29 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 115.861 -0.609 . . . . 0.0 109.903 179.15 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 377' ' ' GLY . . . . . . . . . . . . . . . -60.11 -33.11 78.18 Favored Glycine 0 N--CA 1.449 -0.486 0 C-N-CA 120.606 -0.807 . . . . 0.0 111.259 179.054 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 378' ' ' GLN . . . . . . . . . . . . . 26.8 mm-40 -67.98 -31.92 71.96 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.751 0.31 . . . . 0.0 110.881 179.318 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 379' ' ' PHE . . . . . 0.433 ' HB2' ' O ' ' B' ' 376' ' ' PHE . 15.1 m-85 -56.57 -41.13 76.39 Favored 'General case' 0 C--N 1.334 -0.105 0 CA-C-N 116.319 -0.4 . . . . 0.0 110.943 179.71 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 380' ' ' LEU . . . . . . . . . . . . . 96.0 mt -56.38 131.1 76.16 Favored Pre-proline 0 C--N 1.329 -0.302 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.633 179.824 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 381' ' ' PRO . . . . . 0.516 ' HA ' ' HB3' ' A' ' 377' ' ' ARG . 54.3 Cg_exo -51.3 144.51 30.32 Favored 'Trans proline' 0 C--N 1.347 0.473 0 C-N-CA 122.355 2.037 . . . . 0.0 112.337 -179.955 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 382' ' ' ASP . . . . . . . . . . . . . 15.4 t70 -96.56 122.19 39.21 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.742 179.977 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 383' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.031 0 CA-C-O 118.263 -0.875 . . . . 0.0 111.098 -179.932 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 358' ' ' ASP . . . . . . . . . . . . . 17.0 t70 . . . . . 0 N--CA 1.487 1.383 0 CA-C-O 120.804 0.335 . . . . 0.0 110.923 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 359' ' ' PHE . . . . . . . . . . . . . 69.4 m-85 -82.28 117.99 22.8 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.04 179.982 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 360' ' ' THR . . . . . 0.492 ' HB ' ' HD3' ' A' ' 361' ' ' PRO . 91.1 m -91.67 -47.17 0.34 Allowed Pre-proline 0 C--N 1.328 -0.328 0 CA-C-N 115.972 -0.558 . . . . 0.0 111.698 179.932 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 361' ' ' PRO . . . . . 0.492 ' HD3' ' HB ' ' A' ' 360' ' ' THR . 73.4 Cg_exo -50.28 -50.22 14.13 Favored 'Trans proline' 0 C--N 1.354 0.865 0 C-N-CA 122.204 1.936 . . . . 0.0 112.663 -179.988 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 362' ' ' MET . . . . . 0.513 ' HG2' ' HB2' ' A' ' 366' ' ' ALA . 4.4 tpt -57.45 -71.92 0.09 Allowed 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 120.937 0.399 . . . . 0.0 110.517 179.764 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 363' ' ' ASP . . . . . . . . . . . . . 16.9 t70 175.08 -60.34 0.01 OUTLIER 'General case' 0 C--N 1.333 -0.135 0 CA-C-N 115.667 -0.697 . . . . 0.0 109.949 -179.809 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 364' ' ' SER . . . . . . . . . . . . . 79.7 p -134.75 -60.26 0.79 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.603 -0.726 . . . . 0.0 110.296 179.445 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 365' ' ' SER . . . . . . . . . . . . . 48.2 t -175.24 100.9 0.08 Allowed 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.026 -0.534 . . . . 0.0 111.045 179.674 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 366' ' ' ALA . . . . . 0.513 ' HB2' ' HG2' ' A' ' 362' ' ' MET . . . -74.09 -13.55 60.85 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 121.013 0.435 . . . . 0.0 110.686 179.59 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 367' ' ' VAL . . . . . . . . . . . . . 61.8 t -53.7 -31.23 19.71 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 115.706 -0.679 . . . . 0.0 111.452 -179.885 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 368' ' ' TYR . . . . . . . . . . . . . 65.8 m-85 -60.39 -50.4 73.75 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.758 0.313 . . . . 0.0 111.32 -179.929 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 369' ' ' VAL . . . . . 0.539 HG13 ' HG2' ' B' ' 336' ' ' GLN . 24.0 t -67.93 -52.35 40.27 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.568 -179.534 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 370' ' ' LEU . . . . . 0.518 HD13 ' HA ' ' B' ' 307' ' ' ALA . 86.9 mt -55.93 -46.51 78.45 Favored 'General case' 0 C--O 1.235 0.341 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.215 -179.808 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 371' ' ' SER . . . . . . . . . . . . . 45.8 t -60.04 -59.42 5.45 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.089 -179.949 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 372' ' ' SER . . . . . . . . . . . . . 50.6 m -51.06 -35.02 32.48 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.459 -0.337 . . . . 0.0 111.468 -179.616 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 373' ' ' MET . . . . . . . . . . . . . 54.1 tpp -65.0 -56.18 14.63 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.419 -0.355 . . . . 0.0 111.599 -179.441 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 374' ' ' ALA . . . . . 0.474 ' HB2' ' OE1' ' B' ' 303' ' ' GLU . . . -80.96 -6.15 58.38 Favored 'General case' 0 C--N 1.33 -0.267 0 N-CA-C 112.256 0.465 . . . . 0.0 112.256 -178.885 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 375' ' ' ARG . . . . . . . . . . . . . 32.7 tpt180 -96.65 -27.31 14.85 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 120.611 0.243 . . . . 0.0 111.263 -179.688 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 376' ' ' GLN . . . . . . . . . . . . . 7.5 mm100 -65.02 -9.55 22.78 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.466 -0.334 . . . . 0.0 111.435 -179.961 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 377' ' ' ARG . . . . . . . . . . . . . 14.9 ptp180 -59.14 -38.26 79.23 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.463 -0.335 . . . . 0.0 110.854 179.905 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 378' ' ' ARG . . . . . . . . . . . . . 99.3 mtt180 -144.25 143.89 31.25 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.74 179.791 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 379' ' ' ALA . . . . . . . . . . . . . . . -89.5 -47.97 7.63 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.105 179.98 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 380' ' ' SER . . . . . . . . . . . . . 59.3 p . . . . . 0 C--O 1.249 1.067 0 CA-C-O 118.201 -0.904 . . . . 0.0 110.941 -179.965 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' B' B ' 295' ' ' SER . . . . . . . . . . . . . 78.8 p . . . . . 0 N--CA 1.486 1.375 0 CA-C-O 120.822 0.344 . . . . 0.0 110.834 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' B' B ' 296' ' ' LEU . . . . . 0.423 ' N ' HD21 ' B' ' 296' ' ' LEU . 3.4 mm? -80.35 -33.4 37.39 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.77 -179.979 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 297' ' ' GLN . . . . . . . . . . . . . 24.2 mt-30 57.28 -169.03 0.11 Allowed 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.075 -179.969 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 298' ' ' ASN . . . . . . . . . . . . . 16.1 m120 -119.87 -52.07 2.23 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.144 -179.891 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 299' ' ' ASN . . . . . . . . . . . . . 17.1 m120 -87.39 169.38 12.31 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.27 -179.915 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 300' ' ' GLN . . . . . . . . . . . . . 83.9 mm-40 -137.23 149.91 67.4 Favored Pre-proline 0 C--N 1.33 -0.269 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.905 179.96 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 301' ' ' PRO . . . . . 0.426 ' HB2' ' HB2' ' B' ' 304' ' ' PHE . 31.2 Cg_exo -61.01 130.93 34.57 Favored 'Trans proline' 0 C--N 1.348 0.528 0 C-N-CA 122.439 2.093 . . . . 0.0 111.898 179.788 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 302' ' ' VAL . . . . . . . . . . . . . 7.3 p -89.76 -41.0 13.46 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.296 -179.728 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 303' ' ' GLU . . . . . 0.474 ' OE1' ' HB2' ' A' ' 374' ' ' ALA . 55.8 mm-40 -70.33 -45.58 65.9 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.178 -0.464 . . . . 0.0 111.41 -179.44 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 304' ' ' PHE . . . . . 0.426 ' HB2' ' HB2' ' B' ' 301' ' ' PRO . 89.7 m-85 -64.35 -50.24 68.52 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.098 -179.7 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 305' ' ' ASN . . . . . . . . . . . . . 27.7 t-20 -58.18 -54.47 46.58 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.436 -179.613 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 306' ' ' HIS . . . . . . . . . . . . . 9.8 m-70 -59.48 -61.26 2.76 Favored 'General case' 0 C--N 1.331 -0.234 0 N-CA-C 112.012 0.375 . . . . 0.0 112.012 -179.327 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 307' ' ' ALA . . . . . 0.518 ' HA ' HD13 ' A' ' 370' ' ' LEU . . . -52.7 -60.52 3.15 Favored 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 112.492 0.553 . . . . 0.0 112.492 -178.798 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 308' ' ' ILE . . . . . . . . . . . . . 90.9 mt -51.55 -54.28 12.9 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.218 0 N-CA-C 111.647 0.24 . . . . 0.0 111.647 -179.26 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 309' ' ' ASN . . . . . 0.562 ' N ' HD21 ' B' ' 309' ' ' ASN . 0.8 OUTLIER -62.52 -24.07 67.3 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.456 -0.338 . . . . 0.0 111.09 -179.744 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' B' B ' 310' ' ' TYR . . . . . . . . . . . . . 34.3 t80 -69.3 -58.92 3.4 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.424 -0.353 . . . . 0.0 111.093 -179.693 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 311' ' ' VAL . . . . . 0.435 ' O ' ' HG3' ' B' ' 315' ' ' LYS . 27.1 t -58.94 -44.83 91.84 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.117 0 CA-C-O 120.816 0.341 . . . . 0.0 110.514 179.9 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 312' ' ' ASN . . . . . . . . . . . . . 2.9 t-20 -57.96 -41.59 83.19 Favored 'General case' 0 C--O 1.232 0.179 0 CA-C-O 121.005 0.431 . . . . 0.0 110.631 179.641 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 313' ' ' LYS . . . . . . . . . . . . . 37.4 tttt -59.06 -60.01 4.55 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.771 -0.649 . . . . 0.0 111.123 179.703 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 314' ' ' ILE . . . . . . . . . . . . . 19.9 mt -59.61 -27.47 37.68 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 115.778 -0.646 . . . . 0.0 111.708 -179.04 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 315' ' ' LYS . . . . . 0.503 ' HZ2' ' HB2' ' B' ' 315' ' ' LYS . 8.7 mtmp? -71.59 -40.4 69.9 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.805 0.335 . . . . 0.0 110.805 179.681 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 316' ' ' ASN . . . . . . . . . . . . . 58.8 t30 -84.75 -12.88 52.81 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.772 179.912 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 317' ' ' ARG . . . . . 0.404 HH21 HE22 ' B' ' 369' ' ' GLN . 29.8 tpt180 -90.3 -66.63 0.91 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.798 179.814 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 318' ' ' PHE . . . . . . . . . . . . . 96.7 m-85 -88.28 39.68 0.92 Allowed 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.788 179.862 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 319' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -61.13 -9.17 4.23 Favored 'General case' 0 N--CA 1.45 -0.467 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.532 -179.785 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 320' ' ' GLY . . . . . . . . . . . . . . . -96.23 -40.25 4.04 Favored Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.83 -0.7 . . . . 0.0 112.901 179.968 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 321' ' ' GLN . . . . . . . . . . . . . 6.2 tp-100 -105.88 98.08 17.19 Favored Pre-proline 0 C--N 1.33 -0.242 0 CA-C-O 120.418 0.151 . . . . 0.0 110.925 -179.82 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 322' ' ' PRO . . . . . . . . . . . . . 93.2 Cg_endo -80.43 -13.36 12.27 Favored 'Trans proline' 0 C--N 1.348 0.552 0 C-N-CA 122.472 2.115 . . . . 0.0 112.533 179.913 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 323' ' ' ASP . . . . . . . . . . . . . 14.7 t70 -65.87 -55.11 18.73 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.007 179.992 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 324' ' ' ILE . . . . . . . . . . . . . 61.1 mt -63.32 -37.93 80.81 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.936 179.899 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 325' ' ' TYR . . . . . . . . . . . . . 55.7 t80 -60.21 -58.39 8.71 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.657 179.766 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 326' ' ' LYS . . . . . . . . . . . . . 38.2 ttmt -58.89 -40.76 85.39 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.835 -0.62 . . . . 0.0 110.993 179.994 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 327' ' ' ALA . . . . . . . . . . . . . . . -55.47 -50.48 69.76 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-O 120.891 0.376 . . . . 0.0 110.991 -179.917 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 328' ' ' PHE . . . . . . . . . . . . . 24.4 t80 -57.42 -57.46 12.56 Favored 'General case' 0 C--O 1.239 0.504 0 CA-C-O 121.334 0.587 . . . . 0.0 110.189 179.637 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 329' ' ' LEU . . . . . 0.44 HD21 ' SD ' ' A' ' 362' ' ' MET . 10.5 mp -59.13 -20.31 52.55 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.523 -0.762 . . . . 0.0 110.904 -179.989 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 330' ' ' GLU . . . . . . . . . . . . . 21.8 mt-10 -77.84 -35.68 50.85 Favored 'General case' 0 C--N 1.332 -0.158 0 N-CA-C 109.829 -0.434 . . . . 0.0 109.829 178.825 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 331' ' ' ILE . . . . . . . . . . . . . 96.8 mt -64.93 -44.25 96.16 Favored 'Isoleucine or valine' 0 C--O 1.233 0.189 0 N-CA-C 109.312 -0.625 . . . . 0.0 109.312 178.524 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 332' ' ' LEU . . . . . 0.421 ' O ' ' HB3' ' B' ' 335' ' ' TYR . 8.9 mp -68.62 -41.03 80.06 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.621 -0.718 . . . . 0.0 110.783 179.225 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 333' ' ' HIS . . . . . . . . . . . . . 42.5 t-80 -59.68 -53.93 52.3 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.309 179.752 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 334' ' ' THR . . . . . . . . . . . . . 93.1 m -60.92 -33.16 72.72 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.277 179.143 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 335' ' ' TYR . . . . . 0.526 ' HH ' ' HG2' ' B' ' 355' ' ' GLU . 74.2 t80 -55.65 -65.35 0.61 Allowed 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.646 179.463 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 336' ' ' GLN . . . . . 0.539 ' HG2' HG13 ' A' ' 369' ' ' VAL . 63.9 mm-40 -65.18 -22.3 66.88 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.36 -0.382 . . . . 0.0 111.018 179.846 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 337' ' ' LYS . . . . . . . . . . . . . 61.0 tttp -61.32 -65.67 0.66 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.382 -0.372 . . . . 0.0 110.424 179.695 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 338' ' ' GLU . . . . . . . . . . . . . 42.9 mt-10 -63.51 -33.88 76.55 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.53 179.53 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 339' ' ' GLN . . . . . . . . . . . . . 7.7 tp60 -57.38 -53.91 52.75 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.532 179.609 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 340' ' ' ARG . . . . . . . . . . . . . 99.7 mtt180 -59.28 -50.87 72.33 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.372 179.484 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 341' ' ' ASN . . . . . . . . . . . . . 13.8 m120 -56.09 -26.82 51.15 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.861 179.637 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 342' ' ' ALA . . . . . . . . . . . . . . . -74.44 -46.7 38.23 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.056 179.948 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 343' ' ' LYS . . . . . . . . . . . . . 14.2 mptt -76.37 -12.63 60.09 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.068 179.738 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 344' ' ' GLU . . . . . . . . . . . . . 23.2 mm-40 -89.08 -40.92 12.61 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.925 179.742 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 345' ' ' ALA . . . . . . . . . . . . . . . -71.96 -41.54 67.62 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.936 179.937 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 346' ' ' GLY . . . . . . . . . . . . . . . 53.33 31.4 42.5 Favored Glycine 0 C--N 1.331 0.288 0 C-N-CA 121.003 -0.618 . . . . 0.0 112.591 179.906 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 347' ' ' GLY . . . . . . . . . . . . . . . -129.89 -119.82 2.18 Favored Glycine 0 N--CA 1.45 -0.407 0 C-N-CA 120.737 -0.744 . . . . 0.0 112.805 -179.927 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 348' ' ' ASN . . . . . . . . . . . . . 14.8 m120 -90.65 -8.25 50.51 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.555 0.217 . . . . 0.0 111.423 -179.532 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 349' ' ' TYR . . . . . . . . . . . . . 31.2 t80 -58.73 128.32 36.62 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 120.828 0.347 . . . . 0.0 110.912 -179.719 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 350' ' ' THR . . . . . . . . . . . . . 30.6 m -132.42 130.19 21.76 Favored Pre-proline 0 C--N 1.329 -0.307 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.773 179.83 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 351' ' ' PRO . . . . . . . . . . . . . 26.3 Cg_exo -62.33 174.98 2.3 Favored 'Trans proline' 0 C--N 1.35 0.622 0 C-N-CA 122.433 2.089 . . . . 0.0 112.334 -179.733 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 352' ' ' ALA . . . . . . . . . . . . . . . -104.38 -71.11 0.75 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.486 -179.911 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 353' ' ' LEU . . . . . 0.544 ' HB3' ' HG2' ' B' ' 357' ' ' GLU . 0.3 OUTLIER -92.6 145.7 24.23 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 121.464 0.649 . . . . 0.0 112.398 -179.392 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' B' B ' 354' ' ' THR . . . . . . . . . . . . . 81.4 p -115.14 -166.65 1.14 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.447 -0.797 . . . . 0.0 110.333 179.34 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 355' ' ' GLU . . . . . 0.526 ' HG2' ' HH ' ' B' ' 335' ' ' TYR . 37.5 mt-10 -59.89 -33.09 71.38 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 121.155 0.503 . . . . 0.0 110.271 179.418 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 356' ' ' GLN . . . . . . . . . . . . . 26.2 mp0 -70.17 -44.81 67.99 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.695 -0.684 . . . . 0.0 111.176 -179.78 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 357' ' ' GLU . . . . . 0.544 ' HG2' ' HB3' ' B' ' 353' ' ' LEU . 6.5 tp10 -61.68 -44.0 97.78 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-O 120.706 0.289 . . . . 0.0 110.534 -179.984 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 358' ' ' VAL . . . . . . . . . . . . . 87.0 t -59.76 -54.57 32.79 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.633 179.499 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 359' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -60.99 -28.03 68.73 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.864 -179.869 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 360' ' ' ALA . . . . . . . . . . . . . . . -72.4 -60.98 1.96 Allowed 'General case' 0 C--O 1.233 0.22 0 CA-C-N 116.41 -0.359 . . . . 0.0 111.273 -179.767 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 361' ' ' GLN . . . . . 0.405 ' O ' ' HB2' ' B' ' 365' ' ' LEU . 47.3 mt-30 -58.96 -34.0 71.28 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.438 179.855 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 362' ' ' VAL . . . . . . . . . . . . . 11.5 t -69.99 -40.16 78.26 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 115.826 -0.625 . . . . 0.0 110.785 179.577 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 363' ' ' ALA . . . . . 0.586 ' HA ' HD23 ' B' ' 373' ' ' LEU . . . -62.14 -38.73 90.09 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.39 179.488 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 364' ' ' ARG . . . . . . . . . . . . . 64.9 ttt180 -83.63 -19.35 35.59 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.252 179.141 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 365' ' ' LEU . . . . . 0.405 ' HB2' ' O ' ' B' ' 361' ' ' GLN . 13.2 tp -58.89 -34.62 71.87 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.853 -179.959 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 366' ' ' PHE . . . . . 0.481 ' HB3' ' HB2' ' B' ' 369' ' ' GLN . 59.7 m-85 -117.25 164.66 14.48 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.732 179.983 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 367' ' ' LYS . . . . . . . . . . . . . 60.9 mttp -116.54 -75.15 0.58 Allowed 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.931 179.915 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 368' ' ' ASN . . . . . . . . . . . . . 15.9 m120 -87.48 -3.98 59.0 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.78 -179.956 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 369' ' ' GLN . . . . . 0.481 ' HB2' ' HB3' ' B' ' 366' ' ' PHE . 17.7 mm-40 -97.3 83.01 3.22 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.025 -179.867 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 370' ' ' GLU . . . . . . . . . . . . . 40.2 tt0 -93.41 -15.61 25.47 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.629 179.648 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 371' ' ' ASP . . . . . . . . . . . . . 7.3 m-20 -55.36 -39.13 69.71 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.94 -0.573 . . . . 0.0 111.122 -179.9 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 372' ' ' LEU . . . . . . . . . . . . . 6.1 mp -71.3 -38.88 71.73 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.772 179.844 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 373' ' ' LEU . . . . . 0.586 HD23 ' HA ' ' B' ' 363' ' ' ALA . 3.0 mp -56.74 -50.52 71.99 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.997 -0.547 . . . . 0.0 111.028 179.885 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 374' ' ' SER . . . . . . . . . . . . . 41.7 t -69.6 -48.0 61.58 Favored 'General case' 0 C--O 1.235 0.329 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.616 179.651 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 375' ' ' GLU . . . . . 0.408 ' O ' ' HG2' ' B' ' 378' ' ' GLN . 40.9 tt0 -54.67 -29.63 53.29 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 115.857 -0.611 . . . . 0.0 110.108 179.642 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 376' ' ' PHE . . . . . 0.441 ' O ' ' HB2' ' B' ' 379' ' ' PHE . 90.4 t80 -87.18 -27.68 22.88 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.934 -0.576 . . . . 0.0 110.004 178.71 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 377' ' ' GLY . . . . . . . . . . . . . . . -61.41 -38.67 96.12 Favored Glycine 0 N--CA 1.45 -0.376 0 C-N-CA 120.884 -0.674 . . . . 0.0 112.342 179.749 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 378' ' ' GLN . . . . . 0.408 ' HG2' ' O ' ' B' ' 375' ' ' GLU . 13.4 pt20 -63.31 -26.6 68.84 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.524 0.202 . . . . 0.0 111.053 179.731 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 379' ' ' PHE . . . . . 0.441 ' HB2' ' O ' ' B' ' 376' ' ' PHE . 29.3 m-85 -62.02 -33.96 75.32 Favored 'General case' 0 C--N 1.333 -0.122 0 CA-C-N 116.607 -0.269 . . . . 0.0 110.855 179.681 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 380' ' ' LEU . . . . . . . . . . . . . 79.3 mt -53.95 133.77 58.04 Favored Pre-proline 0 C--N 1.33 -0.26 0 CA-C-N 116.334 -0.393 . . . . 0.0 110.328 179.938 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 381' ' ' PRO . . . . . . . . . . . . . 64.1 Cg_exo -51.13 127.13 20.87 Favored 'Trans proline' 0 C--N 1.347 0.483 0 C-N-CA 122.434 2.089 . . . . 0.0 112.353 -179.596 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 382' ' ' ASP . . . . . . . . . . . . . 5.7 m-20 -96.83 128.78 44.12 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.875 -179.945 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 383' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.115 0 CA-C-O 118.34 -0.838 . . . . 0.0 111.258 179.947 . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 358' ' ' ASP . . . . . . . . . . . . . 22.6 t70 . . . . . 0 N--CA 1.486 1.347 0 CA-C-O 120.714 0.292 . . . . 0.0 111.026 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 359' ' ' PHE . . . . . . . . . . . . . 11.0 p90 -86.26 -171.03 3.36 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.811 -179.897 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 360' ' ' THR . . . . . . . . . . . . . 80.7 p -120.35 117.69 31.59 Favored Pre-proline 0 C--N 1.33 -0.246 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.152 179.97 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 361' ' ' PRO . . . . . . . . . . . . . 28.5 Cg_exo -62.07 169.43 7.61 Favored 'Trans proline' 0 C--N 1.348 0.54 0 C-N-CA 122.326 2.018 . . . . 0.0 112.026 179.746 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 362' ' ' MET . . . . . 0.556 ' HG3' ' HB3' ' B' ' 329' ' ' LEU . 1.6 tmt? -74.85 -71.94 0.32 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.306 -0.406 . . . . 0.0 111.053 -179.947 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 363' ' ' ASP . . . . . . . . . . . . . 21.8 t70 177.25 142.02 0.08 Allowed 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 115.664 -0.698 . . . . 0.0 109.886 -179.899 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 364' ' ' SER . . . . . . . . . . . . . 49.8 m 56.8 23.23 7.79 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.966 0.412 . . . . 0.0 110.209 -179.495 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 365' ' ' SER . . . . . . . . . . . . . 39.7 t 63.73 93.35 0.06 Allowed 'General case' 0 C--O 1.232 0.172 0 CA-C-N 115.646 -0.706 . . . . 0.0 111.309 -179.996 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 366' ' ' ALA . . . . . 0.441 ' HB3' ' HB3' ' A' ' 362' ' ' MET . . . -74.47 -26.27 59.92 Favored 'General case' 0 C--O 1.234 0.289 0 CA-C-O 121.095 0.474 . . . . 0.0 110.538 179.434 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 367' ' ' VAL . . . . . . . . . . . . . 18.4 t -57.97 -28.38 33.5 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 115.707 -0.679 . . . . 0.0 110.541 179.521 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 368' ' ' TYR . . . . . . . . . . . . . 46.1 t80 -70.16 -33.95 72.41 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.452 179.747 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 369' ' ' VAL . . . . . 0.508 HG23 ' HB2' ' B' ' 336' ' ' GLN . 20.7 t -71.48 -52.8 23.75 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.784 179.795 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 370' ' ' LEU . . . . . 0.417 HD11 ' HA ' ' B' ' 307' ' ' ALA . 87.7 mt -62.74 -41.2 99.07 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.831 -0.622 . . . . 0.0 111.183 -179.848 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 371' ' ' SER . . . . . 0.513 ' HG ' ' H ' ' A' ' 372' ' ' SER . 84.3 p -62.81 -55.78 23.29 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.768 179.901 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 372' ' ' SER . . . . . 0.513 ' H ' ' HG ' ' A' ' 371' ' ' SER . 69.1 m -53.03 -39.65 63.34 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.921 179.998 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 373' ' ' MET . . . . . . . . . . . . . 55.3 ttm -62.42 -43.07 99.7 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.768 179.779 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 374' ' ' ALA . . . . . . . . . . . . . . . -83.18 -8.44 59.49 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.557 -179.972 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 375' ' ' ARG . . . . . 0.551 ' HA ' ' HE ' ' A' ' 375' ' ' ARG . 4.1 mmp_? -102.62 -13.73 17.01 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.491 -0.322 . . . . 0.0 111.174 -179.854 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 376' ' ' GLN . . . . . 0.416 ' HB3' ' HG3' ' B' ' 381' ' ' PRO . 44.4 tt0 -82.34 18.45 1.44 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.321 -0.4 . . . . 0.0 110.727 -179.956 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 377' ' ' ARG . . . . . . . . . . . . . 78.5 mtp180 -54.62 134.46 46.9 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.088 179.886 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 378' ' ' ARG . . . . . . . . . . . . . 65.1 mtm180 63.79 156.78 0.07 Allowed 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 115.958 -0.564 . . . . 0.0 111.375 -179.993 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 379' ' ' ALA . . . . . . . . . . . . . . . -154.13 -168.01 2.82 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.895 -179.958 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 380' ' ' SER . . . . . . . . . . . . . 50.7 p . . . . . 0 C--O 1.249 1.063 0 CA-C-O 118.281 -0.866 . . . . 0.0 110.864 -179.993 . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' B' B ' 295' ' ' SER . . . . . . . . . . . . . 49.3 m . . . . . 0 N--CA 1.487 1.395 0 CA-C-O 120.853 0.358 . . . . 0.0 110.858 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' B' B ' 296' ' ' LEU . . . . . . . . . . . . . 57.3 tp -69.97 144.74 52.25 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.859 -179.991 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 297' ' ' GLN . . . . . . . . . . . . . 35.4 tt0 -154.14 -40.23 0.09 Allowed 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.879 179.903 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 298' ' ' ASN . . . . . . . . . . . . . 3.4 p-10 -144.18 171.11 14.74 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.795 -179.969 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 299' ' ' ASN . . . . . . . . . . . . . 66.4 m-20 -111.04 -7.6 14.51 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.037 -179.957 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 300' ' ' GLN . . . . . . . . . . . . . 7.6 tp60 -138.69 85.4 17.07 Favored Pre-proline 0 C--N 1.33 -0.27 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.878 179.904 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 301' ' ' PRO . . . . . . . . . . . . . 51.4 Cg_exo -54.43 150.9 32.23 Favored 'Trans proline' 0 C--N 1.347 0.468 0 C-N-CA 122.5 2.133 . . . . 0.0 112.363 179.833 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 302' ' ' VAL . . . . . . . . . . . . . 28.5 m -81.29 -20.25 11.08 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.95 179.935 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 303' ' ' GLU . . . . . . . . . . . . . 40.5 mt-10 -55.6 -82.88 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.75 -0.659 . . . . 0.0 111.877 -179.212 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 304' ' ' PHE . . . . . . . . . . . . . 79.6 m-85 -57.56 -39.71 77.33 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.788 -179.067 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 305' ' ' ASN . . . . . . . . . . . . . 22.5 t-20 -53.68 -69.34 0.12 Allowed 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 111.86 0.318 . . . . 0.0 111.86 -179.1 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 306' ' ' HIS . . . . . . . . . . . . . 13.4 m-70 -61.94 -53.97 48.32 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.185 -0.461 . . . . 0.0 112.243 -178.697 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 307' ' ' ALA . . . . . 0.417 ' HA ' HD11 ' A' ' 370' ' ' LEU . . . -52.3 -61.96 1.94 Allowed 'General case' 0 C--N 1.33 -0.242 0 N-CA-C 112.372 0.508 . . . . 0.0 112.372 -178.904 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 308' ' ' ILE . . . . . . . . . . . . . 86.1 mt -55.4 -54.54 24.1 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.231 0 N-CA-C 111.809 0.3 . . . . 0.0 111.809 -179.346 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 309' ' ' ASN . . . . . . . . . . . . . 39.2 t-20 -54.05 -29.91 45.92 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-O 120.899 0.38 . . . . 0.0 111.042 -179.554 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 310' ' ' TYR . . . . . 0.449 ' O ' ' HG3' ' B' ' 313' ' ' LYS . 8.6 t80 -70.86 -61.77 1.64 Allowed 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.073 -179.729 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 311' ' ' VAL . . . . . . . . . . . . . 38.4 t -59.09 -22.09 21.17 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-O 120.922 0.392 . . . . 0.0 110.656 179.875 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 312' ' ' ASN . . . . . . . . . . . . . 41.1 t30 -73.53 -57.38 4.04 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.534 -179.893 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 313' ' ' LYS . . . . . 0.449 ' HG3' ' O ' ' B' ' 310' ' ' TYR . 0.0 OUTLIER -62.46 -27.98 69.49 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 116.323 -0.399 . . . . 0.0 111.327 -179.55 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' B' B ' 314' ' ' ILE . . . . . . . . . . . . . 92.8 mt -77.43 -44.98 29.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.497 -0.32 . . . . 0.0 111.177 179.737 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 315' ' ' LYS . . . . . . . . . . . . . 27.4 ttpp -69.25 -24.74 64.03 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.223 -179.65 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 316' ' ' ASN . . . . . . . . . . . . . 6.7 t30 -85.8 -57.59 2.99 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.321 -0.399 . . . . 0.0 111.247 -179.694 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 317' ' ' ARG . . . . . . . . . . . . . 21.4 tpp180 -65.33 -59.56 3.91 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.058 -179.801 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 318' ' ' PHE . . . . . . . . . . . . . 90.3 m-85 -83.49 40.26 0.71 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.213 -0.448 . . . . 0.0 110.853 -179.89 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 319' ' ' GLN . . . . . . . . . . . . . 17.7 tt0 -71.76 -7.38 47.82 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.042 -0.527 . . . . 0.0 110.884 -179.864 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 320' ' ' GLY . . . . . . . . . . . . . . . -107.23 1.14 35.1 Favored Glycine 0 N--CA 1.452 -0.26 0 C-N-CA 120.658 -0.782 . . . . 0.0 112.83 -179.758 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 321' ' ' GLN . . . . . . . . . . . . . 27.7 mm-40 -112.5 88.49 11.13 Favored Pre-proline 0 C--N 1.33 -0.261 0 CA-C-O 120.491 0.186 . . . . 0.0 110.89 179.969 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 322' ' ' PRO . . . . . . . . . . . . . 73.9 Cg_endo -74.15 -29.46 9.78 Favored 'Trans proline' 0 C--N 1.347 0.475 0 C-N-CA 122.625 2.217 . . . . 0.0 112.654 -179.815 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 323' ' ' ASP . . . . . . . . . . . . . 13.8 t70 -68.87 -51.02 44.78 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.332 -0.395 . . . . 0.0 111.084 -179.647 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 324' ' ' ILE . . . . . . . . . . . . . 73.3 mt -68.23 -44.16 84.22 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.16 179.943 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 325' ' ' TYR . . . . . . . . . . . . . 35.3 t80 -58.04 -53.44 58.23 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.855 -179.826 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 326' ' ' LYS . . . . . 0.415 ' O ' ' HG3' ' B' ' 330' ' ' GLU . 86.1 tttt -60.09 -58.44 8.54 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.372 -179.865 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 327' ' ' ALA . . . . . 0.411 ' HB2' HD12 ' B' ' 365' ' ' LEU . . . -45.69 -53.07 9.9 Favored 'General case' 0 C--O 1.234 0.248 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.592 -179.654 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 328' ' ' PHE . . . . . . . . . . . . . 52.2 t80 -54.01 -53.52 51.84 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.146 0.498 . . . . 0.0 110.649 179.947 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 329' ' ' LEU . . . . . 0.556 ' HB3' ' HG3' ' A' ' 362' ' ' MET . 84.6 mt -60.5 -24.38 65.26 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.712 -0.676 . . . . 0.0 110.984 179.891 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 330' ' ' GLU . . . . . 0.415 ' HG3' ' O ' ' B' ' 326' ' ' LYS . 48.0 mt-10 -76.17 -33.38 59.35 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.569 179.587 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 331' ' ' ILE . . . . . 0.484 HG21 HG23 ' B' ' 358' ' ' VAL . 76.8 mt -70.77 -44.53 76.2 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.222 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.275 179.378 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 332' ' ' LEU . . . . . . . . . . . . . 30.1 mt -69.34 -39.91 77.85 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.987 179.569 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 333' ' ' HIS . . . . . . . . . . . . . 53.5 t-80 -62.84 -54.04 44.87 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.977 0.418 . . . . 0.0 110.378 179.641 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 334' ' ' THR . . . . . . . . . . . . . 70.7 m -60.0 -33.69 72.32 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.361 179.545 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 335' ' ' TYR . . . . . . . . . . . . . 74.7 t80 -61.35 -48.18 82.49 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.664 179.518 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 336' ' ' GLN . . . . . 0.508 ' HB2' HG23 ' A' ' 369' ' ' VAL . 20.6 tt0 -60.75 -46.5 90.21 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.742 179.727 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 337' ' ' LYS . . . . . . . . . . . . . 41.0 ttmt -57.34 -43.08 83.12 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.031 -0.531 . . . . 0.0 111.008 179.985 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 338' ' ' GLU . . . . . . . . . . . . . 29.8 mm-40 -68.04 -36.84 80.57 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.378 -179.664 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 339' ' ' GLN . . . . . . . . . . . . . 27.0 mm-40 -66.41 -44.33 83.26 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.744 0.307 . . . . 0.0 110.837 179.949 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 340' ' ' ARG . . . . . . . . . . . . . 99.7 mtt180 -62.76 -54.11 44.02 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.738 179.895 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 341' ' ' ASN . . . . . . . . . . . . . 2.7 m-20 -57.52 -44.95 85.49 Favored 'General case' 0 C--O 1.234 0.249 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.947 179.865 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 342' ' ' ALA . . . . . . . . . . . . . . . -63.8 -30.22 71.33 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.846 179.881 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 343' ' ' LYS . . . . . . . . . . . . . 26.8 ttpp -76.1 -31.29 58.63 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.64 179.756 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 344' ' ' GLU . . . . . . . . . . . . . 22.7 mm-40 -69.63 -55.24 10.59 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.03 -0.532 . . . . 0.0 111.076 179.939 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 345' ' ' ALA . . . . . . . . . . . . . . . -74.0 -42.32 60.55 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.814 179.997 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 346' ' ' GLY . . . . . . . . . . . . . . . 43.59 56.34 4.95 Favored Glycine 0 C--N 1.331 0.291 0 CA-C-N 115.915 -0.584 . . . . 0.0 113.066 179.728 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 347' ' ' GLY . . . . . . . . . . . . . . . -174.54 -112.49 0.29 Allowed Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.559 -0.829 . . . . 0.0 112.938 -179.881 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 348' ' ' ASN . . . . . . . . . . . . . 27.5 t-20 -56.78 -30.6 63.8 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.709 0.29 . . . . 0.0 111.4 -179.616 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 349' ' ' TYR . . . . . . . . . . . . . 40.5 t80 -62.67 138.16 58.43 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.806 0.336 . . . . 0.0 110.883 -179.822 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 350' ' ' THR . . . . . . . . . . . . . 90.3 m -128.05 125.11 23.4 Favored Pre-proline 0 C--N 1.329 -0.305 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.849 179.778 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 351' ' ' PRO . . . . . . . . . . . . . 52.7 Cg_exo -55.1 163.31 4.51 Favored 'Trans proline' 0 C--N 1.349 0.564 0 C-N-CA 122.402 2.068 . . . . 0.0 112.262 179.948 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 352' ' ' ALA . . . . . . . . . . . . . . . -93.48 -23.05 18.51 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.163 -179.82 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 353' ' ' LEU . . . . . 0.521 ' HB3' ' HG2' ' B' ' 357' ' ' GLU . 0.2 OUTLIER -159.15 140.31 12.9 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 121.229 0.538 . . . . 0.0 111.743 179.91 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' B' B ' 354' ' ' THR . . . . . . . . . . . . . 60.4 p -114.63 -167.09 1.17 Allowed 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.754 -0.657 . . . . 0.0 110.744 179.733 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 355' ' ' GLU . . . . . . . . . . . . . 42.7 mt-10 -56.8 -27.62 60.15 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.957 0.408 . . . . 0.0 110.521 179.547 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 356' ' ' GLN . . . . . . . . . . . . . 87.8 mt-30 -70.55 -49.53 47.08 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.814 -0.63 . . . . 0.0 111.115 -179.828 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 357' ' ' GLU . . . . . 0.521 ' HG2' ' HB3' ' B' ' 353' ' ' LEU . 7.0 tp10 -62.7 -44.06 97.21 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.103 -179.634 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 358' ' ' VAL . . . . . 0.484 HG23 HG21 ' B' ' 331' ' ' ILE . 95.1 t -62.32 -58.08 9.17 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.351 -0.386 . . . . 0.0 111.29 -179.911 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 359' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -58.81 -31.55 68.56 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.523 -179.246 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 360' ' ' ALA . . . . . . . . . . . . . . . -72.16 -60.9 2.0 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.729 0.299 . . . . 0.0 111.252 -179.811 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 361' ' ' GLN . . . . . . . . . . . . . 97.6 mt-30 -55.37 -35.7 65.55 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 121.045 0.45 . . . . 0.0 110.348 179.555 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 362' ' ' VAL . . . . . . . . . . . . . 14.4 t -70.82 -36.85 66.24 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 CA-C-N 115.734 -0.666 . . . . 0.0 110.485 179.316 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 363' ' ' ALA . . . . . 0.599 ' HA ' HD22 ' B' ' 373' ' ' LEU . . . -63.13 -38.33 90.75 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.735 179.903 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 364' ' ' ARG . . . . . . . . . . . . . 36.1 ttt180 -88.71 -18.14 28.48 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.793 179.73 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 365' ' ' LEU . . . . . 0.411 HD12 ' HB2' ' B' ' 327' ' ' ALA . 20.7 tp -56.22 -64.86 0.72 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.019 -0.537 . . . . 0.0 111.011 -179.861 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 366' ' ' PHE . . . . . . . . . . . . . 74.0 m-85 -71.56 167.83 18.89 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.024 -0.535 . . . . 0.0 111.096 -179.675 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 367' ' ' LYS . . . . . . . . . . . . . 35.1 mmtp -82.18 75.32 9.11 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.955 -179.796 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 368' ' ' ASN . . . . . . . . . . . . . 85.3 m-20 58.92 10.42 1.54 Allowed 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.11 -0.496 . . . . 0.0 111.356 179.967 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 369' ' ' GLN . . . . . . . . . . . . . 83.0 mm-40 -61.02 113.25 2.44 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.785 0.326 . . . . 0.0 110.852 179.979 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 370' ' ' GLU . . . . . . . . . . . . . 9.7 tp10 -91.25 -26.77 18.84 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.218 -0.447 . . . . 0.0 110.862 179.916 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 371' ' ' ASP . . . . . . . . . . . . . 18.0 t70 -56.6 -54.6 44.12 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.69 179.91 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 372' ' ' LEU . . . . . . . . . . . . . 6.4 mp -65.17 -43.26 92.29 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.777 179.81 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 373' ' ' LEU . . . . . 0.599 HD22 ' HA ' ' B' ' 363' ' ' ALA . 2.1 mp -56.69 -34.53 67.49 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.926 179.789 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 374' ' ' SER . . . . . . . . . . . . . 59.7 m -75.97 -56.25 4.84 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.627 -179.948 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 375' ' ' GLU . . . . . . . . . . . . . 10.1 mm-40 -50.9 -33.53 24.58 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.599 179.647 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 376' ' ' PHE . . . . . 0.407 ' HB2' ' OH ' ' B' ' 310' ' ' TYR . 79.4 t80 -80.76 -38.77 28.02 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.426 179.55 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 377' ' ' GLY . . . . . . . . . . . . . . . -58.61 -28.61 62.84 Favored Glycine 0 N--CA 1.448 -0.519 0 C-N-CA 120.653 -0.784 . . . . 0.0 111.928 179.583 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 378' ' ' GLN . . . . . . . . . . . . . 50.3 mt-30 -61.31 -35.62 77.88 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.729 0.299 . . . . 0.0 110.807 179.603 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 379' ' ' PHE . . . . . . . . . . . . . 68.2 m-85 -58.96 -40.38 84.56 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.772 179.766 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 380' ' ' LEU . . . . . . . . . . . . . 48.7 mt -51.32 131.92 33.24 Favored Pre-proline 0 C--N 1.331 -0.221 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.441 179.907 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 381' ' ' PRO . . . . . 0.416 ' HG3' ' HB3' ' A' ' 376' ' ' GLN . 76.3 Cg_exo -49.59 108.04 0.18 Allowed 'Trans proline' 0 C--N 1.348 0.529 0 C-N-CA 122.235 1.956 . . . . 0.0 112.234 -179.806 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 382' ' ' ASP . . . . . . . . . . . . . 7.8 m-20 -72.86 151.77 41.81 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.961 -179.777 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 383' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.251 1.138 0 CA-C-O 118.159 -0.924 . . . . 0.0 111.09 -179.924 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 366' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.46 0.045 0 CA-C-O 120.793 0.33 . . . . 0.0 111.307 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 367' ' ' VAL . . . . . . . . . . . . . 16.4 m -62.63 -26.39 40.52 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.152 179.831 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 368' ' ' TYR . . . . . . . . . . . . . 42.6 t80 -73.36 -54.92 7.15 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.251 -0.432 . . . . 0.0 111.169 -179.825 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 369' ' ' VAL . . . . . 0.515 HG13 HD22 ' A' ' 370' ' ' LEU . 7.7 p -57.99 -42.22 82.13 Favored 'Isoleucine or valine' 0 C--O 1.232 0.169 0 CA-C-O 120.782 0.325 . . . . 0.0 110.799 -179.992 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 370' ' ' LEU . . . . . 0.515 HD22 HG13 ' A' ' 369' ' ' VAL . 2.7 mm? -63.16 -46.38 87.45 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 121.011 0.434 . . . . 0.0 110.124 179.093 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 371' ' ' SER . . . . . . . . . . . . . 30.6 t -64.78 -24.21 67.48 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 115.843 -0.617 . . . . 0.0 110.641 179.36 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 372' ' ' SER . . . . . . . . . . . . . 46.6 t -72.59 -50.37 25.87 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.678 -179.972 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 373' ' ' MET . . . . . . . . . . . . . 66.4 mtt -62.02 -41.08 97.7 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.75 179.652 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 374' ' ' ALA . . . . . . . . . . . . . . . -65.71 -55.77 15.59 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.089 -0.505 . . . . 0.0 112.021 -179.329 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 375' ' ' ARG . . . . . . . . . . . . . 25.3 mmm180 -60.08 -44.6 94.65 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.506 -0.315 . . . . 0.0 111.668 -179.509 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 376' ' ' GLN . . . . . . . . . . . . . 24.2 mm-40 . . . . . 0 C--N 1.328 -0.332 0 CA-C-N 116.431 -0.35 . . . . 0.0 111.812 -179.407 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' B' B ' 302' ' ' VAL . . . . . 0.59 HG23 ' H ' ' B' ' 303' ' ' GLU . 5.1 m . . . . . 0 CA--C 1.529 0.153 0 N-CA-C 111.819 0.303 . . . . 0.0 111.819 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 303' ' ' GLU . . . . . 0.59 ' H ' HG23 ' B' ' 302' ' ' VAL . 10.6 pt-20 -57.33 -39.63 76.29 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 111.761 0.282 . . . . 0.0 111.761 -179.152 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 304' ' ' PHE . . . . . . . . . . . . . 81.5 m-85 -60.22 -77.08 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 112.048 0.388 . . . . 0.0 112.048 -179.217 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 305' ' ' ASN . . . . . . . . . . . . . 37.5 t30 -50.47 -45.36 56.12 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 112.779 0.659 . . . . 0.0 112.779 -178.596 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 306' ' ' HIS . . . . . 0.426 ' HB2' ' O ' ' B' ' 302' ' ' VAL . 0.4 OUTLIER -64.39 -64.87 0.77 Allowed 'General case' 0 C--N 1.33 -0.27 0 N-CA-C 112.315 0.487 . . . . 0.0 112.315 -178.418 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' B' B ' 307' ' ' ALA . . . . . . . . . . . . . . . -54.88 -48.69 72.67 Favored 'General case' 0 N--CA 1.464 0.27 0 N-CA-C 112.183 0.438 . . . . 0.0 112.183 -178.929 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 308' ' ' ILE . . . . . . . . . . . . . 97.6 mt -55.66 -54.19 28.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-O 120.707 0.289 . . . . 0.0 111.097 -179.889 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 309' ' ' ASN . . . . . 0.403 ' O ' ' HG2' ' B' ' 313' ' ' LYS . 5.1 m-20 -63.45 -22.34 66.83 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.436 -0.347 . . . . 0.0 110.99 179.985 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 310' ' ' TYR . . . . . 0.445 ' HA ' ' HE2' ' B' ' 313' ' ' LYS . 64.0 t80 -70.4 -61.11 1.9 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.218 -0.447 . . . . 0.0 110.826 179.887 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 311' ' ' VAL . . . . . . . . . . . . . 50.6 t -62.37 -28.39 44.55 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.771 179.823 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 312' ' ' ASN . . . . . . . . . . . . . 26.8 t-20 -69.18 -55.32 10.98 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.379 -179.873 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 313' ' ' LYS . . . . . 0.564 ' HG3' ' N ' ' B' ' 314' ' ' ILE . 40.5 pttt -58.18 -43.61 87.61 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.377 -0.374 . . . . 0.0 111.345 -179.542 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 314' ' ' ILE . . . . . 0.564 ' N ' ' HG3' ' B' ' 313' ' ' LYS . 96.0 mt -68.66 -34.97 67.86 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.437 -0.347 . . . . 0.0 111.368 -179.473 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 315' ' ' LYS . . . . . . . . . . . . . 22.4 ttmm -66.65 -37.17 84.24 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.822 0.344 . . . . 0.0 110.711 179.648 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 316' ' ' ASN . . . . . . . . . . . . . 25.4 t-20 -83.61 -21.45 32.54 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.978 -179.836 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 317' ' ' ARG . . . . . . . . . . . . . 21.9 tpt180 -75.92 -65.84 0.86 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.994 -179.998 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 318' ' ' PHE . . . . . . . . . . . . . 99.1 m-85 -91.24 35.66 0.93 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.933 179.991 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 319' ' ' GLN . . . . . . . . . . . . . 11.6 pt20 -58.34 -18.27 26.2 Favored 'General case' 0 N--CA 1.449 -0.519 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.17 179.905 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 320' ' ' GLY . . . . . . . . . . . . . . . -96.03 -22.66 19.61 Favored Glycine 0 N--CA 1.451 -0.347 0 C-N-CA 120.805 -0.712 . . . . 0.0 112.58 179.937 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 321' ' ' GLN . . . . . . . . . . . . . 7.6 tp-100 -109.0 96.2 19.85 Favored Pre-proline 0 C--N 1.33 -0.26 0 CA-C-O 120.465 0.174 . . . . 0.0 110.825 -179.946 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 322' ' ' PRO . . . . . . . . . . . . . 87.8 Cg_endo -81.76 -12.25 11.11 Favored 'Trans proline' 0 C--N 1.348 0.511 0 C-N-CA 122.625 2.217 . . . . 0.0 112.847 -179.735 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 323' ' ' ASP . . . . . . . . . . . . . 9.6 m-20 -70.29 -55.69 8.59 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.517 -0.311 . . . . 0.0 111.168 -179.788 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 324' ' ' ILE . . . . . . . . . . . . . 58.8 mt -65.46 -37.37 79.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.277 -0.42 . . . . 0.0 111.065 -179.774 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 325' ' ' TYR . . . . . . . . . . . . . 28.1 t80 -64.05 -50.09 69.78 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.592 179.971 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 326' ' ' LYS . . . . . . . . . . . . . 38.9 ttmt -61.04 -38.66 86.94 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.035 -0.529 . . . . 0.0 110.692 179.613 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 327' ' ' ALA . . . . . 0.405 ' HB3' HD21 ' B' ' 365' ' ' LEU . . . -58.87 -54.96 41.24 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.916 179.905 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 328' ' ' PHE . . . . . . . . . . . . . 90.0 t80 -53.59 -49.96 66.65 Favored 'General case' 0 C--O 1.235 0.29 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.613 179.726 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 329' ' ' LEU . . . . . . . . . . . . . 96.4 mt -58.0 -35.53 71.36 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.96 179.892 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 330' ' ' GLU . . . . . . . . . . . . . 41.7 mt-10 -67.83 -34.84 77.52 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.617 179.652 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 331' ' ' ILE . . . . . . . . . . . . . 74.2 mt -65.65 -49.77 75.62 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.197 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.751 179.565 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 332' ' ' LEU . . . . . 0.467 ' HB3' HG11 ' A' ' 369' ' ' VAL . 5.2 mp -67.22 -30.56 70.51 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.359 -0.382 . . . . 0.0 111.104 179.939 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 333' ' ' HIS . . . . . . . . . . . . . 49.7 t-80 -65.26 -55.7 16.94 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.872 0.368 . . . . 0.0 110.279 179.565 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 334' ' ' THR . . . . . . . . . . . . . 77.6 m -63.18 -36.52 83.9 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.337 179.486 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 335' ' ' TYR . . . . . . . . . . . . . 87.9 t80 -66.92 -33.21 75.1 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.311 179.435 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 336' ' ' GLN . . . . . . . . . . . . . 47.4 tt0 -68.58 -49.7 57.38 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.84 -0.618 . . . . 0.0 110.66 179.815 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 337' ' ' LYS . . . . . 0.524 ' O ' ' HG2' ' B' ' 340' ' ' ARG . 39.1 ttpt -62.83 -36.89 84.69 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.068 179.955 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 338' ' ' GLU . . . . . . . . . . . . . 18.9 mm-40 -71.15 -32.53 69.07 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.974 0.416 . . . . 0.0 110.238 179.345 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 339' ' ' GLN . . . . . . . . . . . . . 58.4 tt0 -72.24 -43.3 64.59 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.798 -0.637 . . . . 0.0 110.736 179.512 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 340' ' ' ARG . . . . . 0.569 ' HG3' ' N ' ' B' ' 341' ' ' ASN . 36.3 ptt180 -63.74 -53.64 47.84 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 121.015 0.436 . . . . 0.0 110.772 179.933 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 341' ' ' ASN . . . . . 0.569 ' N ' ' HG3' ' B' ' 340' ' ' ARG . 51.1 t-20 -55.8 -51.98 65.58 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.677 -0.692 . . . . 0.0 110.837 179.502 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 342' ' ' ALA . . . . . . . . . . . . . . . -58.73 -32.76 69.51 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.015 179.897 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 343' ' ' LYS . . . . . . . . . . . . . 62.5 tttm -70.53 -38.28 74.19 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.948 179.882 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 344' ' ' GLU . . . . . . . . . . . . . 20.8 mm-40 -78.29 -22.75 47.76 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.056 -179.899 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 345' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.33 -0.274 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.095 -179.967 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' B' B ' 351' ' ' PRO . . . . . . . . . . . . . 50.1 Cg_exo . . . . . 0 C--O 1.231 0.142 0 CA-C-O 120.744 0.227 . . . . 0.0 112.529 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' B' B ' 352' ' ' ALA . . . . . . . . . . . . . . . -68.83 -54.34 16.31 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.838 179.838 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 353' ' ' LEU . . . . . 0.446 ' HG ' ' HG2' ' B' ' 357' ' ' GLU . 7.7 mp -107.42 131.23 54.5 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.989 -0.55 . . . . 0.0 111.068 179.972 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 354' ' ' THR . . . . . 0.401 ' H ' ' HB2' ' B' ' 357' ' ' GLU . 71.2 p -113.64 -177.39 3.12 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.64 179.601 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 355' ' ' GLU . . . . . . . . . . . . . 48.0 mt-10 -56.53 -35.79 68.48 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.953 0.406 . . . . 0.0 110.669 179.823 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 356' ' ' GLN . . . . . . . . . . . . . 86.2 mm-40 -74.28 -34.2 63.47 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.824 -0.625 . . . . 0.0 111.217 -179.907 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 357' ' ' GLU . . . . . 0.446 ' HG2' ' HG ' ' B' ' 353' ' ' LEU . 5.2 tp10 -63.71 -47.81 79.62 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.865 0.365 . . . . 0.0 110.513 -179.966 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 358' ' ' VAL . . . . . 0.485 ' O ' HG23 ' B' ' 362' ' ' VAL . 93.7 t -67.52 -55.31 17.66 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.334 -179.933 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 359' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER -53.34 -37.81 62.68 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.575 0.226 . . . . 0.0 111.29 -179.332 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 360' ' ' ALA . . . . . . . . . . . . . . . -67.12 -60.8 2.31 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.589 -0.278 . . . . 0.0 111.396 -179.784 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 361' ' ' GLN . . . . . . . . . . . . . 97.2 mt-30 -52.96 -45.44 67.76 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.341 -0.39 . . . . 0.0 110.81 179.918 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 362' ' ' VAL . . . . . 0.485 HG23 ' O ' ' B' ' 358' ' ' VAL . 99.1 t -62.02 -38.75 81.55 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.224 -0.443 . . . . 0.0 110.386 179.371 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 363' ' ' ALA . . . . . . . . . . . . . . . -65.97 -28.05 68.61 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.503 179.484 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 364' ' ' ARG . . . . . . . . . . . . . 61.1 ttp180 -84.63 -26.98 27.47 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.905 -0.588 . . . . 0.0 110.544 179.5 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 365' ' ' LEU . . . . . 0.405 HD21 ' HB3' ' B' ' 327' ' ' ALA . 1.2 mp -61.99 -37.43 84.78 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.022 -0.536 . . . . 0.0 110.675 179.758 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 366' ' ' PHE . . . . . . . . . . . . . 20.2 m-85 -117.09 156.91 26.77 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.922 -179.622 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 367' ' ' LYS . . . . . . . . . . . . . 63.4 tttp -123.36 -73.83 0.63 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.736 179.885 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 368' ' ' ASN . . . . . . . . . . . . . 27.7 t-20 -72.69 -18.05 61.58 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.554 179.789 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 369' ' ' GLN . . . . . . . . . . . . . 23.7 mp0 -94.71 86.99 4.9 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.846 179.937 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 370' ' ' GLU . . . . . . . . . . . . . 42.8 tt0 -93.69 -14.75 26.0 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.609 179.89 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 371' ' ' ASP . . . . . . . . . . . . . 18.5 t70 -55.69 -37.73 68.73 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.914 -0.585 . . . . 0.0 110.864 179.899 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 372' ' ' LEU . . . . . 0.4 ' H ' HD12 ' B' ' 372' ' ' LEU . 6.4 mp -67.06 -38.63 86.13 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.117 179.891 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 373' ' ' LEU . . . . . . . . . . . . . 27.3 mt -64.31 -44.27 92.1 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.404 -0.362 . . . . 0.0 110.926 -179.777 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 374' ' ' SER . . . . . . . . . . . . . 59.2 m -65.79 -55.0 19.5 Favored 'General case' 0 C--O 1.236 0.352 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.507 179.649 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 375' ' ' GLU . . . . . 0.447 ' HG3' ' NZ ' ' B' ' 313' ' ' LYS . 20.6 mm-40 -52.78 -38.55 61.25 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.993 -0.548 . . . . 0.0 110.075 179.409 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 376' ' ' PHE . . . . . . . . . . . . . 91.0 t80 -66.42 -41.67 88.89 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.026 179.268 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 377' ' ' GLY . . . . . . . . . . . . . . . -55.62 -35.84 63.25 Favored Glycine 0 N--CA 1.448 -0.503 0 C-N-CA 120.621 -0.8 . . . . 0.0 111.269 179.103 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 378' ' ' GLN . . . . . . . . . . . . . 18.8 mm-40 -56.99 -34.84 68.52 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.928 0.394 . . . . 0.0 110.421 179.01 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 379' ' ' PHE . . . . . . . . . . . . . 89.6 m-85 -74.31 -38.49 63.31 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.031 -0.532 . . . . 0.0 110.712 179.566 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 380' ' ' LEU . . . . . . . . . . . . . 10.9 tp -45.31 115.0 2.45 Favored Pre-proline 0 C--N 1.331 -0.231 0 CA-C-N 115.861 -0.609 . . . . 0.0 111.037 -179.475 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 381' ' ' PRO . . . . . . . . . . . . . 99.1 Cg_exo . . . . . 0 C--N 1.35 0.645 0 C-N-CA 122.704 2.269 . . . . 0.0 112.628 -179.777 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 366' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.231 0.107 0 CA-C-O 120.915 0.388 . . . . 0.0 110.993 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 367' ' ' VAL . . . . . . . . . . . . . 14.8 t -65.49 -22.09 30.34 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.868 -179.89 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 368' ' ' TYR . . . . . . . . . . . . . 61.5 t80 -65.14 -53.55 43.39 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.025 179.993 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 369' ' ' VAL . . . . . 0.4 HG23 ' N ' ' A' ' 370' ' ' LEU . 17.4 m -70.96 -45.23 74.03 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-N 116.457 -0.338 . . . . 0.0 111.093 179.881 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 370' ' ' LEU . . . . . 0.4 ' N ' HG23 ' A' ' 369' ' ' VAL . 98.9 mt -56.43 -37.97 70.94 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.386 -0.37 . . . . 0.0 110.739 179.762 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 371' ' ' SER . . . . . . . . . . . . . 83.1 p -70.51 -60.66 2.13 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.148 -179.994 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 372' ' ' SER . . . . . . . . . . . . . 79.3 p -52.56 -33.22 44.85 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.508 -0.315 . . . . 0.0 111.814 -179.28 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 373' ' ' MET . . . . . . . . . . . . . 95.8 mtp -74.4 -45.89 43.82 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 111.701 0.26 . . . . 0.0 111.701 -179.318 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 374' ' ' ALA . . . . . . . . . . . . . . . -84.48 -6.58 59.39 Favored 'General case' 0 C--N 1.331 -0.234 0 N-CA-C 112.339 0.496 . . . . 0.0 112.339 -179.217 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 375' ' ' ARG . . . . . 0.471 ' HA ' ' HE ' ' A' ' 375' ' ' ARG . 2.6 mmp_? -106.32 -27.51 10.95 Favored 'General case' 0 C--N 1.33 -0.276 0 N-CA-C 111.64 0.237 . . . . 0.0 111.64 -179.296 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 376' ' ' GLN . . . . . . . . . . . . . 34.9 tt0 . . . . . 0 C--N 1.333 -0.14 0 CA-C-O 120.702 0.287 . . . . 0.0 111.065 -179.8 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' B' B ' 302' ' ' VAL . . . . . . . . . . . . . 22.1 m . . . . . 0 C--O 1.23 0.077 0 CA-C-O 121.06 0.457 . . . . 0.0 111.29 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' B' B ' 303' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -56.7 -68.76 0.19 Allowed 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.665 -0.698 . . . . 0.0 111.805 -178.859 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 304' ' ' PHE . . . . . 0.57 ' HA ' HD13 ' B' ' 308' ' ' ILE . 77.5 t80 -50.0 -63.58 1.07 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.867 -179.257 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 305' ' ' ASN . . . . . . . . . . . . . 53.9 t30 -46.57 -63.58 0.98 Allowed 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 112.355 0.502 . . . . 0.0 112.355 -178.803 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 306' ' ' HIS . . . . . . . . . . . . . 12.7 m-70 -55.23 -68.71 0.17 Allowed 'General case' 0 C--N 1.33 -0.266 0 N-CA-C 112.765 0.654 . . . . 0.0 112.765 -178.661 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 307' ' ' ALA . . . . . . . . . . . . . . . -48.68 -61.97 1.75 Allowed 'General case' 0 CA--C 1.532 0.254 0 N-CA-C 112.903 0.705 . . . . 0.0 112.903 -178.304 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 308' ' ' ILE . . . . . 0.57 HD13 ' HA ' ' B' ' 304' ' ' PHE . 1.8 mp -52.48 -61.22 0.82 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 N-CA-C 112.221 0.452 . . . . 0.0 112.221 -179.04 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 309' ' ' ASN . . . . . . . . . . . . . 54.0 t30 -55.4 -27.24 46.47 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.725 0.298 . . . . 0.0 111.518 -179.256 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 310' ' ' TYR . . . . . . . . . . . . . 82.3 t80 -68.02 -57.25 6.46 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.369 -0.378 . . . . 0.0 111.225 -179.726 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 311' ' ' VAL . . . . . . . . . . . . . 27.8 t -58.17 -44.77 88.38 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.163 0 CA-C-N 116.367 -0.379 . . . . 0.0 110.705 -179.969 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 312' ' ' ASN . . . . . . . . . . . . . 34.8 t30 -61.65 -37.15 82.96 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.13 -0.487 . . . . 0.0 110.628 179.722 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 313' ' ' LYS . . . . . . . . . . . . . 28.0 tttp -60.11 -57.11 14.25 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.963 179.827 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 314' ' ' ILE . . . . . . . . . . . . . 58.7 mt -67.51 -23.37 29.81 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.412 -179.619 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 315' ' ' LYS . . . . . . . . . . . . . 1.3 tmmt? -73.24 -36.58 66.45 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.318 -0.401 . . . . 0.0 111.142 -179.727 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 316' ' ' ASN . . . . . . . . . . . . . 24.0 t-20 -86.59 -43.19 12.87 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.412 -0.358 . . . . 0.0 111.469 -179.547 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 317' ' ' ARG . . . . . 0.43 ' HA ' ' HE ' ' B' ' 317' ' ' ARG . 5.7 tpm_? -64.02 -65.82 0.63 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.383 -0.371 . . . . 0.0 111.188 -179.779 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 318' ' ' PHE . . . . . . . . . . . . . 68.1 m-85 -81.62 31.59 0.35 Allowed 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.433 -179.639 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 319' ' ' GLN . . . . . . . . . . . . . 50.1 tt0 -68.69 -15.6 63.57 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.7 179.886 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 320' ' ' GLY . . . . . . . . . . . . . . . -74.53 -48.25 13.98 Favored Glycine 0 N--CA 1.452 -0.297 0 C-N-CA 120.888 -0.672 . . . . 0.0 112.604 179.964 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 321' ' ' GLN . . . . . . . . . . . . . 6.0 tp-100 -100.92 100.94 14.06 Favored Pre-proline 0 C--N 1.33 -0.242 0 CA-C-N 116.579 0.19 . . . . 0.0 110.754 179.878 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 322' ' ' PRO . . . . . . . . . . . . . 33.6 Cg_endo -64.58 -24.71 62.83 Favored 'Trans proline' 0 C--N 1.349 0.6 0 C-N-CA 122.495 2.13 . . . . 0.0 112.525 -179.914 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 323' ' ' ASP . . . . . . . . . . . . . 8.0 m-20 -62.79 -37.07 85.23 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.059 -179.741 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 324' ' ' ILE . . . . . . . . . . . . . 48.8 mm -68.85 -61.0 1.87 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.374 -0.376 . . . . 0.0 111.039 -179.882 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 325' ' ' TYR . . . . . . . . . . . . . 23.2 t80 -51.75 -51.86 53.08 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.911 -0.586 . . . . 0.0 111.013 -179.938 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 326' ' ' LYS . . . . . . . . . . . . . 63.0 tttm -58.3 -46.02 86.89 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.145 -179.844 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 327' ' ' ALA . . . . . . . . . . . . . . . -52.23 -55.28 22.26 Favored 'General case' 0 C--O 1.233 0.237 0 CA-C-O 120.875 0.369 . . . . 0.0 111.078 -179.986 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 328' ' ' PHE . . . . . . . . . . . . . 60.6 t80 -54.05 -45.17 71.59 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.473 179.77 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 329' ' ' LEU . . . . . . . . . . . . . 73.4 mt -59.44 -35.16 73.51 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.737 179.569 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 330' ' ' GLU . . . . . . . . . . . . . 47.1 mt-10 -67.69 -37.1 81.82 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.446 179.653 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 331' ' ' ILE . . . . . . . . . . . . . 70.8 mt -63.69 -53.5 43.97 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.596 179.376 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 332' ' ' LEU . . . . . . . . . . . . . 8.4 mp -63.02 -35.42 80.17 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.838 179.732 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 333' ' ' HIS . . . . . . . . . . . . . 45.6 t60 -62.27 -52.9 61.89 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.905 0.384 . . . . 0.0 110.005 179.442 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 334' ' ' THR . . . . . 0.43 HG22 HD13 ' B' ' 353' ' ' LEU . 58.8 m -60.1 -32.07 70.64 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.984 -0.553 . . . . 0.0 109.886 179.004 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 335' ' ' TYR . . . . . . . . . . . . . 57.3 t80 -63.88 -38.66 91.9 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.641 -0.709 . . . . 0.0 109.879 179.273 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 336' ' ' GLN . . . . . . . . . . . . . 3.4 tt0 -66.35 -48.99 68.44 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.689 -0.687 . . . . 0.0 110.42 179.529 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 337' ' ' LYS . . . . . . . . . . . . . 38.6 ttpt -56.09 -50.62 70.52 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.807 -0.633 . . . . 0.0 111.018 179.987 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 338' ' ' GLU . . . . . . . . . . . . . 38.3 mm-40 -63.36 -35.67 81.16 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.139 -179.819 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 339' ' ' GLN . . . . . . . . . . . . . 23.3 tp60 -65.38 -45.65 83.22 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.719 179.936 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 340' ' ' ARG . . . . . . . . . . . . . 80.3 mtp180 -60.84 -50.53 73.07 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.604 179.705 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 341' ' ' ASN . . . . . . . . . . . . . 81.8 m-20 -54.9 -44.13 73.86 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.7 179.685 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 342' ' ' ALA . . . . . . . . . . . . . . . -64.76 -33.04 75.04 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.815 179.704 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 343' ' ' LYS . . . . . . . . . . . . . 39.5 ttpt -71.52 -40.07 70.33 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.862 179.799 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 344' ' ' GLU . . . . . . . . . . . . . 13.3 mm-40 -69.29 -33.56 73.38 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.906 179.993 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 345' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.286 0 CA-C-N 116.165 -0.471 . . . . 0.0 111.021 179.922 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' B' B ' 351' ' ' PRO . . . . . . . . . . . . . 57.7 Cg_exo . . . . . 0 CA--C 1.526 0.084 0 CA-C-O 120.814 0.256 . . . . 0.0 112.258 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' B' B ' 352' ' ' ALA . . . . . . . . . . . . . . . -59.78 -44.05 94.09 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.256 -179.796 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 353' ' ' LEU . . . . . 0.434 ' HG ' ' HG2' ' B' ' 357' ' ' GLU . 6.3 mp -112.02 120.16 40.92 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 120.998 0.428 . . . . 0.0 111.28 179.879 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 354' ' ' THR . . . . . . . . . . . . . 56.2 p -113.06 -164.18 0.9 Allowed 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.802 -0.635 . . . . 0.0 110.369 179.422 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 355' ' ' GLU . . . . . 0.402 ' H ' ' CD ' ' B' ' 355' ' ' GLU . 2.0 mp0 -61.29 -38.09 85.53 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 121.025 0.441 . . . . 0.0 110.368 179.681 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 356' ' ' GLN . . . . . . . . . . . . . 91.6 mt-30 -72.75 -40.91 65.65 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 115.868 -0.605 . . . . 0.0 111.317 -179.852 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 357' ' ' GLU . . . . . 0.434 ' HG2' ' HG ' ' B' ' 353' ' ' LEU . 4.8 tp10 -59.49 -53.1 62.02 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-O 120.785 0.326 . . . . 0.0 110.702 -179.793 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 358' ' ' VAL . . . . . 0.514 ' O ' HG23 ' B' ' 362' ' ' VAL . 49.9 t -61.82 -54.87 28.81 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.205 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.973 179.928 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 359' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER -52.28 -37.25 55.06 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.566 -0.288 . . . . 0.0 110.938 -179.524 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 360' ' ' ALA . . . . . . . . . . . . . . . -65.08 -58.64 5.53 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.43 -0.35 . . . . 0.0 111.411 -179.826 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 361' ' ' GLN . . . . . . . . . . . . . 52.4 mt-30 -55.83 -38.71 70.38 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.897 -179.889 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 362' ' ' VAL . . . . . 0.514 HG23 ' O ' ' B' ' 358' ' ' VAL . 60.4 t -71.01 -34.01 53.82 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.291 179.581 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 363' ' ' ALA . . . . . 0.547 ' HA ' HD21 ' B' ' 373' ' ' LEU . . . -64.2 -36.23 83.38 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.266 179.356 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 364' ' ' ARG . . . . . . . . . . . . . 58.9 mtp180 -87.18 -20.32 27.16 Favored 'General case' 0 N--CA 1.453 -0.286 0 CA-C-N 115.806 -0.634 . . . . 0.0 110.2 179.251 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 365' ' ' LEU . . . . . . . . . . . . . 23.6 tp -60.3 -21.11 61.58 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 115.824 -0.626 . . . . 0.0 109.916 179.239 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 366' ' ' PHE . . . . . . . . . . . . . 44.8 m-85 -131.13 -174.54 3.42 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.527 -0.76 . . . . 0.0 109.925 179.391 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 367' ' ' LYS . . . . . . . . . . . . . 66.5 mttm -133.89 -80.37 0.46 Allowed 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.745 0.307 . . . . 0.0 111.214 -179.943 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 368' ' ' ASN . . . . . . . . . . . . . 3.0 p-10 -90.18 8.83 30.98 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.955 -179.854 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 369' ' ' GLN . . . . . 0.439 ' HB3' HD13 ' B' ' 372' ' ' LEU . 73.7 mm-40 -91.49 84.51 5.55 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.869 179.832 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 370' ' ' GLU . . . . . . . . . . . . . 2.2 mp0 -89.92 -11.43 41.82 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.535 -0.302 . . . . 0.0 110.653 179.749 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 371' ' ' ASP . . . . . . . . . . . . . 5.3 m-20 -63.67 -46.89 83.49 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.468 179.629 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 372' ' ' LEU . . . . . 0.439 HD13 ' HB3' ' B' ' 369' ' ' GLN . 6.3 mp -68.17 -45.81 72.44 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.553 179.477 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 373' ' ' LEU . . . . . 0.547 HD21 ' HA ' ' B' ' 363' ' ' ALA . 1.1 mp -59.08 -33.58 70.98 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.739 -0.664 . . . . 0.0 111.046 -179.898 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 374' ' ' SER . . . . . . . . . . . . . 47.7 t -74.16 -57.51 3.91 Favored 'General case' 0 C--O 1.236 0.344 0 CA-C-O 120.949 0.404 . . . . 0.0 110.673 179.794 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 375' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -54.35 -32.81 57.71 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.133 179.505 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 376' ' ' PHE . . . . . 0.465 ' O ' ' HB2' ' B' ' 379' ' ' PHE . 66.9 t80 -79.6 -31.36 41.71 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.02 179.196 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 377' ' ' GLY . . . . . . . . . . . . . . . -61.71 -33.17 84.2 Favored Glycine 0 N--CA 1.448 -0.532 0 C-N-CA 120.593 -0.813 . . . . 0.0 111.236 179.12 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 378' ' ' GLN . . . . . . . . . . . . . 90.8 mt-30 -69.53 -26.73 64.66 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.753 0.311 . . . . 0.0 110.884 179.303 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 379' ' ' PHE . . . . . 0.465 ' HB2' ' O ' ' B' ' 376' ' ' PHE . 12.9 m-85 -61.67 -38.22 86.95 Favored 'General case' 0 C--N 1.333 -0.14 0 CA-C-N 116.277 -0.419 . . . . 0.0 111.298 -179.9 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 380' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -53.22 141.43 41.09 Favored Pre-proline 0 C--N 1.331 -0.213 0 CA-C-N 116.523 -0.308 . . . . 0.0 110.62 -179.966 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 381' ' ' PRO . . . . . . . . . . . . . 39.6 Cg_endo . . . . . 0 C--N 1.346 0.405 0 C-N-CA 122.404 2.069 . . . . 0.0 112.164 -179.817 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 366' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.235 0.305 0 CA-C-O 121.326 0.584 . . . . 0.0 110.355 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 367' ' ' VAL . . . . . . . . . . . . . 35.2 m -62.16 -16.59 16.32 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 115.608 -0.724 . . . . 0.0 110.414 179.376 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 368' ' ' TYR . . . . . . . . . . . . . 66.9 t80 -71.39 -56.84 5.17 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.54 179.743 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 369' ' ' VAL . . . . . 0.586 HG11 ' HB3' ' B' ' 332' ' ' LEU . 3.4 p -61.21 -44.53 98.54 Favored 'Isoleucine or valine' 0 C--O 1.232 0.147 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.455 179.533 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 370' ' ' LEU . . . . . . . . . . . . . 91.9 mt -64.0 -36.49 84.16 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.71 179.821 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 371' ' ' SER . . . . . 0.545 ' HA ' ' HB3' ' B' ' 303' ' ' GLU . 29.9 t -60.85 -61.44 2.58 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.896 179.772 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 372' ' ' SER . . . . . 0.407 ' O ' ' HG3' ' A' ' 376' ' ' GLN . 79.3 p -57.43 -33.07 67.53 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.991 -179.783 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 373' ' ' MET . . . . . . . . . . . . . 52.3 ttm -58.93 -56.96 15.5 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.365 -179.804 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 374' ' ' ALA . . . . . 0.506 ' HB3' ' OE1' ' B' ' 303' ' ' GLU . . . -84.23 -6.92 59.46 Favored 'General case' 0 C--N 1.33 -0.246 0 N-CA-C 112.016 0.376 . . . . 0.0 112.016 -179.379 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 375' ' ' ARG . . . . . . . . . . . . . 21.2 tpp180 -80.97 -40.86 23.72 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.734 0.302 . . . . 0.0 110.753 179.94 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 376' ' ' GLN . . . . . 0.407 ' HG3' ' O ' ' A' ' 372' ' ' SER . 56.6 mt-30 . . . . . 0 C--N 1.331 -0.196 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.882 179.843 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 302' ' ' VAL . . . . . 0.457 HG13 ' N ' ' B' ' 303' ' ' GLU . 4.2 p . . . . . 0 C--O 1.231 0.122 0 CA-C-O 120.84 0.352 . . . . 0.0 111.278 . . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 303' ' ' GLU . . . . . 0.545 ' HB3' ' HA ' ' A' ' 371' ' ' SER . 72.7 mm-40 -67.32 -40.17 85.94 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.092 -0.504 . . . . 0.0 111.815 -179.314 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 304' ' ' PHE . . . . . . . . . . . . . 83.8 m-85 -58.85 -62.06 2.16 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.416 -179.482 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 305' ' ' ASN . . . . . . . . . . . . . 47.4 t-20 -59.59 -43.14 93.78 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.845 -179.228 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 306' ' ' HIS . . . . . . . . . . . . . 7.0 t-160 -61.29 -65.4 0.7 Allowed 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 111.881 0.326 . . . . 0.0 111.881 -179.063 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 307' ' ' ALA . . . . . . . . . . . . . . . -54.23 -43.86 71.23 Favored 'General case' 0 C--N 1.33 -0.242 0 N-CA-C 112.147 0.425 . . . . 0.0 112.147 -179.036 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 308' ' ' ILE . . . . . . . . . . . . . 62.7 mt -58.87 -54.75 29.48 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-O 120.676 0.274 . . . . 0.0 111.393 -179.735 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 309' ' ' ASN . . . . . . . . . . . . . 4.9 m-20 -58.47 -30.88 67.32 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.835 0.35 . . . . 0.0 111.041 -179.962 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 310' ' ' TYR . . . . . 0.421 ' O ' ' HG3' ' B' ' 313' ' ' LYS . 24.0 t80 -65.38 -62.3 1.61 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.83 179.967 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 311' ' ' VAL . . . . . . . . . . . . . 56.4 t -61.3 -23.37 30.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.975 179.94 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 312' ' ' ASN . . . . . . . . . . . . . 27.2 t-20 -69.45 -56.72 6.6 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.486 -179.6 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 313' ' ' LYS . . . . . 0.421 ' HG3' ' O ' ' B' ' 310' ' ' TYR . 0.0 OUTLIER -64.69 -33.45 75.97 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.362 -0.381 . . . . 0.0 111.372 -179.381 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 314' ' ' ILE . . . . . . . . . . . . . 79.3 mt -72.22 -36.92 57.49 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-O 120.755 0.312 . . . . 0.0 111.278 179.774 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 315' ' ' LYS . . . . . . . . . . . . . 25.8 ttpp -67.93 -45.76 73.38 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.37 -0.377 . . . . 0.0 111.095 -179.761 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 316' ' ' ASN . . . . . . . . . . . . . 52.1 t-20 -68.58 -48.74 63.43 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.187 -0.461 . . . . 0.0 111.317 -179.625 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 317' ' ' ARG . . . . . . . . . . . . . 49.5 ttt180 -59.48 -64.2 1.03 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.481 -179.474 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 318' ' ' PHE . . . . . . . . . . . . . 96.8 m-85 -84.38 33.08 0.5 Allowed 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.323 -179.59 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 319' ' ' GLN . . . . . . . . . . . . . 7.1 tp60 -64.87 -20.16 66.28 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.416 -0.356 . . . . 0.0 110.702 179.795 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 320' ' ' GLY . . . . . . . . . . . . . . . -85.72 -21.15 54.45 Favored Glycine 0 C--N 1.33 0.213 0 C-N-CA 120.858 -0.687 . . . . 0.0 112.626 179.936 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 321' ' ' GLN . . . . . . . . . . . . . 29.6 mm-40 -106.87 96.45 14.71 Favored Pre-proline 0 C--N 1.33 -0.261 0 CA-C-O 120.539 0.209 . . . . 0.0 110.809 179.91 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 322' ' ' PRO . . . . . . . . . . . . . 86.7 Cg_endo -78.4 -28.46 4.51 Favored 'Trans proline' 0 C--N 1.348 0.537 0 C-N-CA 122.417 2.078 . . . . 0.0 112.72 -179.817 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 323' ' ' ASP . . . . . . . . . . . . . 31.3 m-20 -65.29 -48.01 74.64 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.354 -0.384 . . . . 0.0 111.103 -179.725 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 324' ' ' ILE . . . . . . . . . . . . . 71.6 mt -66.2 -47.25 85.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.236 -179.962 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 325' ' ' TYR . . . . . 0.404 ' CE2' HD11 ' B' ' 329' ' ' LEU . 41.1 t80 -55.82 -57.73 10.8 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.982 -179.989 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 326' ' ' LYS . . . . . 0.476 ' O ' ' HG3' ' B' ' 330' ' ' GLU . 98.5 mttt -55.53 -48.85 74.04 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.046 -0.524 . . . . 0.0 111.259 -179.898 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 327' ' ' ALA . . . . . . . . . . . . . . . -49.08 -51.67 30.22 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.372 -0.377 . . . . 0.0 111.231 -179.922 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 328' ' ' PHE . . . . . . . . . . . . . 84.1 t80 -56.33 -46.03 80.07 Favored 'General case' 0 C--O 1.235 0.324 0 CA-C-N 116.191 -0.459 . . . . 0.0 109.975 179.316 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 329' ' ' LEU . . . . . 0.404 HD11 ' CE2' ' B' ' 325' ' ' TYR . 83.5 mt -58.71 -31.22 68.06 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 115.711 -0.677 . . . . 0.0 110.186 179.042 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 330' ' ' GLU . . . . . 0.476 ' HG3' ' O ' ' B' ' 326' ' ' LYS . 38.8 mt-10 -71.73 -36.05 70.36 Favored 'General case' 0 C--N 1.333 -0.13 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.679 179.65 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 331' ' ' ILE . . . . . . . . . . . . . 61.5 mt -65.48 -47.8 85.32 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.152 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.872 179.881 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 332' ' ' LEU . . . . . 0.586 ' HB3' HG11 ' A' ' 369' ' ' VAL . 14.0 mt -67.36 -37.82 83.8 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.412 -0.358 . . . . 0.0 110.899 179.97 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 333' ' ' HIS . . . . . . . . . . . . . 48.4 t-80 -61.29 -57.89 10.52 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.649 179.635 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 334' ' ' THR . . . . . 0.448 HG22 HD13 ' B' ' 353' ' ' LEU . 86.3 m -59.56 -35.17 73.73 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.915 -0.584 . . . . 0.0 111.005 179.842 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 335' ' ' TYR . . . . . . . . . . . . . 83.4 t80 -61.1 -60.35 3.9 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.902 -179.935 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 336' ' ' GLN . . . . . . . . . . . . . 6.5 tp60 -56.98 -33.62 67.28 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.715 -179.856 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 337' ' ' LYS . . . . . . . . . . . . . 23.9 ttmm -59.02 -54.27 48.97 Favored 'General case' 0 C--O 1.234 0.251 0 CA-C-O 120.971 0.415 . . . . 0.0 110.528 179.296 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 338' ' ' GLU . . . . . . . . . . . . . 26.2 mm-40 -60.05 -33.69 72.39 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.296 179.468 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 339' ' ' GLN . . . . . . . . . . . . . 57.7 tp60 -64.1 -43.5 95.17 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.464 179.549 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 340' ' ' ARG . . . . . . . . . . . . . 94.7 mtt180 -61.83 -53.89 49.67 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.597 179.68 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 341' ' ' ASN . . . . . . . . . . . . . 47.9 t-20 -57.6 -33.05 67.8 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.507 179.696 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 342' ' ' ALA . . . . . . . . . . . . . . . -65.91 -43.28 88.62 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.937 -0.574 . . . . 0.0 111.023 179.917 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 343' ' ' LYS . . . . . . . . . . . . . 88.2 tttt -66.93 -39.79 87.42 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.839 179.965 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 344' ' ' GLU . . . . . . . . . . . . . 12.6 mm-40 -69.54 -31.79 70.21 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.898 -179.978 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 345' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.285 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.243 -179.878 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' B' B ' 351' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_exo . . . . . 0 C--O 1.231 0.161 0 CA-C-O 120.902 0.293 . . . . 0.0 112.057 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' B' B ' 352' ' ' ALA . . . . . . . . . . . . . . . -64.32 -58.99 4.92 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.11 -0.495 . . . . 0.0 111.562 -179.485 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 353' ' ' LEU . . . . . 0.448 HD13 HG22 ' B' ' 334' ' ' THR . 6.7 mp -101.12 128.93 46.97 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.923 0.392 . . . . 0.0 111.535 -179.536 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 354' ' ' THR . . . . . . . . . . . . . 61.6 p -113.1 -173.9 2.35 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.528 179.429 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 355' ' ' GLU . . . . . . . . . . . . . 31.2 mt-10 -58.59 -35.2 72.04 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.992 0.425 . . . . 0.0 110.578 179.783 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 356' ' ' GLN . . . . . . . . . . . . . 52.0 tt0 -73.86 -37.91 64.63 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.887 -0.597 . . . . 0.0 111.01 -179.881 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 357' ' ' GLU . . . . . 0.436 ' HG2' ' HG ' ' B' ' 353' ' ' LEU . 6.9 tp10 -62.5 -45.83 91.23 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-O 120.925 0.393 . . . . 0.0 110.575 179.998 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 358' ' ' VAL . . . . . 0.52 ' O ' HG23 ' B' ' 362' ' ' VAL . 70.5 t -66.76 -58.19 7.36 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.02 -0.536 . . . . 0.0 111.114 179.933 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 359' ' ' TYR . . . . . . . . . . . . . 40.3 t80 -52.09 -32.43 34.9 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.611 -0.268 . . . . 0.0 111.087 -179.626 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 360' ' ' ALA . . . . . . . . . . . . . . . -68.91 -56.51 7.66 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.412 -0.358 . . . . 0.0 111.043 179.868 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 361' ' ' GLN . . . . . . . . . . . . . 53.4 mt-30 -57.01 -44.35 82.74 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.73 179.872 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 362' ' ' VAL . . . . . 0.52 HG23 ' O ' ' B' ' 358' ' ' VAL . 45.2 t -65.56 -32.96 60.49 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.524 179.84 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 363' ' ' ALA . . . . . 0.693 ' HA ' HD21 ' B' ' 373' ' ' LEU . . . -62.48 -51.67 66.53 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.722 179.645 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 364' ' ' ARG . . . . . . . . . . . . . 96.7 mtt180 -75.1 -18.38 60.27 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.625 179.58 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 365' ' ' LEU . . . . . . . . . . . . . 7.2 tp -59.66 -31.91 69.98 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.731 179.894 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 366' ' ' PHE . . . . . . . . . . . . . 58.4 m-85 -118.16 173.32 6.86 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.57 179.8 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 367' ' ' LYS . . . . . . . . . . . . . 47.3 mmtm -129.25 -78.16 0.55 Allowed 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.754 0.312 . . . . 0.0 111.373 -179.775 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 368' ' ' ASN . . . . . . . . . . . . . 7.5 t30 -82.95 -10.17 58.93 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.142 -179.65 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 369' ' ' GLN . . . . . . . . . . . . . 19.5 mp0 -94.2 87.59 5.31 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.411 -0.359 . . . . 0.0 111.143 -179.784 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 370' ' ' GLU . . . . . . . . . . . . . 44.0 mt-10 -94.45 -10.59 31.89 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.726 179.516 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 371' ' ' ASP . . . . . . . . . . . . . 13.8 t70 -58.48 -38.05 76.81 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.429 179.674 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 372' ' ' LEU . . . . . 0.45 ' H ' HD12 ' B' ' 372' ' ' LEU . 6.0 mp -70.12 -39.2 75.6 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.905 -0.588 . . . . 0.0 110.49 179.316 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 373' ' ' LEU . . . . . 0.693 HD21 ' HA ' ' B' ' 363' ' ' ALA . 1.4 mp -65.73 -36.27 83.12 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.582 -0.735 . . . . 0.0 111.305 -179.702 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 374' ' ' SER . . . . . . . . . . . . . 87.8 p -71.72 -51.18 24.16 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.883 0.373 . . . . 0.0 110.287 179.663 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 375' ' ' GLU . . . . . . . . . . . . . 11.1 mm-40 -58.33 -33.38 69.45 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.263 179.347 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 376' ' ' PHE . . . . . 0.436 ' HA ' ' HB2' ' B' ' 379' ' ' PHE . 64.6 t80 -80.8 -29.7 36.0 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.151 179.373 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 377' ' ' GLY . . . . . . . . . . . . . . . -62.84 -40.13 98.87 Favored Glycine 0 N--CA 1.45 -0.412 0 C-N-CA 120.715 -0.755 . . . . 0.0 111.388 179.267 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 378' ' ' GLN . . . . . . . . . . . . . 12.9 mm100 -78.04 -16.89 57.68 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.053 0.454 . . . . 0.0 110.093 179.074 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 379' ' ' PHE . . . . . 0.436 ' HB2' ' HA ' ' B' ' 376' ' ' PHE . 0.2 OUTLIER -68.31 -42.3 79.61 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.714 -0.675 . . . . 0.0 110.622 179.803 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 380' ' ' LEU . . . . . . . . . . . . . 64.0 mt -56.82 147.32 53.74 Favored Pre-proline 0 C--N 1.33 -0.247 0 CA-C-N 116.013 -0.54 . . . . 0.0 110.866 -179.932 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 381' ' ' PRO . . . . . . . . . . . . . 70.9 Cg_exo . . . . . 0 C--N 1.347 0.497 0 C-N-CA 122.68 2.253 . . . . 0.0 112.554 -179.989 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 366' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.233 0.209 0 CA-C-O 120.786 0.327 . . . . 0.0 111.418 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 367' ' ' VAL . . . . . . . . . . . . . 20.6 m -60.36 -30.29 45.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.232 179.911 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 368' ' ' TYR . . . . . . . . . . . . . 37.1 t80 -75.87 -40.54 54.35 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.991 -179.76 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 369' ' ' VAL . . . . . 0.45 HG22 ' HB2' ' B' ' 336' ' ' GLN . 20.1 t -63.31 -43.56 98.69 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.162 -179.923 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 370' ' ' LEU . . . . . . . . . . . . . 96.5 mt -71.37 -47.14 58.14 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.018 179.93 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 371' ' ' SER . . . . . 0.474 ' HA ' ' HB2' ' B' ' 303' ' ' GLU . 79.7 p -58.92 -33.0 70.07 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.219 -179.859 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 372' ' ' SER . . . . . . . . . . . . . 79.1 p -76.82 -58.01 3.52 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.417 -0.356 . . . . 0.0 111.409 -179.475 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 373' ' ' MET . . . . . . . . . . . . . 20.4 ptm -55.59 -26.81 45.84 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.382 -0.372 . . . . 0.0 111.605 -179.451 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 374' ' ' ALA . . . . . . . . . . . . . . . -87.04 -44.04 11.87 Favored 'General case' 0 C--N 1.33 -0.271 0 N-CA-C 111.692 0.256 . . . . 0.0 111.692 -179.722 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 375' ' ' ARG . . . . . 0.658 ' HB2' ' HG2' ' B' ' 303' ' ' GLU . 21.4 tpp180 -64.89 -26.67 68.42 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.83 0.348 . . . . 0.0 110.753 -179.969 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 376' ' ' GLN . . . . . . . . . . . . . 15.1 mm100 . . . . . 0 C--N 1.329 -0.288 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.045 179.852 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' B' B ' 302' ' ' VAL . . . . . 0.52 HG23 ' H ' ' B' ' 303' ' ' GLU . 8.8 m . . . . . 0 C--O 1.231 0.12 0 CA-C-O 120.794 0.33 . . . . 0.0 111.752 . . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 303' ' ' GLU . . . . . 0.658 ' HG2' ' HB2' ' A' ' 375' ' ' ARG . 0.0 OUTLIER -72.26 -30.92 65.31 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.266 -0.425 . . . . 0.0 111.72 -179.273 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' B' B ' 304' ' ' PHE . . . . . 0.409 ' O ' HG12 ' B' ' 308' ' ' ILE . 84.7 t80 -72.65 -51.05 21.14 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.678 0.275 . . . . 0.0 110.915 -179.663 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 305' ' ' ASN . . . . . . . . . . . . . 60.6 t30 -64.46 -40.39 95.62 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.858 -179.975 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 306' ' ' HIS . . . . . . . . . . . . . 15.6 t-160 -66.8 -39.48 87.75 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.344 -0.389 . . . . 0.0 111.011 179.954 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 307' ' ' ALA . . . . . . . . . . . . . . . -67.09 -49.93 63.31 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.39 -0.368 . . . . 0.0 111.58 -179.712 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 308' ' ' ILE . . . . . 0.427 HG13 ' N ' ' B' ' 309' ' ' ASN . 47.6 pt -62.38 -38.41 81.16 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.221 0 CA-C-O 120.682 0.277 . . . . 0.0 111.204 -179.681 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 309' ' ' ASN . . . . . 0.427 ' N ' HG13 ' B' ' 308' ' ' ILE . 95.9 m-20 -70.41 -32.64 70.34 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.404 -0.362 . . . . 0.0 110.605 179.681 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 310' ' ' TYR . . . . . . . . . . . . . 49.3 t80 -67.07 -51.63 52.07 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.607 179.808 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 311' ' ' VAL . . . . . . . . . . . . . 97.8 t -60.27 -43.8 94.25 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.212 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.605 179.338 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 312' ' ' ASN . . . . . . . . . . . . . 49.4 t30 -64.37 -31.69 72.99 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.513 179.578 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 313' ' ' LYS . . . . . . . . . . . . . 20.6 tttp -65.04 -56.8 10.95 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.912 -0.586 . . . . 0.0 110.672 179.648 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 314' ' ' ILE . . . . . . . . . . . . . 30.3 mt -62.61 -28.87 45.65 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.777 -179.912 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 315' ' ' LYS . . . . . . . . . . . . . 22.1 ttmm -70.47 -36.75 74.07 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.74 179.726 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 316' ' ' ASN . . . . . . . . . . . . . 66.5 m-20 -82.23 -58.78 2.8 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.942 -0.572 . . . . 0.0 111.445 -179.8 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 317' ' ' ARG . . . . . . . . . . . . . 25.4 tpp180 -54.13 -64.4 0.84 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.096 179.988 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 318' ' ' PHE . . . . . . . . . . . . . 91.6 m-85 -86.71 42.8 1.03 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.97 179.896 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 319' ' ' GLN . . . . . . . . . . . . . 6.6 tp-100 -68.39 -22.57 64.63 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.821 179.904 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 320' ' ' GLY . . . . . . . . . . . . . . . -89.02 -15.77 58.76 Favored Glycine 0 N--CA 1.452 -0.291 0 C-N-CA 120.761 -0.733 . . . . 0.0 112.507 179.969 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 321' ' ' GLN . . . . . . . . . . . . . 24.3 mp0 -111.24 91.89 14.56 Favored Pre-proline 0 C--N 1.33 -0.267 0 CA-C-O 120.586 0.231 . . . . 0.0 110.958 -179.975 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 322' ' ' PRO . . . . . . . . . . . . . 96.7 Cg_endo -82.24 -18.28 7.37 Favored 'Trans proline' 0 C--N 1.348 0.513 0 C-N-CA 122.625 2.217 . . . . 0.0 112.392 179.875 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 323' ' ' ASP . . . . . . . . . . . . . 18.0 t70 -69.65 -50.58 42.76 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.701 -179.907 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 324' ' ' ILE . . . . . . . . . . . . . 56.3 mt -64.58 -43.86 96.76 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-N 116.081 -0.508 . . . . 0.0 110.85 179.857 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 325' ' ' TYR . . . . . 0.402 ' O ' ' HG ' ' B' ' 329' ' ' LEU . 25.8 t80 -59.61 -48.18 82.67 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.647 179.822 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 326' ' ' LYS . . . . . . . . . . . . . 60.6 tttm -60.05 -45.51 92.63 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.937 -179.972 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 327' ' ' ALA . . . . . . . . . . . . . . . -55.08 -50.47 69.08 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.123 179.944 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 328' ' ' PHE . . . . . . . . . . . . . 66.3 t80 -55.78 -49.33 73.45 Favored 'General case' 0 C--O 1.234 0.273 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.53 179.781 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 329' ' ' LEU . . . . . 0.402 ' HG ' ' O ' ' B' ' 325' ' ' TYR . 93.1 mt -56.26 -34.3 66.28 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.53 179.541 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 330' ' ' GLU . . . . . . . . . . . . . 19.4 mm-40 -69.56 -37.45 77.02 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.869 179.85 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 331' ' ' ILE . . . . . 0.513 HG22 HG22 ' B' ' 358' ' ' VAL . 71.0 mt -62.48 -48.21 89.36 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-N 116.391 -0.368 . . . . 0.0 110.433 179.358 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 332' ' ' LEU . . . . . . . . . . . . . 10.7 mp -68.53 -31.03 69.97 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.97 179.786 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 333' ' ' HIS . . . . . . . . . . . . . 40.4 t60 -63.97 -59.52 4.39 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.93 0.395 . . . . 0.0 110.231 179.532 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 334' ' ' THR . . . . . 0.416 HG22 HD13 ' B' ' 353' ' ' LEU . 94.6 m -58.03 -38.97 77.22 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.87 -0.604 . . . . 0.0 110.471 179.366 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 335' ' ' TYR . . . . . . . . . . . . . 75.2 t80 -58.14 -43.85 87.51 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.744 -0.662 . . . . 0.0 110.306 179.509 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 336' ' ' GLN . . . . . 0.45 ' HB2' HG22 ' A' ' 369' ' ' VAL . 8.1 tt0 -64.57 -42.57 95.55 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.769 -0.651 . . . . 0.0 110.802 179.974 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 337' ' ' LYS . . . . . . . . . . . . . 28.2 ttpp -58.3 -41.38 84.35 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.734 179.82 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 338' ' ' GLU . . . . . . . . . . . . . 24.9 mm-40 -66.13 -42.23 89.43 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.884 179.661 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 339' ' ' GLN . . . . . . . . . . . . . 21.4 tm0? -59.97 -49.29 78.24 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.13 -0.487 . . . . 0.0 110.593 179.668 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 340' ' ' ARG . . . . . . . . . . . . . 99.6 mtt180 -57.0 -53.82 53.7 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.896 179.867 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 341' ' ' ASN . . . . . . . . . . . . . 85.4 m-20 -53.63 -38.47 64.1 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.936 179.923 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 342' ' ' ALA . . . . . . . . . . . . . . . -68.41 -32.95 73.36 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.92 179.875 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 343' ' ' LYS . . . . . . . . . . . . . 61.2 tttp -68.94 -49.23 59.85 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.092 -0.504 . . . . 0.0 111.006 179.822 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 344' ' ' GLU . . . . . . . . . . . . . 14.8 mm-40 -65.15 -36.03 82.97 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.236 -179.817 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 345' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.31 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.253 -179.965 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' B' B ' 351' ' ' PRO . . . . . . . . . . . . . 46.2 Cg_exo . . . . . 0 C--O 1.231 0.147 0 CA-C-O 120.77 0.237 . . . . 0.0 112.126 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' B' B ' 352' ' ' ALA . . . . . . . . . . . . . . . -98.41 -69.44 0.76 Allowed 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.378 -0.374 . . . . 0.0 111.458 -179.858 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 353' ' ' LEU . . . . . 0.446 ' HG ' ' HG2' ' B' ' 357' ' ' GLU . 6.2 mp -87.62 119.68 28.16 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.308 -0.405 . . . . 0.0 111.205 -179.777 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 354' ' ' THR . . . . . . . . . . . . . 81.7 p -107.42 -175.16 2.71 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.978 -0.556 . . . . 0.0 110.368 179.342 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 355' ' ' GLU . . . . . . . . . . . . . 39.9 mt-10 -54.36 -35.93 63.29 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.056 0.455 . . . . 0.0 110.484 179.718 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 356' ' ' GLN . . . . . . . . . . . . . 90.5 mt-30 -72.93 -41.22 64.75 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.928 -179.998 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 357' ' ' GLU . . . . . 0.446 ' HG2' ' HG ' ' B' ' 353' ' ' LEU . 5.3 tp10 -57.52 -50.72 72.14 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.933 0.397 . . . . 0.0 110.58 -179.914 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 358' ' ' VAL . . . . . 0.559 ' O ' HG23 ' B' ' 362' ' ' VAL . 55.0 t -64.33 -58.88 5.38 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 115.982 -0.554 . . . . 0.0 111.013 179.887 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 359' ' ' TYR . . . . . . . . . . . . . 39.0 t80 -51.14 -27.16 7.87 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.491 -0.322 . . . . 0.0 111.279 -179.452 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 360' ' ' ALA . . . . . . . . . . . . . . . -74.09 -54.21 8.31 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.77 0.319 . . . . 0.0 110.838 179.59 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 361' ' ' GLN . . . . . . . . . . . . . 77.2 mt-30 -60.54 -36.01 77.39 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.527 179.705 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 362' ' ' VAL . . . . . 0.559 HG23 ' O ' ' B' ' 358' ' ' VAL . 51.2 t -70.02 -40.31 78.38 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.214 0 CA-C-N 116.013 -0.54 . . . . 0.0 110.347 179.538 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 363' ' ' ALA . . . . . 0.606 ' HA ' HD21 ' B' ' 373' ' ' LEU . . . -61.82 -38.09 86.86 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.346 179.414 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 364' ' ' ARG . . . . . . . . . . . . . 38.3 ttm180 -80.08 -23.84 41.02 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.783 -0.644 . . . . 0.0 110.146 179.317 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 365' ' ' LEU . . . . . . . . . . . . . 2.5 tp -60.64 -29.03 69.0 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.487 179.627 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 366' ' ' PHE . . . . . . . . . . . . . 25.0 m-85 -125.55 -177.98 4.09 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.38 179.747 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 367' ' ' LYS . . . . . . . . . . . . . 68.4 mttm -137.4 -82.87 0.34 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.399 -0.364 . . . . 0.0 111.164 179.919 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 368' ' ' ASN . . . . . . . . . . . . . 27.6 p-10 -82.65 1.03 40.39 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.802 0.334 . . . . 0.0 110.918 179.995 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 369' ' ' GLN . . . . . 0.409 ' HB3' HD13 ' B' ' 372' ' ' LEU . 21.2 mp0 -98.32 58.14 1.26 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.6 179.842 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 370' ' ' GLU . . . . . . . . . . . . . 41.2 mt-10 -69.78 -13.0 62.06 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.852 -179.928 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 371' ' ' ASP . . . . . . . . . . . . . 11.6 m-20 -55.58 -39.69 71.03 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.459 179.809 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 372' ' ' LEU . . . . . 0.421 ' H ' HD12 ' B' ' 372' ' ' LEU . 6.2 mp -69.97 -37.99 75.95 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.567 179.649 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 373' ' ' LEU . . . . . 0.606 HD21 ' HA ' ' B' ' 363' ' ' ALA . 2.7 mp -62.19 -34.65 76.85 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.844 179.828 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 374' ' ' SER . . . . . . . . . . . . . 51.0 m -73.44 -55.66 6.07 Favored 'General case' 0 C--O 1.234 0.28 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.261 179.335 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 375' ' ' GLU . . . . . . . . . . . . . 43.0 mt-10 -54.91 -33.25 61.89 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-N 115.934 -0.576 . . . . 0.0 110.26 179.357 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 376' ' ' PHE . . . . . 0.429 ' O ' ' HB2' ' B' ' 379' ' ' PHE . 87.3 t80 -82.27 -30.21 30.77 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.025 179.333 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 377' ' ' GLY . . . . . . . . . . . . . . . -61.93 -33.51 85.74 Favored Glycine 0 N--CA 1.448 -0.564 0 C-N-CA 120.474 -0.87 . . . . 0.0 111.207 179.114 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 378' ' ' GLN . . . . . . . . . . . . . 98.1 mt-30 -69.75 -29.25 66.56 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.798 0.332 . . . . 0.0 110.56 179.155 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 379' ' ' PHE . . . . . 0.429 ' HB2' ' O ' ' B' ' 376' ' ' PHE . 10.2 m-85 -61.15 -40.35 93.51 Favored 'General case' 0 C--N 1.333 -0.123 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.639 179.541 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 380' ' ' LEU . . . . . . . . . . . . . 95.3 mt -58.19 136.26 84.65 Favored Pre-proline 0 C--N 1.33 -0.265 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.526 179.848 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 381' ' ' PRO . . . . . . . . . . . . . 51.5 Cg_exo . . . . . 0 C--N 1.348 0.508 0 C-N-CA 122.377 2.051 . . . . 0.0 112.251 -179.574 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 366' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.232 0.152 0 CA-C-O 120.871 0.367 . . . . 0.0 111.353 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 367' ' ' VAL . . . . . . . . . . . . . 28.0 m -68.3 -29.51 44.54 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.354 -179.925 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 368' ' ' TYR . . . . . . . . . . . . . 71.3 t80 -72.1 -47.65 49.7 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.47 -0.332 . . . . 0.0 111.252 -179.749 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 369' ' ' VAL . . . . . 0.413 ' O ' ' HB2' ' A' ' 373' ' ' MET . 13.3 m -64.58 -48.37 85.13 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.487 -0.324 . . . . 0.0 111.273 -179.846 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 370' ' ' LEU . . . . . 0.583 HD23 ' HA ' ' B' ' 307' ' ' ALA . 8.3 mp -62.97 -42.92 99.97 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.645 -0.252 . . . . 0.0 111.362 179.997 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 371' ' ' SER . . . . . 0.424 ' O ' ' HB2' ' A' ' 375' ' ' ARG . 88.7 p -57.46 -60.3 3.86 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.481 -0.327 . . . . 0.0 110.942 179.957 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 372' ' ' SER . . . . . . . . . . . . . 44.1 t -62.96 -24.2 67.77 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.31 -0.405 . . . . 0.0 111.15 -179.783 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 373' ' ' MET . . . . . 0.413 ' HB2' ' O ' ' A' ' 369' ' ' VAL . 50.6 tpp -65.11 -49.16 71.06 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.797 0.332 . . . . 0.0 111.196 -179.939 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 374' ' ' ALA . . . . . . . . . . . . . . . -85.32 -17.37 37.03 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.818 -179.391 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 375' ' ' ARG . . . . . 0.424 ' HB2' ' O ' ' A' ' 371' ' ' SER . 0.0 OUTLIER -88.3 -22.21 24.01 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.712 0.291 . . . . 0.0 111.083 -179.68 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 376' ' ' GLN . . . . . . . . . . . . . 57.6 tp60 . . . . . 0 C--N 1.331 -0.198 0 CA-C-N 116.429 -0.35 . . . . 0.0 110.749 -179.937 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' B' B ' 302' ' ' VAL . . . . . 0.447 HG13 ' N ' ' B' ' 303' ' ' GLU . 7.7 p . . . . . 0 C--O 1.234 0.265 0 CA-C-O 120.976 0.417 . . . . 0.0 111.03 . . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 303' ' ' GLU . . . . . 0.447 ' N ' HG13 ' B' ' 302' ' ' VAL . 29.1 mt-10 -58.15 -33.83 69.63 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.888 -179.958 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 304' ' ' PHE . . . . . . . . . . . . . 76.5 t80 -58.05 -76.94 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.895 -0.593 . . . . 0.0 111.225 -179.612 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 305' ' ' ASN . . . . . . . . . . . . . 3.1 p-10 -49.36 -38.8 29.55 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.757 -179.507 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 306' ' ' HIS . . . . . . . . . . . . . 3.2 m80 -59.24 -74.63 0.07 Allowed 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 112.301 0.482 . . . . 0.0 112.301 -179.391 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 307' ' ' ALA . . . . . 0.583 ' HA ' HD23 ' A' ' 370' ' ' LEU . . . -56.48 -44.75 80.93 Favored 'General case' 0 C--N 1.33 -0.26 0 N-CA-C 112.455 0.539 . . . . 0.0 112.455 -178.542 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 308' ' ' ILE . . . . . . . . . . . . . 46.4 mm -58.11 -64.24 0.57 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 N-CA-C 111.737 0.273 . . . . 0.0 111.737 -179.51 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 309' ' ' ASN . . . . . . . . . . . . . 49.9 t30 -50.77 -37.29 41.32 Favored 'General case' 0 N--CA 1.463 0.196 0 CA-C-O 120.735 0.303 . . . . 0.0 110.972 -179.692 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 310' ' ' TYR . . . . . 0.532 ' O ' HG12 ' B' ' 314' ' ' ILE . 90.9 t80 -58.32 -65.92 0.57 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.731 179.705 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 311' ' ' VAL . . . . . . . . . . . . . 59.6 t -51.23 -29.39 8.57 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.378 -0.374 . . . . 0.0 111.163 -179.759 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 312' ' ' ASN . . . . . . . . . . . . . 27.0 t-20 -65.04 -57.09 9.56 Favored 'General case' 0 C--O 1.234 0.262 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.596 -179.832 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 313' ' ' LYS . . . . . 0.434 ' HG3' ' O ' ' B' ' 310' ' ' TYR . 0.1 OUTLIER -65.62 -28.95 69.49 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 120.587 0.232 . . . . 0.0 111.623 -179.371 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' B' B ' 314' ' ' ILE . . . . . 0.532 HG12 ' O ' ' B' ' 310' ' ' TYR . 20.3 mm -67.7 -44.98 85.57 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-O 120.879 0.371 . . . . 0.0 110.841 179.791 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 315' ' ' LYS . . . . . 0.434 ' HE3' ' HB3' ' B' ' 315' ' ' LYS . 1.2 tmmt? -67.34 -42.37 83.66 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.897 -179.988 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 316' ' ' ASN . . . . . . . . . . . . . 6.0 t30 -61.14 -54.39 45.1 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.398 -0.364 . . . . 0.0 111.326 -179.73 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 317' ' ' ARG . . . . . . . . . . . . . 27.9 mmm180 -59.68 -24.33 63.84 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.831 0.348 . . . . 0.0 111.123 -179.875 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 318' ' ' PHE . . . . . . . . . . . . . 34.9 m-85 -114.46 36.76 3.63 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.809 179.837 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 319' ' ' GLN . . . . . . . . . . . . . 32.1 tt0 -64.84 -18.15 64.89 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.903 -0.589 . . . . 0.0 110.893 -179.996 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 320' ' ' GLY . . . . . . . . . . . . . . . -115.64 27.03 8.6 Favored Glycine 0 N--CA 1.452 -0.269 0 C-N-CA 120.851 -0.69 . . . . 0.0 112.591 -179.956 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 321' ' ' GLN . . . . . 0.571 ' HA ' HE21 ' B' ' 321' ' ' GLN . 0.1 OUTLIER -148.74 89.32 5.03 Favored Pre-proline 0 C--N 1.329 -0.302 0 CA-C-O 120.517 0.199 . . . . 0.0 110.717 179.946 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' B' B ' 322' ' ' PRO . . . . . . . . . . . . . 87.8 Cg_endo -81.27 -22.04 6.09 Favored 'Trans proline' 0 C--N 1.347 0.459 0 C-N-CA 122.608 2.205 . . . . 0.0 112.827 -179.764 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 323' ' ' ASP . . . . . 0.4 ' OD2' HG13 ' B' ' 324' ' ' ILE . 6.4 p-10 -68.37 -53.92 20.75 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.495 -0.321 . . . . 0.0 111.219 -179.667 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 324' ' ' ILE . . . . . 0.419 HD12 ' HG2' ' B' ' 321' ' ' GLN . 56.1 mt -64.89 -44.41 96.22 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-O 120.786 0.326 . . . . 0.0 111.007 179.958 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 325' ' ' TYR . . . . . . . . . . . . . 37.3 t80 -58.72 -43.39 90.14 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.599 179.89 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 326' ' ' LYS . . . . . . . . . . . . . 63.3 tttm -62.85 -43.82 97.76 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.449 179.54 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 327' ' ' ALA . . . . . . . . . . . . . . . -55.9 -44.27 78.05 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.78 179.547 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 328' ' ' PHE . . . . . . . . . . . . . 71.5 t80 -60.67 -50.63 72.72 Favored 'General case' 0 C--O 1.233 0.223 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.484 179.732 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 329' ' ' LEU . . . . . . . . . . . . . 95.6 mt -58.3 -28.85 65.38 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 115.816 -0.629 . . . . 0.0 110.863 179.662 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 330' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 -73.07 -41.23 64.33 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.894 179.845 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 331' ' ' ILE . . . . . 0.427 HG22 HG22 ' B' ' 358' ' ' VAL . 78.8 mt -62.01 -44.51 99.05 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.199 0 CA-C-O 120.852 0.358 . . . . 0.0 110.357 179.227 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 332' ' ' LEU . . . . . . . . . . . . . 9.6 mp -69.37 -34.98 75.36 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.619 179.603 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 333' ' ' HIS . . . . . . . . . . . . . 49.4 t-80 -62.59 -53.87 48.12 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.297 179.428 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 334' ' ' THR . . . . . . . . . . . . . 86.0 m -59.87 -38.94 83.59 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.306 179.303 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 335' ' ' TYR . . . . . . . . . . . . . 55.6 t80 -62.04 -37.83 86.42 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.211 179.396 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 336' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -64.85 -47.98 75.95 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 115.76 -0.654 . . . . 0.0 110.372 179.806 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 337' ' ' LYS . . . . . . . . . . . . . 39.5 ttpt -55.17 -48.11 74.22 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.66 179.575 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 338' ' ' GLU . . . . . 0.42 ' HB3' ' HB3' ' B' ' 351' ' ' PRO . 13.6 mm-40 -60.37 -40.36 90.55 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.71 179.685 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 339' ' ' GLN . . . . . . . . . . . . . 59.1 tp60 -58.27 -44.9 88.63 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.741 179.883 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 340' ' ' ARG . . . . . . . . . . . . . 59.1 mtp180 -62.02 -53.28 57.77 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.433 179.755 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 341' ' ' ASN . . . . . . . . . . . . . 86.6 m-20 -53.37 -31.87 46.67 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.846 -0.616 . . . . 0.0 110.577 179.341 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 342' ' ' ALA . . . . . . . . . . . . . . . -74.28 -43.15 58.06 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.97 -0.559 . . . . 0.0 111.13 179.932 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 343' ' ' LYS . . . . . . . . . . . . . 64.0 tttm -75.6 -11.8 60.09 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.709 -179.966 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 344' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -92.41 -40.48 10.85 Favored 'General case' 0 N--CA 1.453 -0.298 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.478 179.786 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 345' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.331 -0.222 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.985 179.926 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' B' B ' 351' ' ' PRO . . . . . 0.42 ' HB3' ' HB3' ' B' ' 338' ' ' GLU . 47.0 Cg_exo . . . . . 0 C--O 1.232 0.214 0 CA-C-O 120.798 0.249 . . . . 0.0 112.43 . . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 352' ' ' ALA . . . . . . . . . . . . . . . -83.08 -63.15 1.42 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.041 179.868 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 353' ' ' LEU . . . . . 0.416 ' HG ' ' HG2' ' B' ' 357' ' ' GLU . 6.3 mp -88.12 116.51 26.36 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.137 -179.99 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 354' ' ' THR . . . . . . . . . . . . . 61.3 p -111.25 -166.06 1.04 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.269 179.397 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 355' ' ' GLU . . . . . . . . . . . . . 8.1 pt-20 -56.8 -42.29 79.27 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.912 0.387 . . . . 0.0 110.638 179.616 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 356' ' ' GLN . . . . . . . . . . . . . 15.0 mm100 -68.07 -42.6 80.2 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.875 -0.602 . . . . 0.0 111.42 -179.888 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 357' ' ' GLU . . . . . 0.416 ' HG2' ' HG ' ' B' ' 353' ' ' LEU . 5.0 tp10 -60.31 -51.45 69.49 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.515 -0.311 . . . . 0.0 111.082 -179.584 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 358' ' ' VAL . . . . . 0.433 ' O ' HG23 ' B' ' 362' ' ' VAL . 4.4 t -60.41 -59.84 3.5 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.352 -0.386 . . . . 0.0 111.24 179.941 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 359' ' ' TYR . . . . . . . . . . . . . 4.4 t80 -51.97 -31.65 30.09 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.616 -0.266 . . . . 0.0 111.05 -179.285 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 360' ' ' ALA . . . . . . . . . . . . . . . -67.99 -59.71 3.06 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.527 -0.306 . . . . 0.0 110.954 179.659 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 361' ' ' GLN . . . . . . . . . . . . . 14.7 mm100 -53.43 -40.49 65.2 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.264 -0.426 . . . . 0.0 110.722 179.7 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 362' ' ' VAL . . . . . 0.433 HG23 ' O ' ' B' ' 358' ' ' VAL . 60.2 t -68.81 -37.03 76.88 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.366 179.502 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 363' ' ' ALA . . . . . 0.55 ' HA ' HD11 ' B' ' 373' ' ' LEU . . . -60.54 -35.72 76.69 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 121.042 0.449 . . . . 0.0 110.003 179.136 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 364' ' ' ARG . . . . . . . . . . . . . 77.3 ttt180 -86.16 -20.02 29.24 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.673 -0.694 . . . . 0.0 109.799 179.048 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 365' ' ' LEU . . . . . . . . . . . . . 24.8 tp -65.6 -42.33 91.75 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 115.594 -0.73 . . . . 0.0 110.393 179.497 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 366' ' ' PHE . . . . . . . . . . . . . 25.4 m-85 -112.83 144.5 42.27 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.289 179.358 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 367' ' ' LYS . . . . . . . . . . . . . 37.4 mtmm -120.76 -79.73 0.61 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.691 0.281 . . . . 0.0 111.358 -179.754 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 368' ' ' ASN . . . . . . . . . . . . . 33.6 m-80 -70.99 -14.83 62.49 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.341 -0.39 . . . . 0.0 110.938 -179.842 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 369' ' ' GLN . . . . . . . . . . . . . 91.5 mt-30 -107.7 94.03 4.86 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.0 179.932 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 370' ' ' GLU . . . . . . . . . . . . . 45.1 mt-10 -93.56 -5.06 49.79 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.996 -179.982 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 371' ' ' ASP . . . . . . . . . . . . . 8.9 m-20 -47.29 -63.78 0.95 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.322 -179.856 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 372' ' ' LEU . . . . . 0.734 HD22 ' H ' ' B' ' 372' ' ' LEU . 0.0 OUTLIER -58.6 -33.34 69.88 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.37 -0.377 . . . . 0.0 111.172 -179.906 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' B' B ' 373' ' ' LEU . . . . . 0.55 HD11 ' HA ' ' B' ' 363' ' ' ALA . 5.4 tp -58.54 -52.93 63.59 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.112 -0.494 . . . . 0.0 111.236 -179.399 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 374' ' ' SER . . . . . . . . . . . . . 46.7 t -64.95 -46.21 82.54 Favored 'General case' 0 C--O 1.233 0.23 0 CA-C-O 120.942 0.401 . . . . 0.0 110.536 179.788 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 375' ' ' GLU . . . . . . . . . . . . . 10.5 tp10 -54.36 -35.11 62.43 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.792 -0.64 . . . . 0.0 110.441 179.647 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 376' ' ' PHE . . . . . . . . . . . . . 85.9 t80 -78.31 -32.77 49.46 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.089 179.49 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 377' ' ' GLY . . . . . . . . . . . . . . . -60.99 -36.0 91.57 Favored Glycine 0 N--CA 1.449 -0.481 0 C-N-CA 120.805 -0.712 . . . . 0.0 111.977 179.581 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 378' ' ' GLN . . . . . . . . . . . . . 88.5 mt-30 -55.49 -28.33 53.96 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-O 120.826 0.346 . . . . 0.0 110.67 179.497 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 379' ' ' PHE . . . . . 0.405 ' HB3' ' H ' ' B' ' 380' ' ' LEU . 67.0 m-85 -72.69 -146.2 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.399 179.39 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 380' ' ' LEU . . . . . 0.405 ' H ' ' HB3' ' B' ' 379' ' ' PHE . 40.4 mt 67.13 143.18 0.08 OUTLIER Pre-proline 0 N--CA 1.462 0.173 0 CA-C-N 116.492 -0.322 . . . . 0.0 110.871 -179.874 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 381' ' ' PRO . . . . . . . . . . . . . 52.2 Cg_exo . . . . . 0 C--N 1.347 0.456 0 C-N-CA 122.563 2.176 . . . . 0.0 112.398 -179.988 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 366' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.237 0.418 0 CA-C-O 121.229 0.538 . . . . 0.0 110.333 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 367' ' ' VAL . . . . . . . . . . . . . 32.7 m -59.66 -29.05 41.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 115.441 -0.799 . . . . 0.0 110.52 179.533 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 368' ' ' TYR . . . . . . . . . . . . . 91.6 t80 -62.43 -42.27 99.33 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.35 179.452 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 369' ' ' VAL . . . . . . . . . . . . . 18.6 t -68.29 -52.76 34.25 Favored 'Isoleucine or valine' 0 C--O 1.234 0.285 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.635 179.641 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 370' ' ' LEU . . . . . . . . . . . . . 97.0 mt -57.16 -36.07 70.31 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.995 179.923 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 371' ' ' SER . . . . . . . . . . . . . 67.7 m -69.49 -41.69 75.8 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.587 179.773 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 372' ' ' SER . . . . . . . . . . . . . 64.4 m -61.31 -35.14 76.54 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.642 179.746 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 373' ' ' MET . . . . . . . . . . . . . 65.4 mtt -70.44 -48.54 55.5 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.313 179.728 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 374' ' ' ALA . . . . . . . . . . . . . . . -72.92 -19.2 61.31 Favored 'General case' 0 C--N 1.331 -0.239 0 N-CA-C 112.054 0.39 . . . . 0.0 112.054 -179.283 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 375' ' ' ARG . . . . . . . . . . . . . 28.9 mmt180 -90.84 -32.67 15.97 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 111.582 0.216 . . . . 0.0 111.582 -179.584 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 376' ' ' GLN . . . . . . . . . . . . . 6.3 tp-100 . . . . . 0 C--N 1.329 -0.304 0 CA-C-O 120.677 0.275 . . . . 0.0 110.814 -179.996 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' B' B ' 302' ' ' VAL . . . . . . . . . . . . . 35.9 m . . . . . 0 C--O 1.232 0.151 0 CA-C-O 120.771 0.32 . . . . 0.0 111.093 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' B' B ' 303' ' ' GLU . . . . . . . . . . . . . 46.5 mt-10 -58.04 -83.25 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.0 -0.545 . . . . 0.0 111.422 -179.724 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 304' ' ' PHE . . . . . . . . . . . . . 99.6 m-85 -59.97 -30.46 69.13 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.339 -179.583 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 305' ' ' ASN . . . . . . . . . . . . . 27.3 t-20 -58.21 -69.69 0.17 Allowed 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.402 -0.363 . . . . 0.0 111.45 -179.599 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 306' ' ' HIS . . . . . . . . . . . . . 20.5 m-70 -62.57 -47.16 85.04 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.123 -0.489 . . . . 0.0 112.147 -179.152 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 307' ' ' ALA . . . . . . . . . . . . . . . -56.61 -62.45 1.72 Allowed 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 112.361 0.504 . . . . 0.0 112.361 -178.921 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 308' ' ' ILE . . . . . . . . . . . . . 85.1 mt -56.56 -49.41 77.75 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.247 0 N-CA-C 111.644 0.239 . . . . 0.0 111.644 -179.335 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 309' ' ' ASN . . . . . . . . . . . . . 36.7 t30 -54.21 -42.73 70.12 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.885 0.374 . . . . 0.0 111.011 -179.82 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 310' ' ' TYR . . . . . 0.483 ' O ' HG12 ' B' ' 314' ' ' ILE . 84.5 t80 -61.94 -62.78 1.54 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.949 -179.808 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 311' ' ' VAL . . . . . . . . . . . . . 43.6 t -54.24 -25.61 13.81 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-O 120.859 0.361 . . . . 0.0 110.978 -179.833 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 312' ' ' ASN . . . . . . . . . . . . . 52.9 t30 -67.9 -56.71 8.03 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.026 -179.924 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 313' ' ' LYS . . . . . 0.449 ' HD3' ' N ' ' B' ' 314' ' ' ILE . 0.1 OUTLIER -65.32 -30.53 71.38 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.519 -0.309 . . . . 0.0 111.514 -179.592 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' B' B ' 314' ' ' ILE . . . . . 0.483 HG12 ' O ' ' B' ' 310' ' ' TYR . 25.9 mm -70.06 -40.55 78.55 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.197 0 CA-C-O 120.945 0.402 . . . . 0.0 110.744 179.578 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 315' ' ' LYS . . . . . . . . . . . . . 4.3 ttmp? -66.92 -42.42 85.4 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.936 -0.574 . . . . 0.0 110.911 -179.899 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 316' ' ' ASN . . . . . . . . . . . . . 27.6 t-20 -64.19 -52.61 58.05 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.333 -179.713 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 317' ' ' ARG . . . . . 0.441 ' HA ' ' NE ' ' B' ' 317' ' ' ARG . 4.7 mmp_? -59.38 -60.75 3.36 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.904 0.383 . . . . 0.0 111.197 -179.873 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 318' ' ' PHE . . . . . . . . . . . . . 65.4 m-85 -85.23 38.14 0.71 Allowed 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.093 -0.503 . . . . 0.0 111.379 -179.559 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 319' ' ' GLN . . . . . . . . . . . . . 22.6 tt0 -65.28 -26.17 67.96 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.706 179.863 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 320' ' ' GLY . . . . . . . . . . . . . . . -96.9 -5.43 58.49 Favored Glycine 0 N--CA 1.451 -0.301 0 C-N-CA 120.804 -0.712 . . . . 0.0 112.624 -179.845 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 321' ' ' GLN . . . . . . . . . . . . . 14.8 mm100 -108.33 94.04 12.65 Favored Pre-proline 0 C--N 1.329 -0.298 0 CA-C-O 120.45 0.167 . . . . 0.0 110.945 -179.962 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 322' ' ' PRO . . . . . . . . . . . . . 97.1 Cg_endo -79.69 -33.78 1.16 Allowed 'Trans proline' 0 C--N 1.348 0.531 0 C-N-CA 122.459 2.106 . . . . 0.0 112.458 -179.911 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 323' ' ' ASP . . . . . . . . . . . . . 20.8 m-20 -63.86 -51.7 63.44 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.146 -179.682 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 324' ' ' ILE . . . . . . . . . . . . . 57.1 mt -65.12 -46.24 91.73 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.424 -179.696 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 325' ' ' TYR . . . . . 0.422 ' O ' HD23 ' B' ' 329' ' ' LEU . 35.0 t80 -57.57 -58.43 8.34 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.996 -179.624 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 326' ' ' LYS . . . . . . . . . . . . . 14.2 mptt -54.03 -44.73 71.23 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.017 179.916 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 327' ' ' ALA . . . . . . . . . . . . . . . -53.59 -45.64 70.09 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 121.055 0.455 . . . . 0.0 110.916 179.802 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 328' ' ' PHE . . . . . . . . . . . . . 54.9 t80 -60.54 -54.92 39.7 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.857 -0.611 . . . . 0.0 110.822 179.961 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 329' ' ' LEU . . . . . 0.422 HD23 ' O ' ' B' ' 325' ' ' TYR . 4.0 mm? -59.76 -25.63 65.03 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.652 179.815 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 330' ' ' GLU . . . . . . . . . . . . . 10.2 mm-40 -69.76 -41.97 74.48 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.39 -0.368 . . . . 0.0 110.037 179.107 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 331' ' ' ILE . . . . . . . . . . . . . 84.8 mt -63.88 -42.41 95.71 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.038 178.814 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 332' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -64.48 -44.42 91.09 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.655 -0.702 . . . . 0.0 110.671 179.532 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 333' ' ' HIS . . . . . . . . . . . . . 54.1 t-80 -61.95 -56.27 20.9 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.777 -179.99 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 334' ' ' THR . . . . . 0.415 HG22 HD13 ' B' ' 353' ' ' LEU . 70.9 m -54.16 -37.51 64.52 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.338 179.486 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 335' ' ' TYR . . . . . . . . . . . . . 60.7 t80 -63.27 -38.56 91.66 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.069 179.299 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 336' ' ' GLN . . . . . . . . . . . . . 23.8 tt0 -64.68 -43.83 92.27 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.729 179.454 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 337' ' ' LYS . . . . . . . . . . . . . 26.9 ttpp -59.16 -52.24 66.57 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.821 -179.849 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 338' ' ' GLU . . . . . . . . . . . . . 35.5 mm-40 -58.29 -42.84 87.48 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.797 179.706 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 339' ' ' GLN . . . . . . . . . . . . . 8.7 tt0 -59.36 -41.1 88.46 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.755 -179.963 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 340' ' ' ARG . . . . . . . . . . . . . 99.1 mtt180 -62.41 -52.03 65.2 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.753 179.772 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 341' ' ' ASN . . . . . . . . . . . . . 43.5 m-80 -60.96 -27.2 68.09 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.872 179.881 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 342' ' ' ALA . . . . . . . . . . . . . . . -73.8 -42.22 61.26 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.21 179.973 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 343' ' ' LYS . . . . . . . . . . . . . 98.6 mttt -76.61 -24.66 53.41 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.99 -179.95 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 344' ' ' GLU . . . . . . . . . . . . . 15.6 mm-40 -82.43 -34.01 28.35 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.264 -0.426 . . . . 0.0 110.861 179.814 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 345' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.295 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.066 179.911 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' B' B ' 351' ' ' PRO . . . . . . . . . . . . . 51.8 Cg_exo . . . . . 0 C--O 1.231 0.138 0 CA-C-O 120.88 0.283 . . . . 0.0 112.288 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' B' B ' 352' ' ' ALA . . . . . . . . . . . . . . . -62.75 -57.27 11.52 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.066 -0.516 . . . . 0.0 111.401 -179.739 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 353' ' ' LEU . . . . . 0.46 ' HG ' ' HG2' ' B' ' 357' ' ' GLU . 5.9 mp -101.33 121.97 42.86 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 120.924 0.392 . . . . 0.0 111.375 -179.846 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 354' ' ' THR . . . . . . . . . . . . . 79.9 p -112.35 -170.76 1.72 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.389 179.158 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 355' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -57.57 -37.45 73.17 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.997 0.427 . . . . 0.0 110.28 179.654 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 356' ' ' GLN . . . . . . . . . . . . . 93.5 mt-30 -71.21 -40.71 70.96 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.807 -0.633 . . . . 0.0 111.029 -179.857 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 357' ' ' GLU . . . . . 0.46 ' HG2' ' HG ' ' B' ' 353' ' ' LEU . 6.6 tp10 -59.34 -52.74 64.32 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 116.345 -0.389 . . . . 0.0 110.908 -179.62 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 358' ' ' VAL . . . . . 0.51 ' O ' HG23 ' B' ' 362' ' ' VAL . 76.3 t -61.51 -54.66 31.87 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.942 179.842 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 359' ' ' TYR . . . . . . . . . . . . . 38.4 t80 -54.57 -28.66 47.59 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.689 0.281 . . . . 0.0 111.196 -179.444 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 360' ' ' ALA . . . . . . . . . . . . . . . -72.09 -60.66 2.12 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.867 0.365 . . . . 0.0 110.981 179.768 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 361' ' ' GLN . . . . . . . . . . . . . 24.2 mm-40 -55.0 -40.33 69.99 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.593 179.788 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 362' ' ' VAL . . . . . 0.51 HG23 ' O ' ' B' ' 358' ' ' VAL . 90.5 t -66.25 -39.87 85.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.304 179.338 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 363' ' ' ALA . . . . . 0.561 ' HA ' HD21 ' B' ' 373' ' ' LEU . . . -58.98 -36.93 75.7 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.139 179.227 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 364' ' ' ARG . . . . . . . . . . . . . 98.2 mtt180 -80.74 -25.29 38.13 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.729 -0.669 . . . . 0.0 110.41 179.387 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 365' ' ' LEU . . . . . . . . . . . . . 14.6 tp -61.14 -29.67 69.93 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.456 179.843 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 366' ' ' PHE . . . . . . . . . . . . . 43.9 m-85 -120.09 -170.2 1.92 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.855 -0.611 . . . . 0.0 110.164 179.545 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 367' ' ' LYS . . . . . . . . . . . . . 61.0 tttp -158.32 -84.24 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.663 0.268 . . . . 0.0 111.38 179.944 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 368' ' ' ASN . . . . . . . . . . . . . 80.6 m-20 -70.0 -7.87 44.41 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.378 -0.373 . . . . 0.0 110.948 -179.83 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 369' ' ' GLN . . . . . . . . . . . . . 15.9 mp0 -110.57 86.83 2.39 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.888 179.999 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 370' ' ' GLU . . . . . . . . . . . . . 42.8 mt-10 -91.36 -12.55 34.57 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.396 -0.365 . . . . 0.0 110.553 179.837 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 371' ' ' ASP . . . . . . . . . . . . . 19.2 t70 -55.1 -34.11 63.4 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 116.158 -0.473 . . . . 0.0 110.155 179.476 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 372' ' ' LEU . . . . . 0.465 ' N ' HD12 ' B' ' 372' ' ' LEU . 6.0 mp -69.97 -38.16 76.0 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.662 -0.699 . . . . 0.0 110.211 179.15 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 373' ' ' LEU . . . . . 0.561 HD21 ' HA ' ' B' ' 363' ' ' ALA . 1.7 mp -63.26 -37.31 86.75 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.733 -0.667 . . . . 0.0 110.783 179.793 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 374' ' ' SER . . . . . . . . . . . . . 61.6 m -72.67 -57.14 4.35 Favored 'General case' 0 C--O 1.235 0.339 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.462 179.532 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 375' ' ' GLU . . . . . . . . . . . . . 17.2 mm-40 -52.56 -40.58 62.72 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.565 179.503 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 376' ' ' PHE . . . . . . . . . . . . . 81.5 t80 -72.8 -34.47 66.92 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.13 -0.487 . . . . 0.0 109.99 179.442 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 377' ' ' GLY . . . . . . . . . . . . . . . -58.97 -32.74 71.36 Favored Glycine 0 N--CA 1.449 -0.485 0 C-N-CA 120.583 -0.818 . . . . 0.0 111.373 179.091 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 378' ' ' GLN . . . . . . . . . . . . . 86.6 mm-40 -56.98 -36.31 70.18 Favored 'General case' 0 C--N 1.333 -0.142 0 CA-C-O 120.929 0.395 . . . . 0.0 110.09 178.829 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 379' ' ' PHE . . . . . . . . . . . . . 70.3 m-85 -68.14 -42.06 80.68 Favored 'General case' 0 C--N 1.333 -0.144 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.243 179.339 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 380' ' ' LEU . . . . . 0.414 HD12 ' HA ' ' B' ' 380' ' ' LEU . 5.8 tp -51.38 121.27 16.62 Favored Pre-proline 0 C--N 1.329 -0.306 0 CA-C-N 115.554 -0.748 . . . . 0.0 110.667 -179.829 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 381' ' ' PRO . . . . . . . . . . . . . 84.9 Cg_exo . . . . . 0 C--N 1.351 0.677 0 C-N-CA 122.413 2.075 . . . . 0.0 112.462 -179.984 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 366' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.234 0.253 0 CA-C-O 120.906 0.384 . . . . 0.0 110.643 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 367' ' ' VAL . . . . . . . . . . . . . 21.4 t -53.28 -32.65 19.74 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 115.892 -0.595 . . . . 0.0 110.986 179.969 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 368' ' ' TYR . . . . . . . . . . . . . 66.3 t80 -68.02 -36.78 80.52 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.675 179.785 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 369' ' ' VAL . . . . . 0.406 HG22 ' HB2' ' B' ' 336' ' ' GLN . 6.0 t -67.26 -52.97 36.99 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.238 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.728 179.85 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 370' ' ' LEU . . . . . 0.412 ' N ' HD22 ' A' ' 370' ' ' LEU . 3.4 mm? -62.32 -32.36 73.1 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.766 179.801 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 371' ' ' SER . . . . . . . . . . . . . 27.2 t -64.12 -58.34 6.94 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.045 179.878 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 372' ' ' SER . . . . . . . . . . . . . 41.7 t -59.68 -32.5 70.54 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.09 -179.86 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 373' ' ' MET . . . . . . . . . . . . . 55.6 ttm -63.99 -47.24 81.09 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.402 -0.363 . . . . 0.0 111.174 179.935 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 374' ' ' ALA . . . . . . . . . . . . . . . -83.17 -13.79 54.77 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.363 -0.38 . . . . 0.0 111.686 -179.715 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 375' ' ' ARG . . . . . 0.533 ' HG2' ' HG2' ' B' ' 303' ' ' GLU . 7.0 mmt180 -86.07 -30.73 22.38 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.487 -0.324 . . . . 0.0 111.25 -179.844 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 376' ' ' GLN . . . . . 0.47 ' HB3' ' HG3' ' B' ' 381' ' ' PRO . 52.6 tt0 . . . . . 0 C--N 1.329 -0.322 0 CA-C-N 116.255 -0.429 . . . . 0.0 111.179 -179.617 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 302' ' ' VAL . . . . . . . . . . . . . 15.0 p . . . . . 0 C--O 1.232 0.137 0 CA-C-O 120.89 0.376 . . . . 0.0 110.805 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' B' B ' 303' ' ' GLU . . . . . 0.533 ' HG2' ' HG2' ' A' ' 375' ' ' ARG . 35.5 mt-10 -51.64 -80.75 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.77 -0.65 . . . . 0.0 111.879 -179.34 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 304' ' ' PHE . . . . . 0.492 ' O ' HG12 ' B' ' 308' ' ' ILE . 81.0 m-85 -54.79 -55.0 34.78 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.918 -0.583 . . . . 0.0 112.043 -179.023 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 305' ' ' ASN . . . . . . . . . . . . . 46.6 t30 -47.58 -68.89 0.15 Allowed 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 112.87 0.693 . . . . 0.0 112.87 -178.668 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 306' ' ' HIS . . . . . . . . . . . . . 2.5 t-160 -54.98 -46.33 75.1 Favored 'General case' 0 C--N 1.33 -0.266 0 N-CA-C 112.417 0.525 . . . . 0.0 112.417 -178.244 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 307' ' ' ALA . . . . . . . . . . . . . . . -58.6 -62.19 2.04 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 112.37 0.507 . . . . 0.0 112.37 -178.89 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 308' ' ' ILE . . . . . 0.492 HG12 ' O ' ' B' ' 304' ' ' PHE . 30.9 pt -54.68 -37.74 40.72 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.208 0 N-CA-C 111.825 0.306 . . . . 0.0 111.825 -179.173 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 309' ' ' ASN . . . . . 0.433 ' N ' HG13 ' B' ' 308' ' ' ILE . 5.3 m-20 -61.58 -45.27 94.85 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.896 0.379 . . . . 0.0 110.804 179.987 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 310' ' ' TYR . . . . . 0.509 ' O ' HG12 ' B' ' 314' ' ' ILE . 81.4 t80 -61.54 -60.13 4.16 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.847 179.869 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 311' ' ' VAL . . . . . . . . . . . . . 47.5 t -54.13 -31.26 21.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-O 120.896 0.379 . . . . 0.0 111.178 -179.572 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 312' ' ' ASN . . . . . . . . . . . . . 55.6 t30 -65.11 -56.52 12.48 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.361 -179.668 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 313' ' ' LYS . . . . . 0.516 ' NZ ' ' HB2' ' B' ' 313' ' ' LYS . 0.0 OUTLIER -65.31 -23.52 67.04 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 116.493 -0.321 . . . . 0.0 111.595 -179.555 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 314' ' ' ILE . . . . . 0.509 HG12 ' O ' ' B' ' 310' ' ' TYR . 24.6 mm -76.68 -36.61 27.45 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-O 120.814 0.34 . . . . 0.0 111.087 179.723 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 315' ' ' LYS . . . . . . . . . . . . . 1.2 tmmt? -75.84 -35.94 59.8 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.404 -0.362 . . . . 0.0 110.858 -179.982 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 316' ' ' ASN . . . . . . . . . . . . . 27.0 t-20 -74.4 -46.0 43.11 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.045 -0.525 . . . . 0.0 111.525 -179.47 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 317' ' ' ARG . . . . . . . . . . . . . 19.1 tpt180 -68.61 -25.55 64.91 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.448 -0.342 . . . . 0.0 111.177 -179.644 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 318' ' ' PHE . . . . . . . . . . . . . 95.7 m-85 -117.31 37.51 3.85 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.172 -179.837 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 319' ' ' GLN . . . . . . . . . . . . . 20.1 pt20 -63.4 -15.15 56.7 Favored 'General case' 0 N--CA 1.447 -0.586 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.925 179.591 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 320' ' ' GLY . . . . . . . . . . . . . . . -104.98 -7.22 38.79 Favored Glycine 0 C--N 1.331 0.284 0 C-N-CA 120.837 -0.697 . . . . 0.0 112.697 -179.85 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 321' ' ' GLN . . . . . . . . . . . . . 23.5 mp0 -113.05 88.32 11.92 Favored Pre-proline 0 C--N 1.33 -0.281 0 CA-C-O 120.549 0.214 . . . . 0.0 111.004 -179.991 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 322' ' ' PRO . . . . . . . . . . . . . 90.2 Cg_endo -80.87 -26.5 3.6 Favored 'Trans proline' 0 C--N 1.348 0.507 0 C-N-CA 122.474 2.116 . . . . 0.0 112.689 179.778 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 323' ' ' ASP . . . . . . . . . . . . . 12.4 m-20 -67.05 -56.82 8.41 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.383 -179.542 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 324' ' ' ILE . . . . . . . . . . . . . 57.1 mt -64.3 -43.39 97.17 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 CA-C-N 116.299 -0.41 . . . . 0.0 111.195 -179.784 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 325' ' ' TYR . . . . . 0.45 ' O ' HD23 ' B' ' 329' ' ' LEU . 55.1 t80 -57.12 -58.23 9.09 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.714 179.957 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 326' ' ' LYS . . . . . 0.438 ' O ' ' HG2' ' B' ' 330' ' ' GLU . 58.6 mtpt -52.2 -50.02 62.72 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.012 179.833 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 327' ' ' ALA . . . . . 0.439 ' O ' ' HB2' ' B' ' 330' ' ' GLU . . . -50.35 -46.46 55.76 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 116.369 -0.378 . . . . 0.0 111.207 179.997 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 328' ' ' PHE . . . . . . . . . . . . . 71.3 t80 -58.01 -53.5 57.49 Favored 'General case' 0 C--O 1.237 0.44 0 CA-C-O 121.062 0.458 . . . . 0.0 109.985 179.293 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 329' ' ' LEU . . . . . 0.45 HD23 ' O ' ' B' ' 325' ' ' TYR . 4.2 mm? -58.73 -27.73 65.19 Favored 'General case' 0 N--CA 1.452 -0.327 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.372 179.082 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 330' ' ' GLU . . . . . 0.439 ' HB2' ' O ' ' B' ' 327' ' ' ALA . 27.4 mm-40 -69.23 -39.22 78.66 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.035 179.464 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 331' ' ' ILE . . . . . 0.463 HG22 HG22 ' B' ' 358' ' ' VAL . 68.2 mt -63.8 -50.51 77.39 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.23 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.254 179.204 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 332' ' ' LEU . . . . . . . . . . . . . 11.0 mp -66.48 -28.92 68.96 Favored 'General case' 0 C--O 1.233 0.2 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.796 179.643 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 333' ' ' HIS . . . . . . . . . . . . . 34.4 t-80 -66.88 -61.05 2.14 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.401 179.348 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 334' ' ' THR . . . . . . . . . . . . . 95.3 m -56.1 -34.29 65.89 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.925 -0.579 . . . . 0.0 110.242 179.286 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 335' ' ' TYR . . . . . . . . . . . . . 52.4 t80 -63.79 -41.73 97.88 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.809 -0.632 . . . . 0.0 110.245 179.31 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 336' ' ' GLN . . . . . 0.406 ' HB2' HG22 ' A' ' 369' ' ' VAL . 44.4 tt0 -62.77 -47.07 85.08 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.773 179.665 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 337' ' ' LYS . . . . . . . . . . . . . 28.7 ttpp -56.72 -54.32 47.52 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.177 -179.914 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 338' ' ' GLU . . . . . . . . . . . . . 19.7 mm-40 -60.94 -33.34 73.03 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.272 -179.916 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 339' ' ' GLN . . . . . . . . . . . . . 60.5 tt0 -63.14 -61.22 2.52 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.854 -179.949 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 340' ' ' ARG . . . . . . . . . . . . . 95.4 mtt180 -52.54 -52.67 53.68 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.011 -0.54 . . . . 0.0 111.084 -179.99 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 341' ' ' ASN . . . . . . . . . . . . . 80.2 m-20 -54.32 -40.66 68.2 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.952 179.906 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 342' ' ' ALA . . . . . . . . . . . . . . . -66.89 -31.25 71.72 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.119 179.961 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 343' ' ' LYS . . . . . . . . . . . . . 14.0 mmmm -72.35 -46.64 54.61 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.112 -0.494 . . . . 0.0 111.195 -179.885 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 344' ' ' GLU . . . . . . . . . . . . . 14.1 mm-40 -69.7 -29.23 66.59 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.17 -179.706 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 345' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.297 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.215 -179.898 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' B' B ' 351' ' ' PRO . . . . . . . . . . . . . 52.5 Cg_exo . . . . . 0 C--O 1.232 0.176 0 CA-C-O 120.843 0.268 . . . . 0.0 112.459 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' B' B ' 352' ' ' ALA . . . . . . . . . . . . . . . -77.26 -41.71 39.94 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.058 179.947 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 353' ' ' LEU . . . . . 0.453 ' HG ' ' HG2' ' B' ' 357' ' ' GLU . 7.1 mp -114.74 130.32 56.82 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.01 179.969 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 354' ' ' THR . . . . . . . . . . . . . 81.0 p -112.36 -174.86 2.55 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.055 -0.521 . . . . 0.0 110.805 179.769 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 355' ' ' GLU . . . . . . . . . . . . . 8.5 pt-20 -56.54 -42.14 77.97 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 121.209 0.528 . . . . 0.0 110.573 179.985 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 356' ' ' GLN . . . . . . . . . . . . . 15.8 mm100 -65.95 -38.92 89.85 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.5 -0.773 . . . . 0.0 111.055 179.789 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 357' ' ' GLU . . . . . 0.453 ' HG2' ' HG ' ' B' ' 353' ' ' LEU . 5.5 tp10 -61.33 -46.48 90.09 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 120.856 0.36 . . . . 0.0 110.707 -179.833 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 358' ' ' VAL . . . . . 0.512 ' O ' HG23 ' B' ' 362' ' ' VAL . 71.5 t -63.5 -59.92 3.57 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-N 116.101 -0.499 . . . . 0.0 111.173 179.889 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 359' ' ' TYR . . . . . . . . . . . . . 46.5 t80 -52.36 -32.47 38.6 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.375 -0.375 . . . . 0.0 111.569 -179.335 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 360' ' ' ALA . . . . . . . . . . . . . . . -68.42 -60.54 2.36 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.77 0.319 . . . . 0.0 111.075 -179.95 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 361' ' ' GLN . . . . . . . . . . . . . 96.7 mt-30 -55.44 -45.5 76.82 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.68 179.939 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 362' ' ' VAL . . . . . 0.512 HG23 ' O ' ' B' ' 358' ' ' VAL . 57.5 t -61.61 -36.96 76.66 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.217 0 CA-C-N 116.152 -0.477 . . . . 0.0 110.305 179.399 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 363' ' ' ALA . . . . . . . . . . . . . . . -63.84 -34.69 78.49 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.104 179.133 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 364' ' ' ARG . . . . . . . . . . . . . 59.2 ttt180 -75.83 -26.93 57.64 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.821 -0.627 . . . . 0.0 110.085 179.197 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 365' ' ' LEU . . . . . . . . . . . . . 2.5 mp -60.04 -57.97 10.53 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.792 179.333 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 366' ' ' PHE . . . . . 0.423 ' HB3' ' HB2' ' B' ' 369' ' ' GLN . 4.9 m-85 -104.97 133.72 49.29 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.609 179.937 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 367' ' ' LYS . . . . . . . . . . . . . 96.7 mttt -105.23 -78.0 0.58 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.844 0.354 . . . . 0.0 111.15 -179.636 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 368' ' ' ASN . . . . . . . . . . . . . 82.6 m-20 -66.88 -16.59 64.41 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.935 -179.982 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 369' ' ' GLN . . . . . 0.423 ' HB2' ' HB3' ' B' ' 366' ' ' PHE . 96.7 mt-30 -97.02 85.75 3.81 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.947 179.964 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 370' ' ' GLU . . . . . . . . . . . . . 10.5 mm-40 -94.06 -6.03 46.09 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.068 -0.515 . . . . 0.0 111.095 179.847 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 371' ' ' ASP . . . . . . . . . . . . . 20.2 t70 -58.67 -62.77 1.62 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.009 -179.976 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 372' ' ' LEU . . . . . 0.558 HD12 ' N ' ' B' ' 373' ' ' LEU . 0.3 OUTLIER -62.25 -22.52 66.04 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.077 179.927 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 373' ' ' LEU . . . . . 0.558 ' N ' HD12 ' B' ' 372' ' ' LEU . 6.1 tp -70.18 -39.82 75.04 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.25 -179.997 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 374' ' ' SER . . . . . . . . . . . . . 54.7 m -71.98 -48.82 42.24 Favored 'General case' 0 C--O 1.234 0.274 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.065 179.247 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 375' ' ' GLU . . . . . . . . . . . . . 15.3 mm-40 -54.43 -44.79 72.75 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-N 116.009 -0.542 . . . . 0.0 110.057 179.361 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 376' ' ' PHE . . . . . . . . . . . . . 82.3 t80 -65.54 -38.52 89.85 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.015 -0.538 . . . . 0.0 109.934 179.206 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 377' ' ' GLY . . . . . . . . . . . . . . . -58.05 -34.27 72.12 Favored Glycine 0 N--CA 1.449 -0.451 0 C-N-CA 120.683 -0.77 . . . . 0.0 111.721 179.332 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 378' ' ' GLN . . . . . . . . . . . . . 98.1 mt-30 -60.99 -34.73 75.24 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.68 0.276 . . . . 0.0 110.711 179.381 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 379' ' ' PHE . . . . . . . . . . . . . 56.6 m-85 -59.57 -36.5 76.34 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.57 179.656 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 380' ' ' LEU . . . . . . . . . . . . . 93.5 mt -54.22 145.49 35.44 Favored Pre-proline 0 C--N 1.331 -0.204 0 CA-C-N 115.921 -0.581 . . . . 0.0 110.644 179.834 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 381' ' ' PRO . . . . . 0.47 ' HG3' ' HB3' ' A' ' 376' ' ' GLN . 76.6 Cg_exo . . . . . 0 C--N 1.346 0.428 0 C-N-CA 122.408 2.072 . . . . 0.0 112.226 179.929 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 366' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.232 0.132 0 CA-C-O 120.973 0.416 . . . . 0.0 110.762 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 367' ' ' VAL . . . . . . . . . . . . . 21.9 t -59.64 -19.4 16.81 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.744 179.918 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 368' ' ' TYR . . . . . . . . . . . . . 84.7 t80 -65.91 -60.03 3.26 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.061 -179.993 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 369' ' ' VAL . . . . . 0.439 HG21 ' HB3' ' B' ' 332' ' ' LEU . 20.8 m -67.82 -36.82 77.14 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.19 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.555 -179.697 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 370' ' ' LEU . . . . . . . . . . . . . 97.5 mt -62.4 -58.46 7.56 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.958 0.409 . . . . 0.0 110.94 179.88 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 371' ' ' SER . . . . . . . . . . . . . 36.6 t -58.87 -51.4 70.17 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.045 -0.525 . . . . 0.0 111.037 179.8 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 372' ' ' SER . . . . . . . . . . . . . 93.0 p -55.17 -41.32 71.72 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.338 -179.503 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 373' ' ' MET . . . . . 0.575 ' HG2' ' H ' ' B' ' 380' ' ' LEU . 54.3 ttm -62.97 -41.49 99.56 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.458 -0.337 . . . . 0.0 111.186 -179.724 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 374' ' ' ALA . . . . . . . . . . . . . . . -87.03 -6.68 58.65 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.357 -0.383 . . . . 0.0 111.922 -179.595 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 375' ' ' ARG . . . . . . . . . . . . . 22.1 mmm180 -107.81 -12.64 15.16 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.591 0.234 . . . . 0.0 111.603 -179.804 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 376' ' ' GLN . . . . . 0.573 ' HB3' ' HG3' ' B' ' 381' ' ' PRO . 54.0 tt0 . . . . . 0 C--N 1.33 -0.244 0 CA-C-O 121.039 0.447 . . . . 0.0 110.892 -179.727 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 302' ' ' VAL . . . . . . . . . . . . . 8.2 p . . . . . 0 C--O 1.232 0.182 0 CA-C-O 121.071 0.463 . . . . 0.0 110.912 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' B' B ' 303' ' ' GLU . . . . . 0.408 ' HG3' ' H ' ' B' ' 303' ' ' GLU . 18.7 mt-10 -54.48 -81.18 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.629 -0.714 . . . . 0.0 111.709 -179.244 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 304' ' ' PHE . . . . . 0.561 ' HA ' HD13 ' B' ' 308' ' ' ILE . 80.8 t80 -51.07 -50.15 59.25 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.871 -179.199 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 305' ' ' ASN . . . . . . . . . . . . . 7.3 t30 -50.43 -72.76 0.05 OUTLIER 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 112.634 0.605 . . . . 0.0 112.634 -178.817 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 306' ' ' HIS . . . . . . . . . . . . . 25.5 m80 -58.95 -55.27 37.33 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 113.024 0.75 . . . . 0.0 113.024 -177.994 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 307' ' ' ALA . . . . . . . . . . . . . . . -50.66 -62.37 1.64 Allowed 'General case' 0 CA--C 1.532 0.277 0 N-CA-C 112.554 0.576 . . . . 0.0 112.554 -178.678 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 308' ' ' ILE . . . . . 0.561 HD13 ' HA ' ' B' ' 304' ' ' PHE . 1.8 mp -57.91 -52.79 53.78 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.219 0 N-CA-C 112.024 0.379 . . . . 0.0 112.024 -179.071 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 309' ' ' ASN . . . . . . . . . . . . . 93.5 m-20 -54.33 -28.97 46.24 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.643 0.258 . . . . 0.0 111.427 -179.473 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 310' ' ' TYR . . . . . 0.563 ' O ' ' HG3' ' B' ' 313' ' ' LYS . 43.7 t80 -74.09 -61.26 1.92 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.948 0.404 . . . . 0.0 111.059 -179.674 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 311' ' ' VAL . . . . . . . . . . . . . 58.5 t -58.64 -27.73 35.01 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.428 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.673 179.949 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 312' ' ' ASN . . . . . . . . . . . . . 7.5 t30 -72.49 -56.69 5.01 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.71 -179.148 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 313' ' ' LYS . . . . . 0.563 ' HG3' ' O ' ' B' ' 310' ' ' TYR . 0.0 OUTLIER -56.56 -38.09 71.45 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.648 0.261 . . . . 0.0 111.465 -179.359 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' B' B ' 314' ' ' ILE . . . . . 0.419 HG13 ' O ' ' B' ' 310' ' ' TYR . 11.0 mt -78.08 -31.14 16.4 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.22 0 N-CA-C 111.958 0.355 . . . . 0.0 111.958 -179.409 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 315' ' ' LYS . . . . . 0.409 ' HE3' ' HB3' ' B' ' 315' ' ' LYS . 1.4 tmmt? -70.54 -34.92 72.81 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.61 0.243 . . . . 0.0 111.281 -179.983 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 316' ' ' ASN . . . . . . . . . . . . . 61.5 t30 -86.01 -38.55 17.78 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.478 -0.328 . . . . 0.0 111.746 -179.087 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 317' ' ' ARG . . . . . . . . . . . . . 32.6 tpt180 -75.58 -44.13 44.71 Favored 'General case' 0 C--N 1.327 -0.374 0 N-CA-C 111.733 0.272 . . . . 0.0 111.733 -179.29 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 318' ' ' PHE . . . . . . . . . . . . . 62.9 m-85 -98.0 34.63 1.88 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.537 -0.302 . . . . 0.0 111.394 -179.455 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 319' ' ' GLN . . . . . . . . . . . . . 25.1 pt20 -67.97 -9.13 42.97 Favored 'General case' 0 N--CA 1.447 -0.602 0 CA-C-N 116.443 -0.344 . . . . 0.0 111.068 179.658 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 320' ' ' GLY . . . . . . . . . . . . . . . -96.05 -19.11 29.56 Favored Glycine 0 N--CA 1.451 -0.347 0 C-N-CA 120.845 -0.693 . . . . 0.0 112.711 -179.857 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 321' ' ' GLN . . . . . . . . . . . . . 58.9 mt-30 -108.07 92.27 9.1 Favored Pre-proline 0 C--N 1.33 -0.274 0 CA-C-O 120.473 0.178 . . . . 0.0 111.139 179.935 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 322' ' ' PRO . . . . . . . . . . . . . 93.0 Cg_endo -79.03 -23.57 7.67 Favored 'Trans proline' 0 C--N 1.349 0.601 0 C-N-CA 122.502 2.135 . . . . 0.0 112.355 179.75 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 323' ' ' ASP . . . . . . . . . . . . . 10.0 m-20 -69.36 -52.69 24.67 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.824 179.949 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 324' ' ' ILE . . . . . . . . . . . . . 64.4 mt -69.12 -42.54 81.85 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.98 179.929 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 325' ' ' TYR . . . . . . . . . . . . . 40.3 t80 -58.21 -57.17 14.03 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.697 179.874 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 326' ' ' LYS . . . . . 0.463 ' O ' ' HG2' ' B' ' 330' ' ' GLU . 28.6 mtpp -57.84 -46.8 84.22 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.938 179.789 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 327' ' ' ALA . . . . . . . . . . . . . . . -48.19 -54.14 14.51 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 116.308 -0.405 . . . . 0.0 111.193 -179.916 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 328' ' ' PHE . . . . . . . . . . . . . 84.0 t80 -56.12 -47.29 78.41 Favored 'General case' 0 C--O 1.237 0.405 0 CA-C-O 121.14 0.495 . . . . 0.0 109.903 179.283 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 329' ' ' LEU . . . . . . . . . . . . . 91.7 mt -61.36 -26.19 67.66 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.614 -0.721 . . . . 0.0 110.636 179.496 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 330' ' ' GLU . . . . . 0.463 ' HG2' ' O ' ' B' ' 326' ' ' LYS . 16.1 mm-40 -75.63 -32.89 60.42 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.151 -0.477 . . . . 0.0 109.983 179.454 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 331' ' ' ILE . . . . . 0.493 HG22 HG22 ' B' ' 358' ' ' VAL . 74.4 mt -67.22 -47.53 81.2 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.191 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.343 179.063 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 332' ' ' LEU . . . . . 0.439 ' HB3' HG21 ' A' ' 369' ' ' VAL . 9.3 mp -69.21 -35.87 76.66 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.755 179.426 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 333' ' ' HIS . . . . . . . . . . . . . 17.0 t-80 -64.05 -52.94 57.03 Favored 'General case' 0 C--O 1.232 0.182 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.37 179.608 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 334' ' ' THR . . . . . . . . . . . . . 84.4 m -60.44 -36.78 79.02 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.036 -0.529 . . . . 0.0 109.838 179.094 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 335' ' ' TYR . . . . . . . . . . . . . 50.9 t80 -61.36 -37.1 82.13 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.516 -0.765 . . . . 0.0 109.933 179.249 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 336' ' ' GLN . . . . . . . . . . . . . 63.0 tt0 -66.01 -51.6 56.87 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 115.798 -0.637 . . . . 0.0 110.492 179.315 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 337' ' ' LYS . . . . . . . . . . . . . 27.1 ttpp -55.36 -39.21 69.8 Favored 'General case' 0 C--O 1.233 0.195 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.936 179.853 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 338' ' ' GLU . . . . . . . . . . . . . 15.6 mm-40 -66.47 -42.29 87.75 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.94 179.881 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 339' ' ' GLN . . . . . . . . . . . . . 74.0 mt-30 -61.45 -42.4 98.71 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.323 -0.398 . . . . 0.0 110.957 179.608 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 340' ' ' ARG . . . . . . . . . . . . . 73.6 mtp180 -62.39 -55.27 29.52 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.901 -179.875 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 341' ' ' ASN . . . . . . . . . . . . . 82.7 m-20 -57.17 -35.01 69.04 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.874 179.912 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 342' ' ' ALA . . . . . . . . . . . . . . . -66.31 -43.24 86.79 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.061 -0.518 . . . . 0.0 111.102 179.92 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 343' ' ' LYS . . . . . . . . . . . . . 14.4 tmtt? -65.03 -46.64 80.44 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.634 -179.979 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 344' ' ' GLU . . . . . . . . . . . . . 12.5 mm-40 -63.98 -32.44 73.98 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.886 -179.999 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 345' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.33 -0.265 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.029 179.938 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' B' B ' 351' ' ' PRO . . . . . . . . . . . . . 54.7 Cg_exo . . . . . 0 C--O 1.231 0.152 0 CA-C-O 120.758 0.232 . . . . 0.0 112.497 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' B' B ' 352' ' ' ALA . . . . . . . . . . . . . . . -61.04 -59.43 5.38 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.028 179.936 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 353' ' ' LEU . . . . . 0.447 ' HG ' ' HG2' ' B' ' 357' ' ' GLU . 5.9 mp -89.88 117.6 28.82 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.856 0.36 . . . . 0.0 111.137 179.921 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 354' ' ' THR . . . . . 0.423 ' H ' ' HB2' ' B' ' 357' ' ' GLU . 73.1 p -110.62 -171.19 1.78 Allowed 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.088 -0.506 . . . . 0.0 110.551 179.427 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 355' ' ' GLU . . . . . . . . . . . . . 34.8 mt-10 -54.9 -42.55 72.29 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 121.065 0.46 . . . . 0.0 110.406 179.671 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 356' ' ' GLN . . . . . . . . . . . . . 96.5 mt-30 -67.2 -35.86 80.5 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.667 -0.697 . . . . 0.0 111.054 -179.936 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 357' ' ' GLU . . . . . 0.447 ' HG2' ' HG ' ' B' ' 353' ' ' LEU . 5.7 tp10 -62.41 -53.85 48.95 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.528 -0.306 . . . . 0.0 110.877 -179.703 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 358' ' ' VAL . . . . . 0.502 ' O ' HG23 ' B' ' 362' ' ' VAL . 72.6 t -59.83 -57.03 13.49 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.413 -0.358 . . . . 0.0 111.042 179.984 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 359' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -51.85 -35.19 43.9 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.806 0.336 . . . . 0.0 110.932 -179.527 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 360' ' ' ALA . . . . . . . . . . . . . . . -68.38 -59.21 3.34 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.501 -0.318 . . . . 0.0 111.451 -179.904 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 361' ' ' GLN . . . . . . . . . . . . . 79.5 mm-40 -53.66 -42.68 68.11 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.993 -179.991 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 362' ' ' VAL . . . . . 0.502 HG23 ' O ' ' B' ' 358' ' ' VAL . 49.0 t -68.96 -37.66 77.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.732 179.82 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 363' ' ' ALA . . . . . 0.587 ' HA ' HD21 ' B' ' 373' ' ' LEU . . . -59.62 -38.25 80.82 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.736 179.687 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 364' ' ' ARG . . . . . . . . . . . . . 77.6 ttt180 -90.33 -18.79 24.92 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.826 -0.624 . . . . 0.0 110.723 179.964 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 365' ' ' LEU . . . . . . . . . . . . . 25.2 tp -55.7 -30.82 61.77 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.531 179.749 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 366' ' ' PHE . . . . . . . . . . . . . 69.3 m-85 -112.63 159.89 18.43 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.31 179.724 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 367' ' ' LYS . . . . . . . . . . . . . 34.5 mmtp -89.34 -75.67 0.43 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.407 -0.36 . . . . 0.0 111.551 -179.31 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 368' ' ' ASN . . . . . . . . . . . . . 29.4 m-80 -115.48 14.95 16.74 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.406 -0.361 . . . . 0.0 111.136 -179.59 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 369' ' ' GLN . . . . . . . . . . . . . 70.9 mt-30 -89.61 90.3 8.19 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.891 179.989 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 370' ' ' GLU . . . . . . . . . . . . . 34.3 mt-10 -91.8 -11.44 36.59 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.755 179.986 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 371' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -58.4 -57.58 12.27 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.83 179.947 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 372' ' ' LEU . . . . . . . . . . . . . 23.1 mt -61.74 -38.59 88.51 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.491 179.75 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 373' ' ' LEU . . . . . 0.587 HD21 ' HA ' ' B' ' 363' ' ' ALA . 1.0 OUTLIER -56.71 -38.93 73.02 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.567 179.866 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' B' B ' 374' ' ' SER . . . . . . . . . . . . . 70.8 m -73.25 -44.87 58.64 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.046 -0.524 . . . . 0.0 110.296 179.417 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 375' ' ' GLU . . . . . . . . . . . . . 28.1 mm-40 -56.76 -34.34 67.49 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.347 179.437 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 376' ' ' PHE . . . . . . . . . . . . . 66.8 t80 -82.58 -30.12 29.8 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.878 -0.601 . . . . 0.0 109.854 179.266 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 377' ' ' GLY . . . . . . . . . . . . . . . -64.59 -31.37 80.67 Favored Glycine 0 N--CA 1.45 -0.389 0 C-N-CA 120.837 -0.697 . . . . 0.0 111.909 179.326 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 378' ' ' GLN . . . . . . . . . . . . . 30.1 mm-40 -56.8 -26.76 58.58 Favored 'General case' 0 C--N 1.333 -0.139 0 CA-C-O 120.953 0.406 . . . . 0.0 110.477 179.553 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 379' ' ' PHE . . . . . . . . . . . . . 63.6 m-85 -73.12 -148.19 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.627 179.527 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 380' ' ' LEU . . . . . 0.575 ' H ' ' HG2' ' A' ' 373' ' ' MET . 32.7 mt 66.81 131.13 0.03 OUTLIER Pre-proline 0 CA--C 1.531 0.226 0 CA-C-N 116.482 -0.326 . . . . 0.0 110.789 179.991 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 381' ' ' PRO . . . . . 0.573 ' HG3' ' HB3' ' A' ' 376' ' ' GLN . 62.8 Cg_exo . . . . . 0 C--N 1.349 0.582 0 C-N-CA 122.28 1.986 . . . . 0.0 112.486 179.989 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 366' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.231 0.114 0 CA-C-O 120.853 0.359 . . . . 0.0 111.09 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 367' ' ' VAL . . . . . . . . . . . . . 39.9 t -73.22 -31.39 34.21 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.051 -179.995 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 368' ' ' TYR . . . . . . . . . . . . . 49.1 t80 -70.42 -42.77 71.17 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.932 -179.885 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 369' ' ' VAL . . . . . 0.431 HG13 ' N ' ' A' ' 370' ' ' LEU . 5.7 p -70.56 -46.88 68.05 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.216 0 CA-C-N 116.242 -0.436 . . . . 0.0 111.157 -179.923 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 370' ' ' LEU . . . . . 0.51 HD13 ' HA ' ' B' ' 307' ' ' ALA . 89.8 mt -60.18 -43.85 95.53 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.816 0.341 . . . . 0.0 110.868 179.808 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 371' ' ' SER . . . . . . . . . . . . . 45.2 t -62.01 -57.28 12.25 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.967 179.89 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 372' ' ' SER . . . . . 0.407 ' O ' ' HG2' ' A' ' 376' ' ' GLN . 47.3 t -51.59 -50.85 59.36 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.224 -179.77 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 373' ' ' MET . . . . . . . . . . . . . 94.2 mtp -54.18 -45.54 72.14 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.353 -179.768 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 374' ' ' ALA . . . . . . . . . . . . . . . -79.81 -9.81 59.71 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.583 -0.28 . . . . 0.0 111.635 -179.832 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 375' ' ' ARG . . . . . . . . . . . . . 22.3 mmm180 -100.68 -12.13 19.41 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.558 -0.292 . . . . 0.0 111.363 179.871 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 376' ' ' GLN . . . . . 0.573 ' HB2' ' HG3' ' B' ' 381' ' ' PRO . 18.1 mm-40 . . . . . 0 C--N 1.329 -0.322 0 CA-C-N 116.511 -0.313 . . . . 0.0 111.084 179.952 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 302' ' ' VAL . . . . . . . . . . . . . 10.3 p . . . . . 0 C--O 1.231 0.127 0 CA-C-O 120.787 0.327 . . . . 0.0 111.147 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' B' B ' 303' ' ' GLU . . . . . . . . . . . . . 27.7 mt-10 -52.12 -74.08 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.859 -0.609 . . . . 0.0 112.016 -179.407 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 304' ' ' PHE . . . . . . . . . . . . . 90.3 m-85 -50.07 -66.52 0.38 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.968 -0.56 . . . . 0.0 112.291 -178.96 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 305' ' ' ASN . . . . . . . . . . . . . 16.8 m120 -41.77 -61.91 1.01 Allowed 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 112.798 0.666 . . . . 0.0 112.798 -178.704 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 306' ' ' HIS . . . . . . . . . . . . . 11.2 m170 -60.46 -67.52 0.39 Allowed 'General case' 0 C--N 1.33 -0.246 0 N-CA-C 112.703 0.631 . . . . 0.0 112.703 -178.519 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 307' ' ' ALA . . . . . 0.51 ' HA ' HD13 ' A' ' 370' ' ' LEU . . . -48.64 -58.11 5.23 Favored 'General case' 0 C--N 1.33 -0.27 0 N-CA-C 112.388 0.514 . . . . 0.0 112.388 -178.542 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 308' ' ' ILE . . . . . . . . . . . . . 42.8 mm -53.37 -60.0 1.51 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 N-CA-C 112.001 0.371 . . . . 0.0 112.001 -179.247 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 309' ' ' ASN . . . . . . . . . . . . . 91.3 m-20 -57.82 -25.02 60.05 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 120.594 0.235 . . . . 0.0 111.615 -179.298 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 310' ' ' TYR . . . . . . . . . . . . . 36.3 t80 -69.87 -56.27 7.53 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.506 -0.315 . . . . 0.0 111.128 -179.541 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 311' ' ' VAL . . . . . . . . . . . . . 40.7 t -59.29 -44.05 91.33 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.719 179.976 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 312' ' ' ASN . . . . . . . . . . . . . 7.2 t30 -62.01 -39.94 93.98 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.925 179.914 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 313' ' ' LYS . . . . . . . . . . . . . 4.5 ttmm -60.62 -60.17 4.22 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.985 -179.924 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 314' ' ' ILE . . . . . . . . . . . . . 32.3 mt -59.48 -27.71 37.94 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.129 -179.5 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 315' ' ' LYS . . . . . . . . . . . . . 23.3 ttmm -70.18 -40.86 74.41 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.534 -0.303 . . . . 0.0 111.031 179.649 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 316' ' ' ASN . . . . . . . . . . . . . 60.3 t30 -88.89 -8.53 54.08 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.352 -0.386 . . . . 0.0 110.976 -179.716 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 317' ' ' ARG . . . . . . . . . . . . . 20.7 tpp180 -95.34 -61.8 1.41 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.084 -179.933 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 318' ' ' PHE . . . . . . . . . . . . . 73.6 m-85 -94.37 34.73 1.26 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.333 -179.767 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 319' ' ' GLN . . . . . . . . . . . . . 20.9 tm0? -61.62 -31.01 71.07 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.37 179.557 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 320' ' ' GLY . . . . . . . . . . . . . . . -60.33 -62.51 5.94 Favored Glycine 0 C--N 1.332 0.312 0 C-N-CA 120.986 -0.626 . . . . 0.0 112.704 -179.858 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 321' ' ' GLN . . . . . . . . . . . . . 81.8 mm-40 -79.36 111.75 23.08 Favored Pre-proline 0 CA--C 1.531 0.22 0 CA-C-N 116.513 0.157 . . . . 0.0 110.989 -179.865 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 322' ' ' PRO . . . . . . . . . . . . . 97.1 Cg_endo -83.96 -22.81 3.36 Favored 'Trans proline' 0 C--N 1.349 0.582 0 C-N-CA 122.547 2.165 . . . . 0.0 112.619 179.989 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 323' ' ' ASP . . . . . . . . . . . . . 6.7 m-20 -70.12 -49.06 54.5 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.268 -0.423 . . . . 0.0 111.155 -179.725 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 324' ' ' ILE . . . . . . . . . . . . . 51.5 mt -64.7 -47.58 88.2 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.205 -179.825 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 325' ' ' TYR . . . . . . . . . . . . . 23.5 t80 -60.09 -52.4 65.52 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.078 -179.767 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 326' ' ' LYS . . . . . 0.402 ' O ' ' HG3' ' B' ' 330' ' ' GLU . 87.8 tttt -59.36 -36.24 75.38 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.726 179.879 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 327' ' ' ALA . . . . . . . . . . . . . . . -59.9 -52.81 63.82 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.722 179.644 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 328' ' ' PHE . . . . . . . . . . . . . 81.2 t80 -55.51 -49.58 72.21 Favored 'General case' 0 C--O 1.236 0.346 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.74 179.818 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 329' ' ' LEU . . . . . . . . . . . . . 89.4 mt -57.54 -38.47 74.77 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.931 -0.577 . . . . 0.0 111.023 179.89 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 330' ' ' GLU . . . . . 0.402 ' HG3' ' O ' ' B' ' 326' ' ' LYS . 44.7 mt-10 -67.08 -35.35 79.62 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.361 -0.381 . . . . 0.0 111.086 -179.845 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 331' ' ' ILE . . . . . . . . . . . . . 94.4 mt -64.67 -50.91 73.45 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-O 120.855 0.359 . . . . 0.0 110.442 179.348 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 332' ' ' LEU . . . . . . . . . . . . . 4.8 mp -65.97 -31.64 72.67 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.769 179.709 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 333' ' ' HIS . . . . . . . . . . . . . 52.9 t-80 -64.28 -58.06 7.63 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.025 179.34 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 334' ' ' THR . . . . . . . . . . . . . 96.7 m -58.22 -32.44 68.3 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.78 -0.645 . . . . 0.0 110.232 179.139 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 335' ' ' TYR . . . . . . . . . . . . . 74.9 t80 -63.04 -44.43 95.9 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 115.701 -0.681 . . . . 0.0 110.062 179.239 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 336' ' ' GLN . . . . . . . . . . . . . 54.0 tt0 -63.35 -39.47 94.63 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.739 -0.664 . . . . 0.0 110.33 179.488 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 337' ' ' LYS . . . . . . . . . . . . . 14.6 tppt? -58.68 -59.5 5.3 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.929 179.544 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 338' ' ' GLU . . . . . . . . . . . . . 13.6 mm-40 -60.67 -31.08 70.34 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.969 -0.56 . . . . 0.0 111.086 -179.819 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 339' ' ' GLN . . . . . . . . . . . . . 53.5 tt0 -64.47 -45.64 86.51 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.896 0.379 . . . . 0.0 110.793 179.895 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 340' ' ' ARG . . . . . . . . . . . . . 65.7 mtt180 -65.42 -51.61 59.04 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.003 -0.544 . . . . 0.0 111.049 -179.979 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 341' ' ' ASN . . . . . . . . . . . . . 25.8 t-20 -56.43 -39.0 72.36 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.11 -0.496 . . . . 0.0 111.032 -179.8 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 342' ' ' ALA . . . . . . . . . . . . . . . -69.62 -38.64 77.32 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.297 -0.41 . . . . 0.0 111.146 -179.905 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 343' ' ' LYS . . . . . . . . . . . . . 62.8 tttm -65.02 -43.63 91.82 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.262 -0.427 . . . . 0.0 110.888 -179.997 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 344' ' ' GLU . . . . . . . . . . . . . 18.3 mm-40 -70.02 -35.92 74.7 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.041 -179.963 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 345' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.328 -0.336 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.188 -179.893 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' B' B ' 351' ' ' PRO . . . . . . . . . . . . . 48.8 Cg_exo . . . . . 0 C--O 1.231 0.165 0 CA-C-O 120.797 0.249 . . . . 0.0 112.284 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' B' B ' 352' ' ' ALA . . . . . . . . . . . . . . . -86.82 -43.11 12.74 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.177 179.978 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 353' ' ' LEU . . . . . 0.437 ' HG ' ' HG2' ' B' ' 357' ' ' GLU . 6.6 mp -115.64 125.78 53.32 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.954 0.407 . . . . 0.0 111.182 -179.99 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 354' ' ' THR . . . . . . . . . . . . . 74.0 p -114.19 -170.23 1.68 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.509 179.329 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 355' ' ' GLU . . . . . 0.401 ' CD ' ' H ' ' B' ' 355' ' ' GLU . 2.8 mp0 -59.81 -33.69 72.07 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.926 0.393 . . . . 0.0 110.511 179.744 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 356' ' ' GLN . . . . . . . . . . . . . 95.8 mt-30 -74.21 -43.93 55.21 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.006 -0.543 . . . . 0.0 111.331 -179.796 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 357' ' ' GLU . . . . . 0.437 ' HG2' ' HG ' ' B' ' 353' ' ' LEU . 6.2 tp10 -57.23 -48.95 77.53 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 120.992 0.425 . . . . 0.0 110.552 -179.981 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 358' ' ' VAL . . . . . 0.506 ' O ' HG23 ' B' ' 362' ' ' VAL . 73.7 t -64.43 -58.41 7.34 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 115.853 -0.612 . . . . 0.0 111.277 -179.941 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 359' ' ' TYR . . . . . . . . . . . . . 50.1 t80 -53.93 -26.62 26.24 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.598 -0.274 . . . . 0.0 111.159 -179.48 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 360' ' ' ALA . . . . . . . . . . . . . . . -72.48 -60.36 2.27 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.773 0.321 . . . . 0.0 111.147 179.855 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 361' ' ' GLN . . . . . . . . . . . . . 72.7 mt-30 -57.3 -39.44 75.77 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.922 179.886 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 362' ' ' VAL . . . . . 0.506 HG23 ' O ' ' B' ' 358' ' ' VAL . 58.1 t -68.39 -38.59 79.58 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.638 179.637 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 363' ' ' ALA . . . . . 0.509 ' HA ' HD11 ' B' ' 373' ' ' LEU . . . -59.21 -43.76 92.29 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.457 179.43 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 364' ' ' ARG . . . . . . . . . . . . . 41.8 ttm180 -79.99 -21.62 43.43 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.859 -0.61 . . . . 0.0 110.484 179.742 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 365' ' ' LEU . . . . . . . . . . . . . 7.5 tp -58.73 -25.9 63.41 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.44 179.657 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 366' ' ' PHE . . . . . . . . . . . . . 47.2 m-85 -129.05 169.12 15.11 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.757 -0.656 . . . . 0.0 110.38 179.818 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 367' ' ' LYS . . . . . . . . . . . . . 55.9 mtmt -132.2 -79.58 0.5 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.786 0.327 . . . . 0.0 111.131 179.974 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 368' ' ' ASN . . . . . . . . . . . . . 22.3 t-20 -73.5 -12.44 60.78 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.827 -179.859 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 369' ' ' GLN . . . . . . . . . . . . . 26.8 mm-40 -96.54 84.12 3.62 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.104 -179.941 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 370' ' ' GLU . . . . . . . . . . . . . 17.4 mm-40 -94.13 -8.9 38.19 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.67 179.438 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 371' ' ' ASP . . . . . . . . . . . . . 7.4 m-20 -57.64 -63.65 1.17 Allowed 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.911 -179.984 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 372' ' ' LEU . . . . . 0.608 HD12 ' N ' ' B' ' 373' ' ' LEU . 0.4 OUTLIER -57.87 -23.14 51.72 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.994 179.872 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 373' ' ' LEU . . . . . 0.608 ' N ' HD12 ' B' ' 372' ' ' LEU . 4.6 tp -72.69 -39.91 66.66 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.253 179.869 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 374' ' ' SER . . . . . . . . . . . . . 47.4 t -69.16 -51.79 34.6 Favored 'General case' 0 C--O 1.235 0.315 0 CA-C-N 116.025 -0.534 . . . . 0.0 109.916 179.058 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 375' ' ' GLU . . . . . . . . . . . . . 43.0 mt-10 -53.23 -43.61 67.44 Favored 'General case' 0 N--CA 1.455 -0.221 0 CA-C-N 115.791 -0.64 . . . . 0.0 109.698 178.915 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 376' ' ' PHE . . . . . 0.403 ' O ' ' HB2' ' B' ' 379' ' ' PHE . 70.9 t80 -62.81 -39.63 94.9 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 115.714 -0.675 . . . . 0.0 110.043 179.172 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 377' ' ' GLY . . . . . . . . . . . . . . . -58.83 -34.9 79.91 Favored Glycine 0 N--CA 1.449 -0.498 0 C-N-CA 120.735 -0.745 . . . . 0.0 111.724 179.32 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 378' ' ' GLN . . . . . . . . . . . . . 55.8 mt-30 -62.99 -30.92 71.97 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.654 0.264 . . . . 0.0 110.962 179.534 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 379' ' ' PHE . . . . . 0.403 ' HB2' ' O ' ' B' ' 376' ' ' PHE . 50.2 m-85 -61.45 -35.34 77.32 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.354 -0.384 . . . . 0.0 110.74 179.715 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 380' ' ' LEU . . . . . . . . . . . . . 89.4 mt -56.07 138.25 72.92 Favored Pre-proline 0 C--N 1.329 -0.289 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.864 179.884 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 381' ' ' PRO . . . . . 0.573 ' HG3' ' HB2' ' A' ' 376' ' ' GLN . 72.3 Cg_exo . . . . . 0 C--N 1.347 0.473 0 C-N-CA 122.447 2.098 . . . . 0.0 112.309 179.953 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 366' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.232 0.147 0 CA-C-O 120.861 0.362 . . . . 0.0 110.89 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 367' ' ' VAL . . . . . . . . . . . . . 26.9 m -51.22 -21.42 1.5 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.209 0 CA-C-N 115.974 -0.557 . . . . 0.0 111.732 -179.871 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 368' ' ' TYR . . . . . . . . . . . . . 45.7 m-85 -65.19 -61.08 2.35 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.58 -0.282 . . . . 0.0 110.836 179.758 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 369' ' ' VAL . . . . . 0.671 HG13 HD22 ' A' ' 370' ' ' LEU . 2.9 p -64.25 -43.63 97.27 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.204 0 CA-C-N 116.551 -0.295 . . . . 0.0 111.541 -179.882 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 370' ' ' LEU . . . . . 0.671 HD22 HG13 ' A' ' 369' ' ' VAL . 4.2 mm? -57.9 -59.59 5.01 Favored 'General case' 0 C--O 1.235 0.295 0 CA-C-O 120.936 0.398 . . . . 0.0 111.254 -179.955 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 371' ' ' SER . . . . . . . . . . . . . 55.2 m -59.84 -32.33 70.57 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.041 -179.844 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 372' ' ' SER . . . . . . . . . . . . . 47.8 t -59.51 -50.08 75.3 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.849 0.357 . . . . 0.0 110.972 179.904 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 373' ' ' MET . . . . . . . . . . . . . 83.8 mtp -67.1 -34.64 78.07 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.48 -179.749 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 374' ' ' ALA . . . . . . . . . . . . . . . -83.66 -12.69 55.61 Favored 'General case' 0 C--N 1.33 -0.267 0 N-CA-C 112.161 0.43 . . . . 0.0 112.161 -179.239 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 375' ' ' ARG . . . . . . . . . . . . . 27.4 tpt180 -108.74 -13.05 14.85 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.75 0.309 . . . . 0.0 111.059 -179.757 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 376' ' ' GLN . . . . . 0.541 ' HB3' ' HG3' ' B' ' 381' ' ' PRO . 34.2 tt0 . . . . . 0 C--N 1.331 -0.215 0 CA-C-O 121.002 0.43 . . . . 0.0 110.573 179.764 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 302' ' ' VAL . . . . . . . . . . . . . 12.8 p . . . . . 0 CA--C 1.528 0.134 0 CA-C-O 120.699 0.285 . . . . 0.0 111.689 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' B' B ' 303' ' ' GLU . . . . . . . . . . . . . 44.2 mt-10 -56.8 -87.35 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.404 -0.362 . . . . 0.0 111.638 -179.461 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 304' ' ' PHE . . . . . . . . . . . . . 42.6 p90 -65.61 -21.12 66.55 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.319 -0.401 . . . . 0.0 111.722 -179.176 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 305' ' ' ASN . . . . . . . . . . . . . 6.2 t30 -68.37 -64.68 0.82 Allowed 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.777 0.322 . . . . 0.0 111.032 -179.744 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 306' ' ' HIS . . . . . . . . . . . . . 18.8 t-160 -64.74 -34.44 78.32 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.3 -179.435 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 307' ' ' ALA . . . . . . . . . . . . . . . -64.43 -59.54 4.22 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.497 -0.32 . . . . 0.0 111.456 -179.736 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 308' ' ' ILE . . . . . . . . . . . . . 94.5 mt -56.98 -49.51 79.07 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 CA-C-N 116.53 -0.305 . . . . 0.0 111.406 -179.796 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 309' ' ' ASN . . . . . . . . . . . . . 3.6 m-20 -55.55 -40.93 72.54 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.809 0.338 . . . . 0.0 110.812 179.832 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 310' ' ' TYR . . . . . 0.454 ' O ' HG12 ' B' ' 314' ' ' ILE . 84.1 t80 -62.5 -64.24 0.98 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.902 -179.99 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 311' ' ' VAL . . . . . . . . . . . . . 55.4 t -52.84 -24.03 6.29 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.221 0 CA-C-O 120.873 0.368 . . . . 0.0 110.894 179.986 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 312' ' ' ASN . . . . . . . . . . . . . 44.2 t30 -69.89 -56.82 6.05 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.066 179.855 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 313' ' ' LYS . . . . . 0.435 ' HD3' ' N ' ' B' ' 314' ' ' ILE . 0.0 OUTLIER -66.28 -23.55 66.41 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-O 120.775 0.322 . . . . 0.0 111.152 -179.907 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 314' ' ' ILE . . . . . 0.454 HG12 ' O ' ' B' ' 310' ' ' TYR . 31.2 mm -74.65 -43.55 47.57 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 116.392 -0.367 . . . . 0.0 110.754 179.805 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 315' ' ' LYS . . . . . . . . . . . . . 25.5 ttpp -73.42 -27.64 61.55 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.785 179.84 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 316' ' ' ASN . . . . . . . . . . . . . 30.6 t30 -74.32 -50.48 18.61 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.958 179.885 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 317' ' ' ARG . . . . . . . . . . . . . 27.3 mmm180 -61.64 -53.64 53.49 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.142 179.979 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 318' ' ' PHE . . . . . . . . . . . . . 75.6 m-85 -90.77 31.62 1.05 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.082 -179.847 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 319' ' ' GLN . . . . . . . . . . . . . 35.3 tt0 -61.91 -25.64 67.69 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.851 179.936 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 320' ' ' GLY . . . . . . . . . . . . . . . -94.48 -18.38 35.93 Favored Glycine 0 N--CA 1.451 -0.361 0 C-N-CA 120.858 -0.687 . . . . 0.0 112.455 179.971 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 321' ' ' GLN . . . . . . . . . . . . . 8.7 tp-100 -109.83 91.47 10.8 Favored Pre-proline 0 C--N 1.33 -0.273 0 CA-C-O 120.437 0.16 . . . . 0.0 110.731 179.947 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 322' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_endo -76.26 -12.73 19.07 Favored 'Trans proline' 0 C--N 1.348 0.515 0 C-N-CA 122.552 2.168 . . . . 0.0 112.548 -179.891 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 323' ' ' ASP . . . . . . . . . . . . . 20.2 t70 -70.82 -56.32 6.58 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.19 -179.854 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 324' ' ' ILE . . . . . . . . . . . . . 62.1 mt -62.44 -40.63 88.79 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.222 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.096 -179.868 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 325' ' ' TYR . . . . . 0.422 ' CE2' HD11 ' B' ' 329' ' ' LEU . 35.0 t80 -63.22 -48.64 77.42 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.589 179.767 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 326' ' ' LYS . . . . . . . . . . . . . 41.0 ttmt -60.55 -37.3 80.79 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.706 179.887 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 327' ' ' ALA . . . . . . . . . . . . . . . -62.1 -54.48 40.69 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.133 179.941 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 328' ' ' PHE . . . . . . . . . . . . . 62.7 t80 -53.62 -45.55 70.14 Favored 'General case' 0 C--O 1.234 0.275 0 CA-C-O 121.008 0.432 . . . . 0.0 110.501 179.899 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 329' ' ' LEU . . . . . 0.422 HD11 ' CE2' ' B' ' 325' ' ' TYR . 92.1 mt -59.21 -43.34 92.3 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.868 -0.606 . . . . 0.0 110.645 179.56 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 330' ' ' GLU . . . . . . . . . . . . . 40.6 mt-10 -59.64 -37.79 79.65 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.763 179.713 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 331' ' ' ILE . . . . . . . . . . . . . 76.1 mt -63.47 -56.6 16.08 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.806 179.728 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 332' ' ' LEU . . . . . 0.41 HD23 HD22 ' A' ' 370' ' ' LEU . 7.3 mp -66.28 -19.19 65.75 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.257 -179.984 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 333' ' ' HIS . . . . . . . . . . . . . 34.6 t-80 -71.61 -59.52 2.71 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 121.031 0.443 . . . . 0.0 110.09 179.284 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 334' ' ' THR . . . . . . . . . . . . . 88.7 m -62.41 -29.77 70.74 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.049 179.21 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 335' ' ' TYR . . . . . . . . . . . . . 69.8 t80 -69.14 -41.55 77.18 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 115.729 -0.669 . . . . 0.0 110.488 179.461 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 336' ' ' GLN . . . . . 0.433 ' HB2' ' HB ' ' A' ' 369' ' ' VAL . 26.3 tt0 -68.23 -33.38 74.3 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.693 -179.993 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 337' ' ' LYS . . . . . 0.558 ' O ' ' HG2' ' B' ' 340' ' ' ARG . 1.0 OUTLIER -72.96 -47.95 40.99 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.885 -179.976 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 338' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -65.78 -28.27 68.89 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.034 0.445 . . . . 0.0 109.873 179.434 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 339' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -73.83 -49.39 25.4 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 115.716 -0.675 . . . . 0.0 110.497 179.407 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 340' ' ' ARG . . . . . 0.572 ' HG3' ' N ' ' B' ' 341' ' ' ASN . 14.9 ptm180 -56.46 -51.83 66.97 Favored 'General case' 0 C--N 1.333 -0.138 0 CA-C-O 121.078 0.466 . . . . 0.0 110.742 -179.838 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 341' ' ' ASN . . . . . 0.572 ' N ' ' HG3' ' B' ' 340' ' ' ARG . 65.7 t30 -58.72 -47.66 83.82 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.62 -0.718 . . . . 0.0 110.732 179.387 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 342' ' ' ALA . . . . . . . . . . . . . . . -63.79 -23.08 67.22 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.022 179.788 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 343' ' ' LYS . . . . . . . . . . . . . 88.0 tttt -78.77 -39.06 37.04 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.799 179.924 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 344' ' ' GLU . . . . . . . . . . . . . 7.0 mm-40 -75.64 -26.97 58.19 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.831 179.829 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 345' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.328 -0.331 0 CA-C-N 116.042 -0.526 . . . . 0.0 111.029 -179.905 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' B' B ' 351' ' ' PRO . . . . . . . . . . . . . 34.9 Cg_exo . . . . . 0 C--O 1.232 0.22 0 CA-C-O 120.866 0.277 . . . . 0.0 112.638 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' B' B ' 352' ' ' ALA . . . . . . . . . . . . . . . -98.27 -73.57 0.61 Allowed 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.453 -179.751 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 353' ' ' LEU . . . . . 0.514 HD22 ' HG2' ' B' ' 357' ' ' GLU . 40.6 mt -99.25 133.32 43.71 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.934 0.397 . . . . 0.0 111.15 -179.778 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 354' ' ' THR . . . . . . . . . . . . . 57.6 p -104.08 -178.31 3.62 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.791 179.842 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 355' ' ' GLU . . . . . . . . . . . . . 41.4 mt-10 -60.65 -39.53 88.67 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.833 0.349 . . . . 0.0 110.786 179.914 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 356' ' ' GLN . . . . . . . . . . . . . 29.1 mm-40 -70.57 -38.82 74.14 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.0 -179.961 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 357' ' ' GLU . . . . . 0.514 ' HG2' HD22 ' B' ' 353' ' ' LEU . 9.6 tp10 -61.55 -49.37 76.94 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.41 -0.359 . . . . 0.0 110.55 179.999 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 358' ' ' VAL . . . . . 0.49 ' O ' HG23 ' B' ' 362' ' ' VAL . 53.3 t -61.42 -56.67 16.29 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.94 179.688 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 359' ' ' TYR . . . . . . . . . . . . . 2.8 t80 -53.96 -30.36 46.47 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.445 -0.343 . . . . 0.0 110.788 -179.802 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 360' ' ' ALA . . . . . . . . . . . . . . . -66.92 -60.42 2.66 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.165 179.821 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 361' ' ' GLN . . . . . . . . . . . . . 47.0 mt-30 -57.46 -39.01 75.41 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.477 179.865 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 362' ' ' VAL . . . . . 0.49 HG23 ' O ' ' B' ' 358' ' ' VAL . 94.2 t -66.53 -33.72 65.34 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.198 179.298 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 363' ' ' ALA . . . . . 0.554 ' HA ' HD21 ' B' ' 373' ' ' LEU . . . -63.85 -43.1 97.16 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.174 179.264 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 364' ' ' ARG . . . . . . . . . . . . . 9.6 mpt_? -80.06 -17.45 52.66 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.811 -0.631 . . . . 0.0 110.161 178.896 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 365' ' ' LEU . . . . . . . . . . . . . 14.1 tp -68.78 -40.76 79.51 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.787 -0.642 . . . . 0.0 111.226 -179.917 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 366' ' ' PHE . . . . . 0.682 ' HB3' ' HB2' ' B' ' 369' ' ' GLN . 32.8 m-85 -106.4 -29.84 9.49 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.438 -0.346 . . . . 0.0 111.393 -179.522 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 367' ' ' LYS . . . . . . . . . . . . . 92.0 mttt 54.01 -96.62 0.06 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.209 -0.451 . . . . 0.0 112.19 179.892 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 368' ' ' ASN . . . . . . . . . . . . . 18.5 m120 -54.75 -46.4 74.32 Favored 'General case' 0 N--CA 1.462 0.139 0 CA-C-N 116.541 -0.299 . . . . 0.0 111.561 -179.192 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 369' ' ' GLN . . . . . 0.682 ' HB2' ' HB3' ' B' ' 366' ' ' PHE . 2.1 mp0 -66.4 97.92 0.45 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.429 -0.35 . . . . 0.0 111.035 -179.778 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 370' ' ' GLU . . . . . . . . . . . . . 43.9 tt0 -93.69 -17.8 22.82 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.97 179.907 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 371' ' ' ASP . . . . . . . . . . . . . 6.9 m-20 -54.78 -45.35 74.27 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.31 -0.404 . . . . 0.0 110.676 179.81 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 372' ' ' LEU . . . . . 0.561 HD13 ' HB3' ' B' ' 369' ' ' GLN . 6.4 mp -64.85 -41.83 95.39 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.505 179.51 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 373' ' ' LEU . . . . . 0.554 HD21 ' HA ' ' B' ' 363' ' ' ALA . 1.1 mp -61.13 -32.2 71.9 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.808 179.842 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 374' ' ' SER . . . . . . . . . . . . . 56.0 m -71.61 -52.13 19.67 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.036 179.28 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 375' ' ' GLU . . . . . . . . . . . . . 7.7 tp10 -58.05 -33.05 68.59 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 115.732 -0.667 . . . . 0.0 109.898 179.279 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 376' ' ' PHE . . . . . . . . . . . . . 54.0 t80 -79.4 -27.81 41.81 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.736 -0.665 . . . . 0.0 109.906 179.263 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 377' ' ' GLY . . . . . . . . . . . . . . . -64.29 -41.2 98.32 Favored Glycine 0 N--CA 1.448 -0.546 0 C-N-CA 120.673 -0.775 . . . . 0.0 111.317 179.076 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 378' ' ' GLN . . . . . . . . . . . . . 46.1 mt-30 -71.63 -23.44 61.69 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.915 0.388 . . . . 0.0 110.144 179.095 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 379' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -62.33 -31.8 72.48 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-N 115.813 -0.631 . . . . 0.0 110.576 179.407 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 380' ' ' LEU . . . . . . . . . . . . . 39.8 mt -61.92 147.57 89.58 Favored Pre-proline 0 C--N 1.33 -0.28 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.714 -179.964 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 381' ' ' PRO . . . . . 0.541 ' HG3' ' HB3' ' A' ' 376' ' ' GLN . 52.1 Cg_exo . . . . . 0 C--N 1.347 0.456 0 C-N-CA 122.391 2.061 . . . . 0.0 112.333 179.946 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 366' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.233 0.223 0 CA-C-O 120.775 0.321 . . . . 0.0 111.618 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 367' ' ' VAL . . . . . . . . . . . . . 35.7 m -54.88 -35.14 32.84 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.925 179.904 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 368' ' ' TYR . . . . . . . . . . . . . 68.7 m-85 -71.04 -24.24 62.31 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.487 179.531 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 369' ' ' VAL . . . . . 0.592 HG22 ' HB2' ' B' ' 336' ' ' GLN . 6.7 t -73.03 -57.73 6.37 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.195 179.383 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 370' ' ' LEU . . . . . 0.478 ' H ' HD22 ' A' ' 370' ' ' LEU . 3.2 mm? -58.56 -37.91 76.74 Favored 'General case' 0 C--O 1.233 0.201 0 CA-C-N 115.763 -0.653 . . . . 0.0 110.443 179.793 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 371' ' ' SER . . . . . 0.641 ' HA ' ' HB2' ' B' ' 303' ' ' GLU . 99.0 p -63.53 -55.87 20.5 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.901 179.928 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 372' ' ' SER . . . . . . . . . . . . . 91.4 p -54.48 -34.37 61.44 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.3 -179.806 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 373' ' ' MET . . . . . . . . . . . . . 56.6 mtt -66.69 -52.26 46.78 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.522 -179.971 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 374' ' ' ALA . . . . . 0.43 ' HB3' ' HB3' ' B' ' 303' ' ' GLU . . . -81.6 -6.74 59.29 Favored 'General case' 0 C--N 1.331 -0.236 0 N-CA-C 112.387 0.514 . . . . 0.0 112.387 -178.973 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 375' ' ' ARG . . . . . . . . . . . . . 18.7 mmt180 -94.82 -42.58 8.63 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.81 0.338 . . . . 0.0 111.164 179.88 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 376' ' ' GLN . . . . . . . . . . . . . 44.2 tt0 . . . . . 0 C--N 1.33 -0.275 0 CA-C-N 116.046 -0.524 . . . . 0.0 111.077 -179.579 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' B' B ' 302' ' ' VAL . . . . . 0.571 HG13 ' H ' ' B' ' 303' ' ' GLU . 2.7 p . . . . . 0 C--O 1.233 0.193 0 N-CA-C 111.761 0.282 . . . . 0.0 111.761 . . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 303' ' ' GLU . . . . . 0.641 ' HB2' ' HA ' ' A' ' 371' ' ' SER . 0.1 OUTLIER -62.13 -29.71 70.52 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.404 -0.362 . . . . 0.0 111.769 -179.058 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' B' B ' 304' ' ' PHE . . . . . 0.443 ' O ' HD13 ' B' ' 308' ' ' ILE . 67.3 t80 -63.0 -71.33 0.17 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.77 0.319 . . . . 0.0 111.188 -179.648 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 305' ' ' ASN . . . . . . . . . . . . . 27.2 t-20 -53.68 -42.86 68.39 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.582 -179.413 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 306' ' ' HIS . . . . . . . . . . . . . 8.5 m-70 -62.53 -67.7 0.4 Allowed 'General case' 0 C--N 1.331 -0.22 0 N-CA-C 112.083 0.401 . . . . 0.0 112.083 -179.225 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 307' ' ' ALA . . . . . . . . . . . . . . . -49.89 -52.74 30.59 Favored 'General case' 0 N--CA 1.465 0.289 0 N-CA-C 112.331 0.493 . . . . 0.0 112.331 -178.905 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 308' ' ' ILE . . . . . 0.443 HD13 ' O ' ' B' ' 304' ' ' PHE . 1.7 mp -54.93 -58.96 2.79 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-O 120.595 0.236 . . . . 0.0 111.439 -179.617 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 309' ' ' ASN . . . . . . . . . . . . . 14.1 m120 -61.52 -19.4 62.07 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.546 -0.297 . . . . 0.0 111.265 -179.646 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 310' ' ' TYR . . . . . . . . . . . . . 24.0 t80 -74.95 -57.28 4.0 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.416 -0.356 . . . . 0.0 111.326 -179.479 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 311' ' ' VAL . . . . . . . . . . . . . 5.8 m -63.19 -33.69 62.42 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.203 0 CA-C-O 120.87 0.367 . . . . 0.0 110.639 -179.818 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 312' ' ' ASN . . . . . . . . . . . . . 6.3 t30 -70.11 -42.88 72.09 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.585 179.751 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 313' ' ' LYS . . . . . . . . . . . . . 4.5 ttmm -60.23 -49.57 77.11 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.035 179.807 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 314' ' ' ILE . . . . . . . . . . . . . 75.8 mt -64.6 -39.59 86.12 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.658 -179.43 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 315' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -65.51 -40.2 92.72 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.744 0.307 . . . . 0.0 111.095 -179.714 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 316' ' ' ASN . . . . . . . . . . . . . 28.2 t-20 -68.77 -51.35 42.06 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.321 -0.399 . . . . 0.0 111.355 -179.479 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 317' ' ' ARG . . . . . 0.569 HH22 HD11 ' B' ' 372' ' ' LEU . 35.7 mtm180 -59.99 -59.08 6.0 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.384 -0.371 . . . . 0.0 111.071 -179.91 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 318' ' ' PHE . . . . . . . . . . . . . 95.1 m-85 -87.65 40.87 0.96 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.917 -179.97 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 319' ' ' GLN . . . . . . . . . . . . . 63.3 tt0 -59.5 -33.64 71.6 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.972 -179.875 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 320' ' ' GLY . . . . . . . . . . . . . . . -80.27 -14.32 80.53 Favored Glycine 0 N--CA 1.452 -0.256 0 C-N-CA 120.853 -0.689 . . . . 0.0 112.261 179.735 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 321' ' ' GLN . . . . . . . . . . . . . 6.1 tp-100 -118.07 83.29 19.18 Favored Pre-proline 0 C--N 1.329 -0.315 0 CA-C-O 120.528 0.204 . . . . 0.0 110.802 -179.998 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 322' ' ' PRO . . . . . . . . . . . . . 76.5 Cg_endo -77.71 -10.17 17.06 Favored 'Trans proline' 0 C--N 1.346 0.404 0 C-N-CA 122.386 2.058 . . . . 0.0 112.338 179.844 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 323' ' ' ASP . . . . . . . . . . . . . 9.5 m-20 -70.08 -52.78 21.07 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.07 -0.514 . . . . 0.0 111.191 -179.742 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 324' ' ' ILE . . . . . . . . . . . . . 71.3 mt -63.89 -46.34 94.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.425 -0.352 . . . . 0.0 111.246 -179.904 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 325' ' ' TYR . . . . . . . . . . . . . 68.8 t80 -58.15 -58.27 9.21 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.155 179.982 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 326' ' ' LYS . . . . . . . . . . . . . 39.4 ttmt -56.95 -41.47 78.35 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.121 -179.728 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 327' ' ' ALA . . . . . . . . . . . . . . . -57.02 -48.29 78.85 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.907 0.384 . . . . 0.0 111.148 -179.997 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 328' ' ' PHE . . . . . . . . . . . . . 45.7 t80 -58.56 -53.87 53.43 Favored 'General case' 0 C--O 1.237 0.435 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.664 179.931 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 329' ' ' LEU . . . . . . . . . . . . . 10.4 mp -60.82 -26.71 67.51 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.979 -179.844 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 330' ' ' GLU . . . . . . . . . . . . . 28.4 mt-10 -70.38 -42.32 71.89 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.852 0.358 . . . . 0.0 110.207 179.306 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 331' ' ' ILE . . . . . 0.509 HG22 HG22 ' B' ' 358' ' ' VAL . 93.8 mt -61.03 -48.03 90.92 Favored 'Isoleucine or valine' 0 C--O 1.233 0.224 0 CA-C-N 116.126 -0.488 . . . . 0.0 109.956 179.085 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 332' ' ' LEU . . . . . . . . . . . . . 10.8 mp -64.81 -33.66 76.52 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 115.813 -0.631 . . . . 0.0 110.512 179.427 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 333' ' ' HIS . . . . . . . . . . . . . 43.3 t60 -60.83 -54.15 48.67 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.057 -0.52 . . . . 0.0 109.956 179.297 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 334' ' ' THR . . . . . . . . . . . . . 62.8 m -61.35 -30.48 70.54 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.687 -0.688 . . . . 0.0 110.338 179.238 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 335' ' ' TYR . . . . . . . . . . . . . 67.8 t80 -60.62 -53.79 53.19 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.844 -0.617 . . . . 0.0 111.158 179.696 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 336' ' ' GLN . . . . . 0.592 ' HB2' HG22 ' A' ' 369' ' ' VAL . 6.4 tp-100 -65.89 -36.64 83.97 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.417 -0.356 . . . . 0.0 111.029 -179.928 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 337' ' ' LYS . . . . . . . . . . . . . 39.8 ttpt -57.89 -56.65 19.27 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.951 0.405 . . . . 0.0 110.995 179.9 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 338' ' ' GLU . . . . . 0.462 ' HG3' ' HB3' ' B' ' 352' ' ' ALA . 19.5 mm-40 -64.11 -36.25 83.42 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.037 -0.528 . . . . 0.0 111.289 -179.857 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 339' ' ' GLN . . . . . . . . . . . . . 6.5 tp-100 -61.0 -46.07 92.25 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.312 -0.403 . . . . 0.0 110.847 179.968 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 340' ' ' ARG . . . . . . . . . . . . . 96.6 mtt180 -63.87 -51.71 63.32 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.652 179.836 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 341' ' ' ASN . . . . . . . . . . . . . 74.9 m-20 -56.59 -33.44 66.21 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.8 179.706 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 342' ' ' ALA . . . . . . . . . . . . . . . -72.75 -37.05 67.82 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.011 179.885 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 343' ' ' LYS . . . . . . . . . . . . . 64.6 tttp -71.85 -28.07 63.31 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.978 -0.555 . . . . 0.0 110.497 179.803 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 344' ' ' GLU . . . . . . . . . . . . . 17.3 mm-40 -77.9 -41.32 36.95 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.912 -0.585 . . . . 0.0 110.788 179.681 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 345' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.33 -0.269 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.272 179.898 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' B' B ' 351' ' ' PRO . . . . . . . . . . . . . 45.9 Cg_exo . . . . . 0 C--O 1.232 0.189 0 CA-C-O 120.727 0.22 . . . . 0.0 112.325 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' B' B ' 352' ' ' ALA . . . . . 0.462 ' HB3' ' HG3' ' B' ' 338' ' ' GLU . . . -70.11 -76.95 0.09 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.133 179.993 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 353' ' ' LEU . . . . . 0.608 ' HB3' ' HG2' ' B' ' 357' ' ' GLU . 0.3 OUTLIER -107.32 154.85 20.66 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 121.095 0.474 . . . . 0.0 111.726 179.965 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' B' B ' 354' ' ' THR . . . . . . . . . . . . . 59.6 p -114.85 -172.91 2.21 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.871 -0.604 . . . . 0.0 110.767 179.586 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 355' ' ' GLU . . . . . . . . . . . . . 7.8 pt-20 -58.92 -42.73 90.4 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 121.309 0.576 . . . . 0.0 110.072 179.577 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 356' ' ' GLN . . . . . . . . . . . . . 28.9 tt0 -64.56 -38.37 90.77 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.394 -0.821 . . . . 0.0 110.97 179.656 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 357' ' ' GLU . . . . . 0.608 ' HG2' ' HB3' ' B' ' 353' ' ' LEU . 4.6 tp10 -61.21 -50.03 74.75 Favored 'General case' 0 C--N 1.333 -0.138 0 CA-C-O 120.807 0.337 . . . . 0.0 110.506 179.948 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 358' ' ' VAL . . . . . 0.59 ' O ' HG23 ' B' ' 362' ' ' VAL . 93.5 t -59.09 -60.55 2.25 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.069 -0.514 . . . . 0.0 111.014 179.991 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 359' ' ' TYR . . . . . . . . . . . . . 2.2 t80 -52.0 -33.44 38.21 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.521 -0.309 . . . . 0.0 111.014 -179.325 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 360' ' ' ALA . . . . . . . . . . . . . . . -65.58 -60.59 2.76 Favored 'General case' 0 C--O 1.234 0.246 0 CA-C-N 116.502 -0.317 . . . . 0.0 111.242 179.896 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 361' ' ' GLN . . . . . . . . . . . . . 92.3 mt-30 -58.15 -36.23 72.7 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.98 0.419 . . . . 0.0 110.414 179.923 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 362' ' ' VAL . . . . . 0.59 HG23 ' O ' ' B' ' 358' ' ' VAL . 66.1 t -70.64 -32.05 48.17 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 115.902 -0.59 . . . . 0.0 109.988 179.246 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 363' ' ' ALA . . . . . 0.576 ' HA ' HD21 ' B' ' 373' ' ' LEU . . . -65.16 -38.87 91.96 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 115.914 -0.585 . . . . 0.0 109.876 179.124 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 364' ' ' ARG . . . . . . . . . . . . . 31.8 ttm180 -80.85 -23.41 39.12 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.574 -0.739 . . . . 0.0 110.109 179.011 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 365' ' ' LEU . . . . . . . . . . . . . 8.3 tp -58.12 -24.84 60.22 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.826 -0.625 . . . . 0.0 110.185 179.523 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 366' ' ' PHE . . . . . 0.474 ' HB3' ' HB2' ' B' ' 369' ' ' GLN . 38.1 m-85 -129.07 179.85 5.52 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.742 -0.663 . . . . 0.0 110.423 179.708 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 367' ' ' LYS . . . . . . . . . . . . . 98.4 mttt -138.49 -80.61 0.33 Allowed 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.584 -0.28 . . . . 0.0 111.246 179.904 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 368' ' ' ASN . . . . . . . . . . . . . 28.0 p30 -79.96 7.67 8.5 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.275 -0.421 . . . . 0.0 110.887 -179.886 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 369' ' ' GLN . . . . . 0.709 ' HB3' HD13 ' B' ' 372' ' ' LEU . 44.5 mt-30 -103.38 91.67 4.16 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.022 -0.536 . . . . 0.0 111.436 -179.788 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 370' ' ' GLU . . . . . . . . . . . . . 42.5 mt-10 -94.54 -20.24 19.81 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.875 179.504 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 371' ' ' ASP . . . . . . . . . . . . . 23.5 t70 -59.09 -45.3 91.2 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.69 179.748 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 372' ' ' LEU . . . . . 0.709 HD13 ' HB3' ' B' ' 369' ' ' GLN . 6.6 mp -62.5 -51.82 65.91 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.731 179.593 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 373' ' ' LEU . . . . . 0.576 HD21 ' HA ' ' B' ' 363' ' ' ALA . 1.1 mp -55.88 -37.47 68.87 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.797 -0.638 . . . . 0.0 111.282 -179.749 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 374' ' ' SER . . . . . . . . . . . . . 70.1 m -69.25 -53.39 20.07 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.676 179.754 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 375' ' ' GLU . . . . . . . . . . . . . 39.4 mm-40 -52.56 -36.76 56.5 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.259 179.485 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 376' ' ' PHE . . . . . . . . . . . . . 91.8 t80 -70.24 -41.09 73.99 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.28 179.429 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 377' ' ' GLY . . . . . . . . . . . . . . . -60.2 -32.59 76.93 Favored Glycine 0 N--CA 1.45 -0.379 0 C-N-CA 120.768 -0.729 . . . . 0.0 112.086 179.536 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 378' ' ' GLN . . . . . . . . . . . . . 75.9 mt-30 -60.31 -29.73 69.04 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.798 0.332 . . . . 0.0 110.614 179.656 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 379' ' ' PHE . . . . . . . . . . . . . 75.1 m-85 -69.9 -34.53 73.64 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.789 179.733 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 380' ' ' LEU . . . . . 0.427 ' HA ' ' HD2' ' B' ' 381' ' ' PRO . 90.8 mt -51.51 113.37 3.93 Favored Pre-proline 0 C--N 1.332 -0.164 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.612 179.861 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 381' ' ' PRO . . . . . 0.427 ' HD2' ' HA ' ' B' ' 380' ' ' LEU . 16.0 Cg_endo . . . . . 0 C--N 1.349 0.568 0 C-N-CA 122.312 2.008 . . . . 0.0 112.338 -179.726 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 366' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.232 0.173 0 CA-C-O 120.839 0.352 . . . . 0.0 110.911 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 367' ' ' VAL . . . . . . . . . . . . . 18.9 t -67.6 -21.27 27.28 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.788 179.891 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 368' ' ' TYR . . . . . . . . . . . . . 57.9 t80 -73.25 -48.99 30.26 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.977 -179.898 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 369' ' ' VAL . . . . . . . . . . . . . 14.6 m -70.11 -36.48 68.34 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.448 -179.782 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 370' ' ' LEU . . . . . 0.563 HD23 ' HA ' ' B' ' 307' ' ' ALA . 6.5 mp -69.35 -47.43 64.35 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.427 -0.352 . . . . 0.0 111.052 179.721 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 371' ' ' SER . . . . . 0.478 ' HB3' ' HB3' ' B' ' 303' ' ' GLU . 72.1 m -64.27 -38.84 92.48 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.294 -179.962 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 372' ' ' SER . . . . . . . . . . . . . 67.9 m -71.22 -61.33 1.81 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.475 -179.662 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 373' ' ' MET . . . . . 0.456 ' HB3' ' HD3' ' B' ' 381' ' ' PRO . 73.9 mtm -50.38 -41.06 51.3 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.626 -179.459 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 374' ' ' ALA . . . . . . . . . . . . . . . -73.01 -41.8 63.89 Favored 'General case' 0 C--N 1.331 -0.223 0 N-CA-C 112.008 0.373 . . . . 0.0 112.008 -179.426 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 375' ' ' ARG . . . . . 0.417 ' HB2' ' HG2' ' B' ' 303' ' ' GLU . 30.3 tpt180 -70.29 -23.08 62.8 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.692 0.282 . . . . 0.0 111.395 -179.55 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 376' ' ' GLN . . . . . . . . . . . . . 85.4 mm-40 . . . . . 0 C--N 1.33 -0.258 0 CA-C-N 116.424 -0.353 . . . . 0.0 111.119 -179.768 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' B' B ' 302' ' ' VAL . . . . . . . . . . . . . 15.0 p . . . . . 0 C--O 1.232 0.134 0 CA-C-O 120.845 0.355 . . . . 0.0 111.178 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' B' B ' 303' ' ' GLU . . . . . 0.478 ' HB3' ' HB3' ' A' ' 371' ' ' SER . 44.2 mt-10 -57.88 -78.77 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.974 -0.557 . . . . 0.0 111.647 -179.661 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 304' ' ' PHE . . . . . . . . . . . . . 64.7 m-85 -59.06 -31.55 68.97 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.898 -0.592 . . . . 0.0 111.914 -179.217 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 305' ' ' ASN . . . . . . . . . . . . . 26.9 t-20 -62.95 -71.4 0.16 Allowed 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.672 0.272 . . . . 0.0 111.57 -179.417 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 306' ' ' HIS . . . . . . . . . . . . . 4.3 t-160 -53.99 -41.1 67.55 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.36 -0.382 . . . . 0.0 111.509 -179.116 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 307' ' ' ALA . . . . . 0.563 ' HA ' HD23 ' A' ' 370' ' ' LEU . . . -60.72 -54.99 38.53 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.473 -0.33 . . . . 0.0 111.679 -179.564 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 308' ' ' ILE . . . . . . . . . . . . . 21.2 mm -57.09 -52.34 57.46 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.195 0 CA-C-N 116.662 -0.245 . . . . 0.0 111.407 -179.736 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 309' ' ' ASN . . . . . . . . . . . . . 28.5 m-80 -55.52 -34.65 64.85 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.473 -0.331 . . . . 0.0 111.211 -179.74 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 310' ' ' TYR . . . . . . . . . . . . . 80.6 t80 -66.5 -56.54 10.41 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.424 -0.353 . . . . 0.0 111.109 179.971 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 311' ' ' VAL . . . . . . . . . . . . . 61.5 t -56.14 -49.07 77.98 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.213 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.129 -179.832 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 312' ' ' ASN . . . . . . . . . . . . . 28.0 t-20 -61.99 -39.12 91.12 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.77 179.896 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 313' ' ' LYS . . . . . . . . . . . . . 42.9 tttp -55.12 -61.16 2.5 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.687 179.846 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 314' ' ' ILE . . . . . . . . . . . . . 98.2 mt -62.48 -28.07 44.0 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.077 -0.51 . . . . 0.0 111.177 -179.9 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 315' ' ' LYS . . . . . . . . . . . . . 1.6 tmmt? -67.21 -33.84 76.24 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.356 -0.383 . . . . 0.0 110.973 -179.851 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 316' ' ' ASN . . . . . . . . . . . . . 7.1 t30 -87.56 -50.45 6.51 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.454 -179.76 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 317' ' ' ARG . . . . . . . . . . . . . 29.3 mmm180 -57.75 -57.49 12.53 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.088 -179.728 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 318' ' ' PHE . . . . . . . . . . . . . 44.0 m-85 -88.41 39.54 0.91 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.944 -179.913 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 319' ' ' GLN . . . . . . . . . . . . . 51.7 tt0 -65.74 -18.04 65.05 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.594 179.815 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 320' ' ' GLY . . . . . . . . . . . . . . . -91.82 -9.62 62.39 Favored Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.845 -0.693 . . . . 0.0 112.547 -179.979 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 321' ' ' GLN . . . . . . . . . . . . . 15.5 mp0 -112.42 88.06 10.37 Favored Pre-proline 0 C--N 1.33 -0.25 0 CA-C-O 120.582 0.23 . . . . 0.0 110.877 179.777 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 322' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_endo -77.35 -33.6 2.44 Favored 'Trans proline' 0 C--N 1.347 0.473 0 C-N-CA 122.537 2.158 . . . . 0.0 112.414 -179.976 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 323' ' ' ASP . . . . . . . . . . . . . 5.2 m-20 -65.46 -56.26 13.43 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.13 -0.487 . . . . 0.0 111.167 -179.761 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 324' ' ' ILE . . . . . . . . . . . . . 53.3 mt -59.28 -53.27 50.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.455 -179.713 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 325' ' ' TYR . . . . . 0.458 ' CE2' HD11 ' B' ' 329' ' ' LEU . 16.8 t80 -54.01 -47.07 71.89 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.886 -179.832 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 326' ' ' LYS . . . . . . . . . . . . . 61.7 tttm -60.09 -40.8 90.86 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.879 -179.953 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 327' ' ' ALA . . . . . . . . . . . . . . . -59.02 -53.02 63.14 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.157 -179.88 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 328' ' ' PHE . . . . . . . . . . . . . 84.0 t80 -54.66 -52.36 62.57 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.785 179.962 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 329' ' ' LEU . . . . . 0.458 HD11 ' CE2' ' B' ' 325' ' ' TYR . 77.3 mt -55.09 -39.17 69.03 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.986 -179.891 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 330' ' ' GLU . . . . . . . . . . . . . 16.4 mm-40 -63.81 -39.47 94.31 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.782 179.884 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 331' ' ' ILE . . . . . . . . . . . . . 90.4 mt -61.36 -45.71 98.06 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.17 0 CA-C-N 116.31 -0.405 . . . . 0.0 110.402 179.278 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 332' ' ' LEU . . . . . . . . . . . . . 7.7 mp -64.74 -34.7 78.93 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.867 179.533 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 333' ' ' HIS . . . . . . . . . . . . . 59.7 t-80 -62.09 -49.35 76.27 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.994 0.426 . . . . 0.0 110.111 179.502 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 334' ' ' THR . . . . . . . . . . . . . 53.1 m -63.09 -39.37 94.5 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.306 179.404 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 335' ' ' TYR . . . . . . . . . . . . . 55.7 t80 -62.72 -32.74 73.91 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.822 -0.626 . . . . 0.0 110.097 179.356 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 336' ' ' GLN . . . . . . . . . . . . . 60.7 tt0 -70.43 -45.5 65.74 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.593 -0.731 . . . . 0.0 110.64 179.808 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 337' ' ' LYS . . . . . . . . . . . . . 41.4 ttmt -60.88 -40.5 93.24 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.055 179.976 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 338' ' ' GLU . . . . . . . . . . . . . 20.8 mm-40 -67.29 -49.07 65.7 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.447 -179.753 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 339' ' ' GLN . . . . . . . . . . . . . 15.8 mm100 -61.06 -47.36 86.72 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.527 -0.306 . . . . 0.0 111.211 -179.85 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 340' ' ' ARG . . . . . . . . . . . . . 82.7 mtp180 -58.7 -51.98 67.66 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.209 -179.866 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 341' ' ' ASN . . . . . . . . . . . . . 5.6 t30 -59.76 -37.93 80.41 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.063 -179.751 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 342' ' ' ALA . . . . . . . . . . . . . . . -65.39 -35.74 81.87 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.043 179.938 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 343' ' ' LYS . . . . . . . . . . . . . 60.1 tttm -71.83 -38.59 70.13 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.923 179.976 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 344' ' ' GLU . . . . . . . . . . . . . 46.7 mt-10 -73.08 -28.51 62.34 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.145 -179.885 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 345' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.33 -0.275 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.146 -179.88 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' B' B ' 351' ' ' PRO . . . . . . . . . . . . . 31.7 Cg_exo . . . . . 0 C--O 1.231 0.154 0 CA-C-O 120.778 0.241 . . . . 0.0 112.425 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' B' B ' 352' ' ' ALA . . . . . . . . . . . . . . . -105.33 -71.17 0.75 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.38 -179.83 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 353' ' ' LEU . . . . . 0.424 ' HG ' ' HG2' ' B' ' 357' ' ' GLU . 7.3 mp -85.05 126.65 33.74 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 121.048 0.451 . . . . 0.0 111.332 -179.779 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 354' ' ' THR . . . . . 0.513 ' H ' ' HB2' ' B' ' 357' ' ' GLU . 81.4 p -111.61 -175.76 2.78 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.738 -0.664 . . . . 0.0 110.564 179.43 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 355' ' ' GLU . . . . . . . . . . . . . 8.9 pt-20 -53.06 -44.9 67.83 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.894 0.378 . . . . 0.0 110.933 179.861 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 356' ' ' GLN . . . . . . . . . . . . . 35.9 tt0 -69.53 -34.57 74.44 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.045 -0.525 . . . . 0.0 111.212 -179.701 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 357' ' ' GLU . . . . . 0.513 ' HB2' ' H ' ' B' ' 354' ' ' THR . 4.8 tp10 -60.28 -55.66 30.99 Favored 'General case' 0 C--O 1.233 0.203 0 CA-C-O 120.752 0.311 . . . . 0.0 110.655 -179.849 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 358' ' ' VAL . . . . . 0.555 ' O ' HG23 ' B' ' 362' ' ' VAL . 69.9 t -60.92 -54.51 34.34 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.872 179.825 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 359' ' ' TYR . . . . . . . . . . . . . 1.2 t80 -52.05 -34.36 43.09 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.774 0.321 . . . . 0.0 110.911 -179.661 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 360' ' ' ALA . . . . . . . . . . . . . . . -66.94 -60.43 2.65 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.357 -179.913 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 361' ' ' GLN . . . . . . . . . . . . . 54.2 mt-30 -55.52 -41.51 73.24 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.992 -179.949 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 362' ' ' VAL . . . . . 0.555 HG23 ' O ' ' B' ' 358' ' ' VAL . 50.1 t -67.59 -35.37 72.8 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.545 179.703 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 363' ' ' ALA . . . . . . . . . . . . . . . -62.06 -40.92 97.42 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.464 179.562 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 364' ' ' ARG . . . . . . . . . . . . . 67.3 ttt180 -81.34 -22.61 38.33 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.886 -0.597 . . . . 0.0 110.444 179.544 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 365' ' ' LEU . . . . . . . . . . . . . 6.4 tp -64.08 -23.14 67.21 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.75 179.989 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 366' ' ' PHE . . . . . . . . . . . . . 84.2 m-85 -125.72 165.72 18.09 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.643 179.811 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 367' ' ' LYS . . . . . . . . . . . . . 63.3 mttp -128.38 -77.32 0.56 Allowed 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.352 -0.386 . . . . 0.0 111.016 -179.859 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 368' ' ' ASN . . . . . . . . . . . . . 38.5 m-80 -85.17 7.9 20.21 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.847 179.951 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 369' ' ' GLN . . . . . . . . . . . . . 14.7 mm100 -112.22 56.33 0.66 Allowed 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.065 -179.842 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 370' ' ' GLU . . . . . . . . . . . . . 6.3 tm-20 -69.0 -23.23 64.08 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.511 179.753 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 371' ' ' ASP . . . . . . . . . . . . . 13.1 m-20 -52.66 -32.64 43.26 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.866 179.949 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 372' ' ' LEU . . . . . . . . . . . . . 78.1 mt -73.53 -35.74 65.59 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.68 179.717 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 373' ' ' LEU . . . . . . . . . . . . . 48.8 mt -65.5 -38.59 90.15 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.441 179.75 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 374' ' ' SER . . . . . . . . . . . . . 87.7 p -70.48 -54.45 12.21 Favored 'General case' 0 C--O 1.234 0.256 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.608 179.559 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 375' ' ' GLU . . . . . . . . . . . . . 16.4 mm-40 -53.24 -39.65 63.98 Favored 'General case' 0 C--N 1.333 -0.144 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.292 179.451 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 376' ' ' PHE . . . . . . . . . . . . . 88.4 t80 -69.29 -36.44 77.04 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.042 -0.526 . . . . 0.0 109.795 179.087 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 377' ' ' GLY . . . . . . . . . . . . . . . -61.87 -31.0 76.79 Favored Glycine 0 N--CA 1.448 -0.512 0 C-N-CA 120.896 -0.669 . . . . 0.0 111.607 179.234 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 378' ' ' GLN . . . . . . . . . . . . . 92.5 mt-30 -58.51 -32.0 68.42 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.836 0.35 . . . . 0.0 110.287 179.252 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 379' ' ' PHE . . . . . . . . . . . . . 97.6 m-85 -75.62 -31.0 59.71 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.221 179.244 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 380' ' ' LEU . . . . . . . . . . . . . 5.7 tp -59.05 127.67 84.05 Favored Pre-proline 0 C--N 1.328 -0.364 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.654 -179.97 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 381' ' ' PRO . . . . . 0.456 ' HD3' ' HB3' ' A' ' 373' ' ' MET . 51.4 Cg_exo . . . . . 0 C--N 1.348 0.514 0 C-N-CA 122.348 2.032 . . . . 0.0 112.322 -179.71 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 366' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.233 0.191 0 N-CA-C 111.811 0.3 . . . . 0.0 111.811 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 367' ' ' VAL . . . . . . . . . . . . . 20.8 m -65.35 -37.93 81.3 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 CA-C-N 116.465 -0.334 . . . . 0.0 111.558 -179.515 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 368' ' ' TYR . . . . . . . . . . . . . 80.4 t80 -68.75 -53.02 24.36 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.355 -0.384 . . . . 0.0 111.539 -179.422 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 369' ' ' VAL . . . . . 0.578 HG11 ' HB3' ' B' ' 332' ' ' LEU . 5.1 p -57.62 -50.2 78.12 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.203 0 CA-C-N 116.611 -0.268 . . . . 0.0 111.513 -179.58 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 370' ' ' LEU . . . . . 0.531 ' HB3' ' HB2' ' B' ' 307' ' ' ALA . 8.1 mp -63.55 -35.73 81.46 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.689 0.28 . . . . 0.0 111.22 -179.866 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 371' ' ' SER . . . . . 0.527 ' HA ' ' HB2' ' B' ' 303' ' ' GLU . 34.6 t -62.41 -61.78 2.21 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 120.828 0.347 . . . . 0.0 111.107 179.85 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 372' ' ' SER . . . . . . . . . . . . . 40.4 t -62.43 -25.6 68.05 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.283 -179.515 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 373' ' ' MET . . . . . . . . . . . . . 56.0 ttm -66.38 -52.14 49.91 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.318 -0.401 . . . . 0.0 111.492 -179.628 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 374' ' ' ALA . . . . . . . . . . . . . . . -88.06 -8.86 54.93 Favored 'General case' 0 C--N 1.33 -0.281 0 N-CA-C 112.419 0.526 . . . . 0.0 112.419 -179.051 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 375' ' ' ARG . . . . . . . . . . . . . 10.4 ttp180 -94.09 -30.14 14.82 Favored 'General case' 0 C--N 1.33 -0.268 0 C-N-CA 120.962 -0.295 . . . . 0.0 111.515 -179.855 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 376' ' ' GLN . . . . . . . . . . . . . 24.0 tp60 . . . . . 0 C--N 1.33 -0.246 0 CA-C-O 120.615 0.245 . . . . 0.0 111.004 -179.837 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' B' B ' 302' ' ' VAL . . . . . 0.623 HG23 ' H ' ' B' ' 303' ' ' GLU . 3.3 m . . . . . 0 C--O 1.233 0.232 0 CA-C-O 120.735 0.302 . . . . 0.0 111.541 . . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 303' ' ' GLU . . . . . 0.623 ' H ' HG23 ' B' ' 302' ' ' VAL . 0.0 OUTLIER -59.67 -16.0 23.34 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.412 -0.358 . . . . 0.0 111.073 -179.791 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' B' B ' 304' ' ' PHE . . . . . . . . . . . . . 82.3 t80 -64.13 -75.64 0.08 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.519 179.786 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 305' ' ' ASN . . . . . . . . . . . . . 25.7 t-20 -61.49 -29.44 69.98 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.995 -179.92 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 306' ' ' HIS . . . . . . . . . . . . . 2.3 m-70 -62.36 -69.33 0.26 Allowed 'General case' 0 C--O 1.233 0.202 0 CA-C-N 116.41 -0.359 . . . . 0.0 111.494 179.875 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 307' ' ' ALA . . . . . 0.531 ' HB2' ' HB3' ' A' ' 370' ' ' LEU . . . -55.56 -42.31 74.5 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.961 -179.217 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 308' ' ' ILE . . . . . . . . . . . . . 97.7 mt -60.34 -63.83 0.7 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.181 0 CA-C-O 120.672 0.272 . . . . 0.0 111.214 -179.853 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 309' ' ' ASN . . . . . . . . . . . . . 2.9 m-20 -54.76 -24.76 23.93 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.321 -0.399 . . . . 0.0 110.704 179.942 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 310' ' ' TYR . . . . . 0.444 ' O ' ' HG3' ' B' ' 313' ' ' LYS . 19.2 t80 -65.7 -57.18 8.67 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.31 179.51 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 311' ' ' VAL . . . . . . . . . . . . . 59.5 t -60.24 -31.05 47.34 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.748 179.557 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 312' ' ' ASN . . . . . . . . . . . . . 51.1 t-20 -66.26 -57.06 8.37 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.97 -0.559 . . . . 0.0 111.58 -179.696 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 313' ' ' LYS . . . . . 0.444 ' HG3' ' O ' ' B' ' 310' ' ' TYR . 0.0 OUTLIER -61.79 -30.56 70.89 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.61 -0.268 . . . . 0.0 111.633 -179.187 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' B' B ' 314' ' ' ILE . . . . . . . . . . . . . 89.3 mt -76.78 -31.69 19.64 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.206 0 CA-C-O 120.878 0.371 . . . . 0.0 110.998 179.542 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 315' ' ' LYS . . . . . . . . . . . . . 23.8 ttmm -78.49 -26.47 46.02 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.298 -179.717 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 316' ' ' ASN . . . . . . . . . . . . . 26.6 t-20 -88.95 -46.08 9.17 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.423 -0.353 . . . . 0.0 111.427 -179.607 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 317' ' ' ARG . . . . . . . . . . . . . 32.0 tpt180 -65.17 -60.41 3.03 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.432 -0.349 . . . . 0.0 111.203 -179.742 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 318' ' ' PHE . . . . . . . . . . . . . 95.4 m-85 -80.94 25.68 0.45 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.242 -0.435 . . . . 0.0 111.27 -179.655 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 319' ' ' GLN . . . . . . . . . . . . . 56.7 tt0 -62.6 -23.88 67.28 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.658 179.775 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 320' ' ' GLY . . . . . . . . . . . . . . . -72.8 -46.08 31.58 Favored Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 120.886 -0.673 . . . . 0.0 112.689 -179.915 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 321' ' ' GLN . . . . . . . . . . . . . 8.4 tt0 -108.0 92.95 9.96 Favored Pre-proline 0 C--N 1.329 -0.301 0 CA-C-O 120.462 0.172 . . . . 0.0 110.828 179.964 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 322' ' ' PRO . . . . . . . . . . . . . 57.9 Cg_endo -71.34 -4.43 14.95 Favored 'Trans proline' 0 C--N 1.348 0.507 0 C-N-CA 122.433 2.089 . . . . 0.0 112.333 179.931 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 323' ' ' ASP . . . . . . . . . . . . . 16.2 t70 -68.97 -56.09 8.87 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.914 179.876 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 324' ' ' ILE . . . . . . . . . . . . . 63.8 mt -60.98 -46.25 96.97 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.938 179.887 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 325' ' ' TYR . . . . . 0.435 ' CE2' HD11 ' B' ' 329' ' ' LEU . 30.0 t80 -57.72 -47.88 81.15 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.989 -0.551 . . . . 0.0 110.887 179.936 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 326' ' ' LYS . . . . . . . . . . . . . 23.6 ttmm -57.3 -52.39 65.52 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.022 -179.977 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 327' ' ' ALA . . . . . . . . . . . . . . . -51.21 -47.13 62.37 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.053 179.964 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 328' ' ' PHE . . . . . . . . . . . . . 59.6 t80 -56.09 -48.71 75.61 Favored 'General case' 0 C--O 1.235 0.296 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.387 179.672 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 329' ' ' LEU . . . . . 0.435 HD11 ' CE2' ' B' ' 325' ' ' TYR . 77.9 mt -58.29 -34.67 70.79 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.844 -0.617 . . . . 0.0 110.813 179.584 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 330' ' ' GLU . . . . . . . . . . . . . 48.1 mt-10 -68.71 -37.07 79.22 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.934 -0.575 . . . . 0.0 110.825 -179.903 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 331' ' ' ILE . . . . . . . . . . . . . 75.8 mt -65.71 -45.28 92.35 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.229 0 CA-C-N 116.38 -0.373 . . . . 0.0 110.697 179.769 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 332' ' ' LEU . . . . . 0.578 ' HB3' HG11 ' A' ' 369' ' ' VAL . 25.0 mt -69.0 -32.44 71.99 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.972 -179.972 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 333' ' ' HIS . . . . . . . . . . . . . 49.7 t60 -66.58 -53.79 30.58 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.927 0.394 . . . . 0.0 110.543 179.649 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 334' ' ' THR . . . . . 0.403 HG22 HD13 ' B' ' 353' ' ' LEU . 89.3 m -62.03 -35.86 79.84 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.825 179.751 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 335' ' ' TYR . . . . . . . . . . . . . 71.7 t80 -64.74 -41.77 95.68 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.511 179.727 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 336' ' ' GLN . . . . . . . . . . . . . 51.1 tt0 -65.9 -38.04 87.68 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.881 -0.599 . . . . 0.0 110.798 179.816 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 337' ' ' LYS . . . . . . . . . . . . . 38.1 ttpt -64.88 -50.3 67.11 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.284 -0.416 . . . . 0.0 111.115 179.941 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 338' ' ' GLU . . . . . . . . . . . . . 21.5 mm-40 -63.3 -35.4 80.25 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.978 -179.854 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 339' ' ' GLN . . . . . . . . . . . . . 28.5 tt0 -64.17 -53.03 55.76 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.669 179.873 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 340' ' ' ARG . . . . . . . . . . . . . 99.1 mtt180 -57.94 -47.07 83.98 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.856 179.819 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 341' ' ' ASN . . . . . . . . . . . . . 49.2 t-20 -56.4 -46.04 80.34 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.481 179.513 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 342' ' ' ALA . . . . . . . . . . . . . . . -66.38 -27.2 67.68 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.064 -0.517 . . . . 0.0 110.707 179.757 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 343' ' ' LYS . . . . . . . . . . . . . 22.3 tptm -71.87 -46.52 57.59 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.809 179.781 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 344' ' ' GLU . . . . . . . . . . . . . 10.9 mm-40 -67.31 -34.84 78.2 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.868 -0.605 . . . . 0.0 110.919 -179.935 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 345' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.304 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.132 179.872 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' B' B ' 351' ' ' PRO . . . . . . . . . . . . . 40.5 Cg_exo . . . . . 0 C--O 1.232 0.184 0 CA-C-O 120.735 0.223 . . . . 0.0 112.053 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' B' B ' 352' ' ' ALA . . . . . . . . . . . . . . . -103.27 -51.5 3.22 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.319 -0.4 . . . . 0.0 111.496 -179.606 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 353' ' ' LEU . . . . . 0.468 ' HG ' ' HG2' ' B' ' 357' ' ' GLU . 7.0 mp -108.87 126.28 52.89 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 121.106 0.479 . . . . 0.0 111.521 -179.529 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 354' ' ' THR . . . . . 0.422 ' H ' ' HB2' ' B' ' 357' ' ' GLU . 40.4 p -111.93 -176.85 3.03 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.703 -0.68 . . . . 0.0 110.382 179.264 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 355' ' ' GLU . . . . . . . . . . . . . 8.4 pt-20 -53.44 -41.71 66.36 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.112 0.482 . . . . 0.0 110.483 179.558 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 356' ' ' GLN . . . . . . . . . . . . . 53.5 tt0 -67.57 -39.36 84.9 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.698 -0.683 . . . . 0.0 110.964 179.904 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 357' ' ' GLU . . . . . 0.468 ' HG2' ' HG ' ' B' ' 353' ' ' LEU . 4.8 tp10 -60.43 -54.07 49.97 Favored 'General case' 0 C--N 1.333 -0.136 0 CA-C-O 120.826 0.346 . . . . 0.0 110.976 -179.895 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 358' ' ' VAL . . . . . 0.553 ' O ' HG23 ' B' ' 362' ' ' VAL . 75.6 t -59.36 -59.63 3.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.104 -179.988 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 359' ' ' TYR . . . . . . . . . . . . . 78.2 t80 -51.04 -31.9 19.94 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.565 -0.289 . . . . 0.0 111.326 -179.466 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 360' ' ' ALA . . . . . . . . . . . . . . . -67.39 -60.37 2.64 Favored 'General case' 0 C--O 1.234 0.285 0 CA-C-O 120.849 0.356 . . . . 0.0 110.987 179.688 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 361' ' ' GLN . . . . . . . . . . . . . 45.1 mt-30 -57.56 -35.25 70.1 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.682 179.948 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 362' ' ' VAL . . . . . 0.553 HG23 ' O ' ' B' ' 358' ' ' VAL . 67.7 t -70.71 -34.7 57.7 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.336 179.456 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 363' ' ' ALA . . . . . 0.589 ' HA ' HD21 ' B' ' 373' ' ' LEU . . . -64.01 -39.42 94.06 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.132 179.212 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 364' ' ' ARG . . . . . . . . . . . . . 80.8 mtp180 -82.37 -22.19 35.58 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.701 -0.682 . . . . 0.0 110.325 179.193 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 365' ' ' LEU . . . . . 0.447 ' HB2' ' HA ' ' B' ' 362' ' ' VAL . 2.4 tp -60.14 -26.98 66.7 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 115.936 -0.574 . . . . 0.0 110.335 179.883 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 366' ' ' PHE . . . . . . . . . . . . . 45.3 m-85 -122.68 -176.29 3.35 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.447 179.659 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 367' ' ' LYS . . . . . 0.459 ' NZ ' ' HB2' ' B' ' 367' ' ' LYS . 0.0 OUTLIER -141.0 -75.95 0.31 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.424 -0.353 . . . . 0.0 110.885 -179.98 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' B' B ' 368' ' ' ASN . . . . . . . . . . . . . 6.6 t30 -81.12 -16.77 52.07 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.528 179.893 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 369' ' ' GLN . . . . . 0.637 ' HB3' HD13 ' B' ' 372' ' ' LEU . 72.5 mm-40 -83.69 84.78 7.42 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.866 -179.939 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 370' ' ' GLU . . . . . . . . . . . . . 38.2 tt0 -93.75 -17.88 22.68 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.874 0.369 . . . . 0.0 110.519 179.81 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 371' ' ' ASP . . . . . . . . . . . . . 25.2 t70 -56.81 -40.28 75.69 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.625 179.722 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 372' ' ' LEU . . . . . 0.637 HD13 ' HB3' ' B' ' 369' ' ' GLN . 6.5 mp -65.86 -44.81 84.32 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.597 179.483 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 373' ' ' LEU . . . . . 0.589 HD21 ' HA ' ' B' ' 363' ' ' ALA . 1.3 mp -57.44 -43.33 83.8 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.76 -0.655 . . . . 0.0 111.417 -179.718 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 374' ' ' SER . . . . . . . . . . . . . 80.9 p -69.2 -53.23 21.04 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.959 0.409 . . . . 0.0 110.518 179.818 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 375' ' ' GLU . . . . . . . . . . . . . 40.0 tt0 -59.54 -24.57 63.81 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.969 -0.559 . . . . 0.0 110.509 179.776 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 376' ' ' PHE . . . . . . . . . . . . . 76.0 t80 -83.34 -34.01 25.75 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.12 179.378 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 377' ' ' GLY . . . . . . . . . . . . . . . -67.72 -32.46 78.15 Favored Glycine 0 N--CA 1.449 -0.436 0 C-N-CA 120.812 -0.708 . . . . 0.0 111.867 179.463 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 378' ' ' GLN . . . . . . . . . . . . . 54.7 mt-30 -61.75 -24.63 66.95 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.819 0.342 . . . . 0.0 110.547 179.442 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 379' ' ' PHE . . . . . . . . . . . . . 22.3 m-85 -72.06 -40.36 68.37 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.541 179.663 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 380' ' ' LEU . . . . . . . . . . . . . 75.8 mt -49.64 144.13 9.95 Favored Pre-proline 0 C--N 1.33 -0.256 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.294 179.72 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 381' ' ' PRO . . . . . . . . . . . . . 72.5 Cg_exo . . . . . 0 C--N 1.347 0.465 0 C-N-CA 122.418 2.079 . . . . 0.0 112.417 -179.462 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 366' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.233 0.196 0 CA-C-O 120.793 0.33 . . . . 0.0 110.973 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 367' ' ' VAL . . . . . . . . . . . . . 16.5 m -58.74 -35.62 56.54 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 116.03 -0.532 . . . . 0.0 111.115 179.913 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 368' ' ' TYR . . . . . . . . . . . . . 94.1 m-85 -64.65 -40.85 96.16 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.389 -0.368 . . . . 0.0 110.624 179.745 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 369' ' ' VAL . . . . . 0.585 HG22 ' HB2' ' B' ' 336' ' ' GLN . 21.9 t -63.99 -59.6 4.01 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-N 116.002 -0.544 . . . . 0.0 111.075 -179.897 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 370' ' ' LEU . . . . . 0.506 ' HB2' ' HB1' ' B' ' 307' ' ' ALA . 88.0 mt -57.81 -35.95 71.56 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.999 -0.546 . . . . 0.0 111.413 -179.604 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 371' ' ' SER . . . . . . . . . . . . . 47.3 t -61.83 -60.86 3.02 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.295 -0.412 . . . . 0.0 111.32 -179.558 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 372' ' ' SER . . . . . . . . . . . . . 79.4 p -56.93 -42.95 80.92 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.772 -179.368 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 373' ' ' MET . . . . . . . . . . . . . 90.2 mtp -57.29 -47.37 81.65 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.381 -0.372 . . . . 0.0 111.818 -179.355 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 374' ' ' ALA . . . . . 0.541 ' HB3' ' HB3' ' B' ' 303' ' ' GLU . . . -84.22 -17.93 38.21 Favored 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 112.044 0.387 . . . . 0.0 112.044 -179.341 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 375' ' ' ARG . . . . . . . . . . . . . 29.8 tpt180 -80.39 -26.49 38.52 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.769 0.319 . . . . 0.0 110.787 -179.881 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 376' ' ' GLN . . . . . . . . . . . . . 50.6 tt0 . . . . . 0 C--N 1.33 -0.265 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.132 -179.748 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' B' B ' 302' ' ' VAL . . . . . 0.632 HG23 ' H ' ' B' ' 303' ' ' GLU . 3.9 m . . . . . 0 C--O 1.233 0.223 0 CA-C-O 120.809 0.337 . . . . 0.0 111.353 . . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 303' ' ' GLU . . . . . 0.632 ' H ' HG23 ' B' ' 302' ' ' VAL . 3.3 mm-40 -69.12 -23.73 64.02 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.611 -179.749 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 304' ' ' PHE . . . . . 0.407 ' O ' HG13 ' B' ' 308' ' ' ILE . 68.9 t80 -67.5 -54.48 19.76 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.188 179.433 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 305' ' ' ASN . . . . . . . . . . . . . 24.6 t-20 -60.29 -48.7 80.61 Favored 'General case' 0 C--O 1.233 0.228 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.471 179.408 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 306' ' ' HIS . . . . . . . . . . . . . 18.5 t-80 -54.72 -42.99 72.18 Favored 'General case' 0 C--O 1.234 0.264 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.24 179.494 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 307' ' ' ALA . . . . . 0.506 ' HB1' ' HB2' ' A' ' 370' ' ' LEU . . . -59.4 -44.98 92.72 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.635 179.548 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 308' ' ' ILE . . . . . 0.407 HG13 ' O ' ' B' ' 304' ' ' PHE . 85.3 mt -54.87 -51.96 47.56 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.215 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.593 179.358 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 309' ' ' ASN . . . . . . . . . . . . . 42.8 m-80 -55.48 -38.17 68.78 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.731 179.788 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 310' ' ' TYR . . . . . 0.425 ' O ' ' HG3' ' B' ' 313' ' ' LYS . 15.0 t80 -61.49 -48.49 80.84 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.093 -0.503 . . . . 0.0 111.056 179.785 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 311' ' ' VAL . . . . . . . . . . . . . 40.0 t -62.57 -32.37 55.15 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.224 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.041 179.931 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 312' ' ' ASN . . . . . . . . . . . . . 31.4 t30 -67.68 -55.44 13.21 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.559 -179.652 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 313' ' ' LYS . . . . . 0.425 ' HG3' ' O ' ' B' ' 310' ' ' TYR . 0.0 OUTLIER -59.65 -36.94 77.4 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.382 -0.372 . . . . 0.0 111.784 -179.109 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' B' B ' 314' ' ' ILE . . . . . 0.404 HD11 ' CZ ' ' B' ' 310' ' ' TYR . 68.3 mt -70.27 -40.1 77.53 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.162 0 C-N-CA 120.85 -0.34 . . . . 0.0 110.866 179.601 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 315' ' ' LYS . . . . . . . . . . . . . 12.9 ttpp -61.11 -47.29 86.95 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.324 -179.715 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 316' ' ' ASN . . . . . . . . . . . . . 57.6 t30 -67.51 -50.99 56.33 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.414 -179.329 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 317' ' ' ARG . . . . . . . . . . . . . 6.8 tpm_? -56.18 -61.26 2.52 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.186 -179.571 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 318' ' ' PHE . . . . . . . . . . . . . 66.9 m-85 -88.61 37.58 0.84 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.362 -179.686 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 319' ' ' GLN . . . . . . . . . . . . . 52.0 tt0 -68.66 -28.83 67.22 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.365 -0.38 . . . . 0.0 110.782 179.981 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 320' ' ' GLY . . . . . . . . . . . . . . . -82.84 -14.69 74.78 Favored Glycine 0 N--CA 1.452 -0.289 0 C-N-CA 120.847 -0.692 . . . . 0.0 112.451 179.856 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 321' ' ' GLN . . . . . . . . . . . . . 25.8 mp0 -110.21 88.53 7.29 Favored Pre-proline 0 C--N 1.33 -0.258 0 CA-C-O 120.451 0.167 . . . . 0.0 110.754 179.948 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 322' ' ' PRO . . . . . . . . . . . . . 70.2 Cg_endo -73.89 -30.8 8.84 Favored 'Trans proline' 0 C--N 1.348 0.537 0 C-N-CA 122.374 2.049 . . . . 0.0 112.391 -179.996 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 323' ' ' ASP . . . . . . . . . . . . . 8.7 m-20 -63.7 -50.74 68.0 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.03 -179.884 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 324' ' ' ILE . . . . . . . . . . . . . 58.7 mt -67.03 -49.16 76.11 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.266 -179.798 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 325' ' ' TYR . . . . . 0.403 ' O ' ' HG ' ' B' ' 329' ' ' LEU . 11.3 t80 -52.91 -50.79 63.23 Favored 'General case' 0 C--O 1.234 0.26 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.694 179.956 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 326' ' ' LYS . . . . . 0.463 ' O ' ' HG3' ' B' ' 330' ' ' GLU . 47.5 mttp -57.46 -53.95 52.31 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.774 179.423 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 327' ' ' ALA . . . . . 0.429 ' O ' HG13 ' B' ' 331' ' ' ILE . . . -46.31 -49.16 17.9 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.36 -179.935 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 328' ' ' PHE . . . . . . . . . . . . . 70.8 t80 -57.46 -55.26 37.09 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.747 179.844 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 329' ' ' LEU . . . . . 0.403 ' HG ' ' O ' ' B' ' 325' ' ' TYR . 62.1 mt -58.65 -26.97 64.31 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.723 179.853 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 330' ' ' GLU . . . . . 0.463 ' HG3' ' O ' ' B' ' 326' ' ' LYS . 45.5 mt-10 -73.91 -36.5 64.72 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.409 179.583 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 331' ' ' ILE . . . . . 0.429 HG13 ' O ' ' B' ' 327' ' ' ALA . 91.7 mt -64.44 -50.5 75.91 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.204 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.135 179.235 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 332' ' ' LEU . . . . . . . . . . . . . 8.9 mp -65.58 -34.33 77.99 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.58 179.411 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 333' ' ' HIS . . . . . . . . . . . . . 50.2 t-80 -59.96 -57.41 13.0 Favored 'General case' 0 C--O 1.233 0.216 0 CA-C-O 120.975 0.417 . . . . 0.0 110.312 179.155 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 334' ' ' THR . . . . . . . . . . . . . 58.0 m -59.18 -33.13 70.58 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.855 -0.611 . . . . 0.0 110.555 179.421 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 335' ' ' TYR . . . . . . . . . . . . . 59.3 t80 -59.84 -51.46 69.62 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.732 179.883 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 336' ' ' GLN . . . . . 0.585 ' HB2' HG22 ' A' ' 369' ' ' VAL . 0.0 OUTLIER -62.33 -40.51 96.58 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.605 179.87 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' B' B ' 337' ' ' LYS . . . . . . . . . . . . . 25.0 ttmm -57.19 -47.82 80.29 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.747 179.712 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 338' ' ' GLU . . . . . 0.442 ' HG3' ' HB3' ' B' ' 352' ' ' ALA . 22.5 mm-40 -64.92 -37.58 88.12 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.795 179.797 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 339' ' ' GLN . . . . . . . . . . . . . 59.1 tp60 -61.7 -41.58 97.78 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.465 179.751 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 340' ' ' ARG . . . . . . . . . . . . . 72.6 mtp180 -64.17 -52.9 56.77 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.335 179.462 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 341' ' ' ASN . . . . . . . . . . . . . 3.2 m-20 -56.93 -31.01 64.51 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.002 -0.544 . . . . 0.0 110.276 179.237 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 342' ' ' ALA . . . . . . . . . . . . . . . -70.19 -40.25 74.75 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.581 179.453 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 343' ' ' LYS . . . . . . . . . . . . . 59.7 tttm -70.78 -28.74 64.89 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.723 179.62 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 344' ' ' GLU . . . . . . . . . . . . . 20.1 mm-40 -79.27 -33.6 43.32 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.105 -179.776 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 345' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.295 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.379 -179.825 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' B' B ' 351' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_exo . . . . . 0 C--O 1.232 0.2 0 CA-C-O 120.736 0.223 . . . . 0.0 112.258 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' B' B ' 352' ' ' ALA . . . . . 0.442 ' HB3' ' HG3' ' B' ' 338' ' ' GLU . . . -67.05 -55.03 16.07 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.389 -179.64 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 353' ' ' LEU . . . . . 0.531 HD22 ' HG2' ' B' ' 357' ' ' GLU . 22.0 mt -106.12 130.92 53.92 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.86 0.362 . . . . 0.0 111.192 -179.709 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 354' ' ' THR . . . . . . . . . . . . . 73.8 p -113.79 -170.63 1.74 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.905 179.69 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 355' ' ' GLU . . . . . . . . . . . . . 37.5 mt-10 -60.77 -44.3 96.94 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.97 179.912 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 356' ' ' GLN . . . . . . . . . . . . . 27.7 mm-40 -68.17 -38.18 81.8 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.028 -0.533 . . . . 0.0 111.335 -179.661 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 357' ' ' GLU . . . . . 0.531 ' HG2' HD22 ' B' ' 353' ' ' LEU . 8.8 tp10 -63.05 -54.37 39.17 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.535 -0.302 . . . . 0.0 111.018 -179.714 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 358' ' ' VAL . . . . . 0.48 ' O ' HG23 ' B' ' 362' ' ' VAL . 54.2 t -59.07 -54.05 39.48 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 116.449 -0.341 . . . . 0.0 110.909 179.817 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 359' ' ' TYR . . . . . . . . . . . . . 72.8 t80 -54.66 -32.86 59.87 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.467 -0.333 . . . . 0.0 110.885 -179.819 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 360' ' ' ALA . . . . . . . . . . . . . . . -68.03 -59.58 3.15 Favored 'General case' 0 C--N 1.332 -0.196 0 CA-C-N 116.376 -0.374 . . . . 0.0 111.012 179.701 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 361' ' ' GLN . . . . . . . . . . . . . 96.4 mt-30 -55.63 -35.21 65.64 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.81 179.822 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 362' ' ' VAL . . . . . 0.48 HG23 ' O ' ' B' ' 358' ' ' VAL . 98.3 t -74.65 -34.49 34.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.509 179.541 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 363' ' ' ALA . . . . . . . . . . . . . . . -64.21 -33.9 76.87 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.059 -0.518 . . . . 0.0 110.232 179.484 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 364' ' ' ARG . . . . . . . . . . . . . 71.1 ttt180 -90.54 -22.03 21.5 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.188 179.374 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 365' ' ' LEU . . . . . . . . . . . . . 18.4 tp -55.17 -31.67 61.55 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.708 -0.678 . . . . 0.0 110.716 179.775 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 366' ' ' PHE . . . . . . . . . . . . . 52.3 m-85 -111.81 179.99 3.86 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.954 -0.567 . . . . 0.0 110.496 179.85 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 367' ' ' LYS . . . . . . . . . . . . . 64.9 tttm -123.44 -75.63 0.6 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.701 0.286 . . . . 0.0 111.313 -179.722 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 368' ' ' ASN . . . . . . . . . . . . . 20.1 m120 -98.91 6.31 46.83 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.254 -179.669 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 369' ' ' GLN . . . . . 0.559 ' HB3' HD13 ' B' ' 372' ' ' LEU . 21.8 mp0 -100.26 87.8 3.53 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.38 -0.373 . . . . 0.0 110.754 179.842 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 370' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -93.56 -16.37 24.48 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.749 179.962 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 371' ' ' ASP . . . . . . . . . . . . . 17.4 t70 -55.96 -37.15 68.64 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.766 179.856 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 372' ' ' LEU . . . . . 0.559 HD13 ' HB3' ' B' ' 369' ' ' GLN . 6.4 mp -69.98 -36.7 75.38 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.307 179.945 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 373' ' ' LEU . . . . . . . . . . . . . 24.4 mt -65.1 -38.27 90.16 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.442 -0.344 . . . . 0.0 110.26 179.811 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 374' ' ' SER . . . . . . . . . . . . . 57.9 m -69.15 -53.31 20.82 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.477 179.359 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 375' ' ' GLU . . . . . . . . . . . . . 22.6 mm-40 -54.21 -44.39 71.58 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.305 179.638 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 376' ' ' PHE . . . . . . . . . . . . . 70.5 t80 -68.8 -33.81 74.47 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.063 179.232 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 377' ' ' GLY . . . . . . . . . . . . . . . -61.11 -34.84 89.52 Favored Glycine 0 N--CA 1.451 -0.364 0 C-N-CA 120.78 -0.724 . . . . 0.0 111.663 179.38 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 378' ' ' GLN . . . . . . . . . . . . . 78.3 mt-30 -62.14 -31.22 71.67 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.692 0.282 . . . . 0.0 110.596 179.427 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 379' ' ' PHE . . . . . . . . . . . . . 60.7 m-85 -66.42 -31.1 71.65 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.773 179.74 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 380' ' ' LEU . . . . . . . . . . . . . 97.6 mt -60.48 134.52 91.45 Favored Pre-proline 0 C--N 1.329 -0.322 0 CA-C-N 116.356 -0.384 . . . . 0.0 110.657 179.91 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 381' ' ' PRO . . . . . . . . . . . . . 79.6 Cg_exo . . . . . 0 C--N 1.351 0.673 0 C-N-CA 122.638 2.226 . . . . 0.0 112.933 -179.641 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 366' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.234 0.259 0 CA-C-O 121.015 0.436 . . . . 0.0 110.7 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 367' ' ' VAL . . . . . . . . . . . . . 39.4 t -55.97 -34.47 38.05 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.214 0 CA-C-N 115.733 -0.667 . . . . 0.0 110.653 179.495 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 368' ' ' TYR . . . . . . . . . . . . . 62.6 t80 -65.66 -37.14 85.68 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.561 179.735 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 369' ' ' VAL . . . . . 0.495 HG22 ' HB2' ' B' ' 336' ' ' GLN . 11.1 t -65.89 -56.52 14.49 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.201 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.511 179.671 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 370' ' ' LEU . . . . . . . . . . . . . 95.0 mt -61.64 -31.74 71.85 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.817 -0.629 . . . . 0.0 110.939 179.958 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 371' ' ' SER . . . . . 0.447 ' HA ' ' HB2' ' B' ' 303' ' ' GLU . 40.7 t -64.76 -52.76 55.26 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.299 -0.409 . . . . 0.0 110.379 179.517 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 372' ' ' SER . . . . . . . . . . . . . 50.3 m -60.59 -32.01 71.13 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.33 179.517 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 373' ' ' MET . . . . . 0.506 ' HG3' ' HD3' ' B' ' 381' ' ' PRO . 54.9 tpp -61.35 -60.63 3.43 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.804 -0.635 . . . . 0.0 110.837 179.622 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 374' ' ' ALA . . . . . . . . . . . . . . . -60.12 -34.17 73.14 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.596 -179.641 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 375' ' ' ARG . . . . . . . . . . . . . 18.9 tpt180 -75.76 -22.43 56.48 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.47 -0.332 . . . . 0.0 110.882 -179.688 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 376' ' ' GLN . . . . . . . . . . . . . 6.2 tp-100 . . . . . 0 C--N 1.331 -0.235 0 CA-C-O 121.029 0.442 . . . . 0.0 110.431 179.566 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' B' B ' 302' ' ' VAL . . . . . . . . . . . . . 27.7 m . . . . . 0 C--O 1.232 0.148 0 CA-C-O 120.835 0.35 . . . . 0.0 111.596 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' B' B ' 303' ' ' GLU . . . . . 0.447 ' HB2' ' HA ' ' A' ' 371' ' ' SER . 5.1 pt-20 -69.42 -46.98 65.51 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.533 -179.505 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 304' ' ' PHE . . . . . . . . . . . . . 89.4 m-85 -64.36 -49.2 72.59 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.776 0.322 . . . . 0.0 111.309 -179.629 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 305' ' ' ASN . . . . . . . . . . . . . 54.6 t30 -59.89 -53.17 61.05 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.768 -179.322 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 306' ' ' HIS . . . . . 0.41 ' O ' ' HB2' ' B' ' 310' ' ' TYR . 10.5 m-70 -60.7 -56.48 20.79 Favored 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 111.781 0.289 . . . . 0.0 111.781 -179.33 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 307' ' ' ALA . . . . . . . . . . . . . . . -51.9 -61.09 2.48 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 112.16 0.429 . . . . 0.0 112.16 -179.286 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 308' ' ' ILE . . . . . . . . . . . . . 46.9 mm -53.0 -56.68 6.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.504 -0.316 . . . . 0.0 111.841 -179.258 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 309' ' ' ASN . . . . . . . . . . . . . 39.8 t30 -57.55 -29.22 64.22 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.483 -0.326 . . . . 0.0 111.482 -179.573 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 310' ' ' TYR . . . . . 0.451 ' O ' ' HG3' ' B' ' 313' ' ' LYS . 11.8 t80 -69.34 -59.94 2.67 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.359 -0.382 . . . . 0.0 111.266 -179.451 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 311' ' ' VAL . . . . . . . . . . . . . 36.2 t -62.17 -26.79 41.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.289 -179.483 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 312' ' ' ASN . . . . . . . . . . . . . 6.8 t30 -72.46 -56.68 5.03 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.477 -179.537 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 313' ' ' LYS . . . . . 0.457 ' NZ ' ' HB2' ' B' ' 313' ' ' LYS . 0.0 OUTLIER -61.31 -32.34 72.2 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.38 -0.373 . . . . 0.0 111.551 -179.452 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' B' B ' 314' ' ' ILE . . . . . . . . . . . . . 98.0 mt -76.89 -39.72 30.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.563 -0.29 . . . . 0.0 111.639 -179.74 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 315' ' ' LYS . . . . . 0.408 ' HE3' ' HB3' ' B' ' 315' ' ' LYS . 1.4 tmmt? -65.64 -38.62 89.87 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.522 -0.308 . . . . 0.0 110.937 -179.853 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 316' ' ' ASN . . . . . . . . . . . . . 42.6 t30 -76.31 -51.8 11.24 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.518 -179.466 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 317' ' ' ARG . . . . . . . . . . . . . 19.0 tpp180 -60.27 -62.93 1.5 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.368 -179.6 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 318' ' ' PHE . . . . . . . . . . . . . 66.7 m-85 -86.38 38.43 0.78 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.209 -179.672 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 319' ' ' GLN . . . . . . . . . . . . . 58.1 tt0 -65.54 -29.61 70.26 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.9 179.933 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 320' ' ' GLY . . . . . . . . . . . . . . . -84.82 -2.31 88.62 Favored Glycine 0 N--CA 1.453 -0.23 0 C-N-CA 120.763 -0.732 . . . . 0.0 112.624 -179.732 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 321' ' ' GLN . . . . . . . . . . . . . 24.2 mp0 -109.98 91.73 11.56 Favored Pre-proline 0 C--N 1.33 -0.245 0 CA-C-O 120.502 0.191 . . . . 0.0 110.884 179.944 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 322' ' ' PRO . . . . . . . . . . . . . 97.6 Cg_endo -78.6 -29.03 3.9 Favored 'Trans proline' 0 C--N 1.348 0.511 0 C-N-CA 122.41 2.074 . . . . 0.0 112.59 -179.857 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 323' ' ' ASP . . . . . . . . . . . . . 25.4 t70 -69.15 -46.0 68.66 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.413 -0.358 . . . . 0.0 111.053 -179.829 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 324' ' ' ILE . . . . . . . . . . . . . 75.5 mt -70.87 -42.04 77.26 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.013 179.928 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 325' ' ' TYR . . . . . . . . . . . . . 46.0 t80 -62.96 -50.62 70.06 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.042 -0.527 . . . . 0.0 110.92 179.955 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 326' ' ' LYS . . . . . 0.435 ' NZ ' ' HB3' ' B' ' 326' ' ' LYS . 6.5 ttpm? -61.55 -49.94 74.66 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.101 -179.862 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 327' ' ' ALA . . . . . 0.415 ' HB3' HD11 ' B' ' 365' ' ' LEU . . . -54.33 -47.23 72.73 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.365 -0.379 . . . . 0.0 110.987 179.937 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 328' ' ' PHE . . . . . . . . . . . . . 53.0 t80 -56.5 -51.1 69.79 Favored 'General case' 0 C--O 1.236 0.357 0 CA-C-N 115.969 -0.56 . . . . 0.0 110.633 179.875 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 329' ' ' LEU . . . . . . . . . . . . . 92.8 mt -56.45 -34.54 66.95 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.541 179.534 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 330' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -67.65 -37.89 83.04 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.711 179.652 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 331' ' ' ILE . . . . . . . . . . . . . 79.9 mt -62.96 -51.62 69.64 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.161 0 CA-C-N 116.407 -0.36 . . . . 0.0 110.427 179.552 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 332' ' ' LEU . . . . . . . . . . . . . 17.7 mt -66.87 -26.7 67.02 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.73 179.784 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 333' ' ' HIS . . . . . . . . . . . . . 57.0 t-80 -64.12 -60.02 3.73 Favored 'General case' 0 C--O 1.234 0.256 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.199 179.481 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 334' ' ' THR . . . . . . . . . . . . . 80.0 m -58.94 -37.25 76.28 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.253 179.285 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 335' ' ' TYR . . . . . . . . . . . . . 56.4 t80 -60.59 -36.83 79.51 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.091 179.312 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 336' ' ' GLN . . . . . 0.495 ' HB2' HG22 ' A' ' 369' ' ' VAL . 24.7 tt0 -67.9 -51.44 47.99 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.781 179.771 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 337' ' ' LYS . . . . . . . . . . . . . 39.5 ttpt -51.8 -51.67 54.69 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.14 -179.824 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 338' ' ' GLU . . . . . 0.493 ' HG3' ' HB3' ' B' ' 352' ' ' ALA . 27.2 mm-40 -62.75 -39.86 95.45 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.986 -179.886 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 339' ' ' GLN . . . . . 0.467 ' HG3' ' HE2' ' B' ' 343' ' ' LYS . 57.6 tp60 -61.45 -39.39 90.67 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 121.023 0.439 . . . . 0.0 110.652 179.718 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 340' ' ' ARG . . . . . . . . . . . . . 64.9 mtp180 -64.1 -54.16 38.37 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.589 179.757 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 341' ' ' ASN . . . . . . . . . . . . . 43.7 t-20 -56.7 -32.42 65.47 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.356 179.555 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 342' ' ' ALA . . . . . . . . . . . . . . . -66.3 -46.6 76.37 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.801 179.75 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 343' ' ' LYS . . . . . 0.467 ' HE2' ' HG3' ' B' ' 339' ' ' GLN . 68.5 mttm -66.53 -29.2 69.23 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.845 179.763 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 344' ' ' GLU . . . . . . . . . . . . . 23.9 mm-40 -69.99 -62.01 1.55 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.085 179.941 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 345' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.305 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.016 179.943 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' B' B ' 351' ' ' PRO . . . . . . . . . . . . . 32.3 Cg_exo . . . . . 0 C--O 1.231 0.127 0 CA-C-O 120.725 0.219 . . . . 0.0 112.074 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' B' B ' 352' ' ' ALA . . . . . 0.493 ' HB3' ' HG3' ' B' ' 338' ' ' GLU . . . -86.2 -55.89 3.71 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.211 179.994 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 353' ' ' LEU . . . . . 0.451 HD22 ' HG2' ' B' ' 357' ' ' GLU . 13.6 mt -91.34 125.33 36.06 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.957 0.408 . . . . 0.0 111.241 -179.854 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 354' ' ' THR . . . . . . . . . . . . . 75.2 p -113.27 -173.44 2.26 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.855 -0.612 . . . . 0.0 110.593 179.668 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 355' ' ' GLU . . . . . . . . . . . . . 7.1 pt-20 -60.61 -41.42 94.75 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.951 0.405 . . . . 0.0 110.613 179.585 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 356' ' ' GLN . . . . . . . . . . . . . 14.5 mm100 -71.61 -38.87 70.79 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.866 -0.607 . . . . 0.0 111.225 -179.98 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 357' ' ' GLU . . . . . 0.451 ' HG2' HD22 ' B' ' 353' ' ' LEU . 9.2 tp10 -60.65 -53.85 52.4 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.518 -0.31 . . . . 0.0 110.851 -179.859 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 358' ' ' VAL . . . . . 0.434 ' O ' HG23 ' B' ' 362' ' ' VAL . 59.8 t -62.52 -50.57 79.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.112 -179.936 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 359' ' ' TYR . . . . . . . . . . . . . 65.4 t80 -58.2 -31.01 66.91 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.63 0.253 . . . . 0.0 111.178 -179.719 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 360' ' ' ALA . . . . . . . . . . . . . . . -69.57 -59.7 2.8 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.369 -0.378 . . . . 0.0 111.044 -179.976 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 361' ' ' GLN . . . . . . . . . . . . . 91.7 mt-30 -56.78 -40.59 76.16 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.579 179.861 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 362' ' ' VAL . . . . . 0.434 HG23 ' O ' ' B' ' 358' ' ' VAL . 74.0 t -66.82 -35.43 74.74 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 115.892 -0.595 . . . . 0.0 110.602 179.708 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 363' ' ' ALA . . . . . 0.643 ' HA ' HD21 ' B' ' 373' ' ' LEU . . . -62.39 -50.2 72.49 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.766 179.742 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 364' ' ' ARG . . . . . . . . . . . . . 57.5 mtp180 -73.54 -21.91 60.24 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.523 179.655 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 365' ' ' LEU . . . . . 0.415 HD11 ' HB3' ' B' ' 327' ' ' ALA . 13.9 tp -61.12 -60.89 3.06 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.86 179.978 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 366' ' ' PHE . . . . . 0.613 ' HB3' ' HB2' ' B' ' 369' ' ' GLN . 47.8 m-85 -74.34 -44.85 50.65 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.989 -179.927 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 367' ' ' LYS . . . . . 0.488 ' C ' ' H ' ' B' ' 369' ' ' GLN . 58.9 tttm 65.37 120.9 0.02 OUTLIER 'General case' 0 N--CA 1.465 0.277 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.706 179.359 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 368' ' ' ASN . . . . . . . . . . . . . 71.6 m-20 70.3 -34.04 0.28 Allowed 'General case' 0 N--CA 1.463 0.19 0 CA-C-N 116.048 -0.523 . . . . 0.0 111.31 179.707 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 369' ' ' GLN . . . . . 0.613 ' HB2' ' HB3' ' B' ' 366' ' ' PHE . 86.7 mm-40 -66.52 90.57 0.16 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.885 0.374 . . . . 0.0 110.532 179.635 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 370' ' ' GLU . . . . . . . . . . . . . 44.1 mt-10 -90.01 -6.21 55.83 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.996 -0.547 . . . . 0.0 111.012 -179.673 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 371' ' ' ASP . . . . . . . . . . . . . 21.4 t70 -67.09 -47.3 71.63 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.073 0.463 . . . . 0.0 110.258 179.494 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 372' ' ' LEU . . . . . 0.479 ' N ' HD12 ' B' ' 372' ' ' LEU . 5.6 mp -72.82 -40.53 65.71 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.779 -0.646 . . . . 0.0 110.111 179.358 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 373' ' ' LEU . . . . . 0.643 HD21 ' HA ' ' B' ' 363' ' ' ALA . 1.1 mp -62.3 -36.1 81.09 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.605 -0.725 . . . . 0.0 110.61 179.647 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 374' ' ' SER . . . . . . . . . . . . . 92.0 p -71.02 -48.93 50.19 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.086 179.433 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 375' ' ' GLU . . . . . . . . . . . . . 43.3 mt-10 -62.97 -23.15 67.29 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.143 179.011 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 376' ' ' PHE . . . . . . . . . . . . . 76.9 t80 -85.13 -29.05 25.13 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.696 -0.684 . . . . 0.0 110.163 179.529 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 377' ' ' GLY . . . . . . . . . . . . . . . -71.45 -41.89 57.26 Favored Glycine 0 C--N 1.331 0.257 0 C-N-CA 120.836 -0.697 . . . . 0.0 112.006 179.465 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 378' ' ' GLN . . . . . . . . . . . . . 4.3 pt20 -70.69 -28.01 64.44 Favored 'General case' 0 C--N 1.331 -0.196 0 N-CA-C 109.224 -0.658 . . . . 0.0 109.224 179.22 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 379' ' ' PHE . . . . . . . . . . . . . 3.7 t80 -82.34 -22.03 35.74 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 114.926 -1.034 . . . . 0.0 109.744 179.05 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 380' ' ' LEU . . . . . . . . . . . . . 18.8 tp -67.79 141.78 95.16 Favored Pre-proline 0 C--N 1.329 -0.306 0 CA-C-N 115.307 -0.86 . . . . 0.0 110.333 179.483 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 381' ' ' PRO . . . . . 0.506 ' HD3' ' HG3' ' A' ' 373' ' ' MET . 74.0 Cg_exo . . . . . 0 C--N 1.35 0.637 0 C-N-CA 122.187 1.925 . . . . 0.0 112.115 179.911 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 366' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.233 0.191 0 CA-C-O 121.06 0.457 . . . . 0.0 110.81 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 367' ' ' VAL . . . . . . . . . . . . . 23.5 t -65.58 -20.76 27.98 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.697 179.747 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 368' ' ' TYR . . . . . . . . . . . . . 25.7 t80 -71.01 -49.64 42.88 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.017 -179.808 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 369' ' ' VAL . . . . . 0.461 ' HB ' ' HB2' ' B' ' 336' ' ' GLN . 6.5 p -68.46 -44.46 83.2 Favored 'Isoleucine or valine' 0 C--O 1.233 0.217 0 CA-C-N 116.433 -0.349 . . . . 0.0 110.881 179.908 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 370' ' ' LEU . . . . . 0.41 ' N ' HG13 ' A' ' 369' ' ' VAL . 90.4 mt -60.43 -42.34 95.88 Favored 'General case' 0 C--O 1.233 0.236 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.887 179.807 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 371' ' ' SER . . . . . . . . . . . . . 87.6 p -72.64 -34.94 67.63 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.772 179.863 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 372' ' ' SER . . . . . . . . . . . . . 45.8 t -61.14 -42.81 99.23 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.341 -0.39 . . . . 0.0 111.185 -179.679 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 373' ' ' MET . . . . . 0.435 ' HB2' ' HD3' ' B' ' 381' ' ' PRO . 22.4 ptp -76.71 -38.4 54.41 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.432 -0.349 . . . . 0.0 111.722 -179.419 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 374' ' ' ALA . . . . . 0.483 ' HB3' ' OE1' ' B' ' 303' ' ' GLU . . . -78.62 -13.15 59.97 Favored 'General case' 0 C--N 1.33 -0.25 0 N-CA-C 112.015 0.376 . . . . 0.0 112.015 -179.421 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 375' ' ' ARG . . . . . . . . . . . . . 22.3 ttp180 -100.5 -32.62 10.7 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.823 0.345 . . . . 0.0 110.768 179.635 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 376' ' ' GLN . . . . . . . . . . . . . 22.8 tp60 . . . . . 0 C--N 1.331 -0.238 0 CA-C-N 116.121 -0.491 . . . . 0.0 111.181 -179.94 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' B' B ' 302' ' ' VAL . . . . . . . . . . . . . 15.0 p . . . . . 0 C--O 1.231 0.121 0 CA-C-O 120.814 0.34 . . . . 0.0 111.293 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' B' B ' 303' ' ' GLU . . . . . 0.483 ' OE1' ' HB3' ' A' ' 374' ' ' ALA . 55.3 mm-40 -65.04 -51.13 63.27 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.169 -0.468 . . . . 0.0 111.402 -179.465 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 304' ' ' PHE . . . . . . . . . . . . . 85.6 m-85 -59.99 -57.39 13.07 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.329 -179.815 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 305' ' ' ASN . . . . . . . . . . . . . 6.6 t30 -51.07 -55.16 19.0 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.874 -179.279 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 306' ' ' HIS . . . . . . . . . . . . . 12.2 m-70 -61.24 -64.1 1.07 Allowed 'General case' 0 C--N 1.33 -0.267 0 N-CA-C 112.357 0.503 . . . . 0.0 112.357 -178.947 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 307' ' ' ALA . . . . . . . . . . . . . . . -53.08 -57.13 11.47 Favored 'General case' 0 N--CA 1.464 0.245 0 N-CA-C 112.468 0.544 . . . . 0.0 112.468 -178.736 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 308' ' ' ILE . . . . . . . . . . . . . 87.4 mt -53.58 -53.57 24.5 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 N-CA-C 111.985 0.365 . . . . 0.0 111.985 -179.298 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 309' ' ' ASN . . . . . . . . . . . . . 50.2 t30 -59.46 -30.44 68.52 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.811 0.338 . . . . 0.0 110.951 -179.706 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 310' ' ' TYR . . . . . . . . . . . . . 74.8 t80 -66.99 -51.57 53.43 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.021 -179.78 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 311' ' ' VAL . . . . . . . . . . . . . 46.2 t -61.19 -52.14 64.89 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.224 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.065 -179.832 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 312' ' ' ASN . . . . . . . . . . . . . 27.6 t-20 -59.37 -34.3 72.24 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.339 -0.392 . . . . 0.0 110.976 -179.951 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 313' ' ' LYS . . . . . . . . . . . . . 39.8 tttp -62.41 -63.14 1.32 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.978 179.957 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 314' ' ' ILE . . . . . . . . . . . . . 97.9 mt -60.28 -27.79 40.35 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.352 -179.792 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 315' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -66.5 -46.34 76.6 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.413 -0.358 . . . . 0.0 110.741 -179.969 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 316' ' ' ASN . . . . . . . . . . . . . 6.7 t30 -72.48 -47.45 48.58 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.264 -179.732 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 317' ' ' ARG . . . . . . . . . . . . . 1.4 tmt_? -62.8 -63.9 1.08 Allowed 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.031 -179.836 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 318' ' ' PHE . . . . . . . . . . . . . 87.0 m-85 -85.11 40.93 0.85 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.121 -0.49 . . . . 0.0 111.043 -179.991 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 319' ' ' GLN . . . . . . . . . . . . . 35.0 tt0 -70.07 -22.61 63.04 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.885 -179.981 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 320' ' ' GLY . . . . . . . . . . . . . . . -86.59 -13.61 67.23 Favored Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.833 -0.699 . . . . 0.0 112.726 -179.793 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 321' ' ' GLN . . . . . . . . . . . . . 22.3 mp0 -110.28 93.41 15.69 Favored Pre-proline 0 C--N 1.329 -0.324 0 CA-C-O 120.416 0.151 . . . . 0.0 110.921 -179.928 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 322' ' ' PRO . . . . . . . . . . . . . 92.1 Cg_endo -79.73 -22.86 7.41 Favored 'Trans proline' 0 C--N 1.348 0.517 0 C-N-CA 122.548 2.165 . . . . 0.0 112.38 179.833 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 323' ' ' ASP . . . . . . . . . . . . . 6.0 m-20 -71.09 -48.01 54.89 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.29 -179.569 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 324' ' ' ILE . . . . . . . . . . . . . 64.0 mt -70.23 -43.07 78.98 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.415 -0.357 . . . . 0.0 111.251 -179.881 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 325' ' ' TYR . . . . . . . . . . . . . 30.8 t80 -62.1 -48.14 81.47 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 120.902 0.382 . . . . 0.0 110.75 179.984 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 326' ' ' LYS . . . . . 0.403 ' O ' ' HG2' ' B' ' 330' ' ' GLU . 87.3 tttt -62.02 -50.11 73.35 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.824 179.896 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 327' ' ' ALA . . . . . 0.412 ' O ' ' HB2' ' B' ' 330' ' ' GLU . . . -54.45 -43.55 71.74 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.185 179.946 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 328' ' ' PHE . . . . . . . . . . . . . 84.5 t80 -59.39 -57.03 14.79 Favored 'General case' 0 C--O 1.235 0.331 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.569 179.927 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 329' ' ' LEU . . . . . . . . . . . . . 91.3 mt -56.85 -28.52 61.78 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.428 179.658 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 330' ' ' GLU . . . . . 0.412 ' HB2' ' O ' ' B' ' 327' ' ' ALA . 22.5 mm-40 -66.52 -44.47 82.37 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.175 179.217 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 331' ' ' ILE . . . . . . . . . . . . . 71.1 mt -61.33 -39.8 83.94 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.12 0 N-CA-C 109.78 -0.452 . . . . 0.0 109.78 178.828 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 332' ' ' LEU . . . . . . . . . . . . . 1.1 mm? -66.61 -36.22 82.07 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.533 -0.758 . . . . 0.0 110.646 179.5 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 333' ' ' HIS . . . . . . . . . . . . . 47.2 t-80 -67.52 -56.44 9.51 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.671 179.731 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 334' ' ' THR . . . . . . . . . . . . . 35.0 m -59.36 -37.78 78.74 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.805 179.697 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 335' ' ' TYR . . . . . . . . . . . . . 32.2 t80 -60.35 -48.34 82.17 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.473 179.554 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 336' ' ' GLN . . . . . 0.461 ' HB2' ' HB ' ' A' ' 369' ' ' VAL . 54.8 tp60 -60.94 -40.22 92.47 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.477 179.535 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 337' ' ' LYS . . . . . 0.459 ' HB3' ' NZ ' ' B' ' 337' ' ' LYS . 4.7 ttpm? -60.11 -47.7 84.8 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.643 179.683 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 338' ' ' GLU . . . . . 0.428 ' HG3' ' HB3' ' B' ' 352' ' ' ALA . 61.6 mm-40 -58.78 -42.02 88.03 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.627 179.572 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 339' ' ' GLN . . . . . . . . . . . . . 29.1 tt0 -61.94 -44.79 96.03 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.707 179.844 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 340' ' ' ARG . . . . . 0.403 ' HE ' HE21 ' B' ' 336' ' ' GLN . 99.7 mtt180 -57.05 -53.78 54.25 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.673 179.825 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 341' ' ' ASN . . . . . . . . . . . . . 45.5 t-20 -55.52 -39.89 71.1 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.557 179.86 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 342' ' ' ALA . . . . . . . . . . . . . . . -60.23 -41.99 94.3 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.843 179.863 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 343' ' ' LYS . . . . . . . . . . . . . 14.5 mptt -74.7 -27.19 60.29 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.847 179.706 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 344' ' ' GLU . . . . . . . . . . . . . 20.2 mm-40 -67.94 -40.05 83.37 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.69 179.556 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 345' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.331 -0.236 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.008 179.748 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' B' B ' 351' ' ' PRO . . . . . . . . . . . . . 58.7 Cg_exo . . . . . 0 C--O 1.23 0.12 0 CA-C-O 120.779 0.241 . . . . 0.0 112.297 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' B' B ' 352' ' ' ALA . . . . . 0.428 ' HB3' ' HG3' ' B' ' 338' ' ' GLU . . . -68.12 -23.17 64.87 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.894 179.848 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 353' ' ' LEU . . . . . 0.522 ' HG ' ' HG2' ' B' ' 357' ' ' GLU . 4.7 mp -131.93 124.11 28.77 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.119 -0.492 . . . . 0.0 111.225 179.848 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 354' ' ' THR . . . . . . . . . . . . . 75.6 p -114.76 -170.73 1.8 Allowed 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.716 -0.675 . . . . 0.0 109.594 178.66 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 355' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 -57.87 -35.98 71.71 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.093 0.473 . . . . 0.0 110.063 179.271 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 356' ' ' GLN . . . . . . . . . . . . . 5.9 tp-100 -73.1 -42.6 62.78 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 115.719 -0.673 . . . . 0.0 111.127 179.97 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 357' ' ' GLU . . . . . 0.522 ' HG2' ' HG ' ' B' ' 353' ' ' LEU . 9.4 tp10 -58.97 -56.14 26.14 Favored 'General case' 0 C--O 1.232 0.176 0 CA-C-N 116.479 -0.328 . . . . 0.0 110.893 -179.779 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 358' ' ' VAL . . . . . 0.509 ' O ' HG23 ' B' ' 362' ' ' VAL . 47.1 t -59.61 -55.1 26.11 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.115 179.912 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 359' ' ' TYR . . . . . . . . . . . . . 67.2 t80 -54.92 -29.71 56.86 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.566 -0.288 . . . . 0.0 111.457 -179.551 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 360' ' ' ALA . . . . . . . . . . . . . . . -70.38 -60.83 2.04 Favored 'General case' 0 C--O 1.234 0.281 0 CA-C-N 116.439 -0.346 . . . . 0.0 111.494 -179.745 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 361' ' ' GLN . . . . . . . . . . . . . 97.6 mt-30 -55.79 -40.48 72.73 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.925 0.393 . . . . 0.0 110.792 -179.892 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 362' ' ' VAL . . . . . 0.509 HG23 ' O ' ' B' ' 358' ' ' VAL . 91.2 t -66.38 -38.25 81.39 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.71 179.616 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 363' ' ' ALA . . . . . . . . . . . . . . . -59.42 -42.73 92.53 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 116.257 -0.428 . . . . 0.0 110.383 179.296 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 364' ' ' ARG . . . . . . . . . . . . . 36.3 ttm180 -77.78 -21.99 50.82 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.834 -0.621 . . . . 0.0 110.367 179.264 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 365' ' ' LEU . . . . . . . . . . . . . 10.4 tp -64.26 -29.81 70.89 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.75 -0.659 . . . . 0.0 110.919 179.909 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 366' ' ' PHE . . . . . 0.653 ' HB3' ' HB2' ' B' ' 369' ' ' GLN . 69.4 m-85 -118.32 -59.41 1.89 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.174 -179.824 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 367' ' ' LYS . . . . . . . . . . . . . 39.7 ttpt 68.55 -80.53 0.04 OUTLIER 'General case' 0 N--CA 1.463 0.184 0 CA-C-N 115.948 -0.569 . . . . 0.0 111.595 179.79 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 368' ' ' ASN . . . . . . . . . . . . . 31.2 p-10 -58.47 -17.63 22.44 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.223 -179.477 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 369' ' ' GLN . . . . . 0.653 ' HB2' ' HB3' ' B' ' 366' ' ' PHE . 15.3 mm100 -109.58 97.54 7.08 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.964 -179.999 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 370' ' ' GLU . . . . . . . . . . . . . 44.9 mt-10 -93.91 -11.53 30.81 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.057 179.714 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 371' ' ' ASP . . . . . . . . . . . . . 13.6 m-20 -57.93 -64.12 1.02 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.935 -179.758 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 372' ' ' LEU . . . . . 0.553 HD12 ' N ' ' B' ' 373' ' ' LEU . 0.4 OUTLIER -61.98 -22.57 65.77 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.965 179.824 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' B' B ' 373' ' ' LEU . . . . . 0.553 ' N ' HD12 ' B' ' 372' ' ' LEU . 4.3 tp -68.76 -43.15 76.42 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.3 179.918 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 374' ' ' SER . . . . . . . . . . . . . 53.1 m -69.12 -48.25 62.97 Favored 'General case' 0 C--O 1.236 0.373 0 N-CA-C 109.676 -0.491 . . . . 0.0 109.676 179.053 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 375' ' ' GLU . . . . . . . . . . . . . 42.0 tt0 -56.47 -32.53 65.07 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 115.747 -0.66 . . . . 0.0 109.701 178.989 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 376' ' ' PHE . . . . . . . . . . . . . 93.3 t80 -78.12 -33.44 50.54 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 115.804 -0.635 . . . . 0.0 110.066 179.014 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 377' ' ' GLY . . . . . . . . . . . . . . . -60.52 -36.49 91.45 Favored Glycine 0 N--CA 1.449 -0.467 0 C-N-CA 120.725 -0.75 . . . . 0.0 111.632 179.506 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 378' ' ' GLN . . . . . . . . . . . . . 54.5 mt-30 -56.55 -30.76 63.48 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.666 0.269 . . . . 0.0 110.823 179.464 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 379' ' ' PHE . . . . . . . . . . . . . 78.6 m-85 -66.87 -45.06 79.3 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.392 -0.367 . . . . 0.0 110.85 179.871 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 380' ' ' LEU . . . . . . . . . . . . . 92.5 mt -53.63 132.57 55.4 Favored Pre-proline 0 C--N 1.33 -0.268 0 CA-C-N 116.373 -0.376 . . . . 0.0 110.193 179.451 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 381' ' ' PRO . . . . . 0.435 ' HD3' ' HB2' ' A' ' 373' ' ' MET . 53.4 Cg_exo . . . . . 0 C--N 1.348 0.528 0 C-N-CA 122.263 1.975 . . . . 0.0 112.55 -179.581 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 366' ' ' ALA . . . . . 0.477 ' HB3' HG22 ' B' ' 311' ' ' VAL . . . . . . . . 0 C--O 1.234 0.268 0 CA-C-O 121.127 0.489 . . . . 0.0 110.551 . . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 367' ' ' VAL . . . . . 0.654 HG23 ' HB3' ' B' ' 307' ' ' ALA . 8.5 p -47.58 -22.99 0.56 Allowed 'Isoleucine or valine' 0 C--O 1.226 -0.178 0 CA-C-N 115.519 -0.764 . . . . 0.0 111.464 -179.969 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 368' ' ' TYR . . . . . . . . . . . . . 85.6 t80 -61.34 -66.09 0.59 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.896 0.379 . . . . 0.0 110.568 179.548 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 369' ' ' VAL . . . . . 0.51 HG11 ' HB3' ' B' ' 332' ' ' LEU . 4.3 p -58.42 -39.21 73.91 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.622 179.609 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 370' ' ' LEU . . . . . 0.462 HD23 ' HA ' ' B' ' 307' ' ' ALA . 2.7 mp -64.78 -35.91 82.63 Favored 'General case' 0 C--O 1.233 0.222 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.152 179.918 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 371' ' ' SER . . . . . . . . . . . . . 37.6 m -66.56 -44.99 80.82 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.387 -0.369 . . . . 0.0 110.856 -179.935 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 372' ' ' SER . . . . . . . . . . . . . 43.6 t -65.19 -36.28 83.69 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.389 -0.369 . . . . 0.0 110.869 179.724 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 373' ' ' MET . . . . . 0.417 ' SD ' HD23 ' B' ' 380' ' ' LEU . 51.4 ttm -66.0 -43.78 86.74 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.888 -179.42 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 374' ' ' ALA . . . . . . . . . . . . . . . -79.56 -42.16 25.65 Favored 'General case' 0 C--N 1.33 -0.245 0 N-CA-C 112.591 0.589 . . . . 0.0 112.591 -179.023 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 375' ' ' ARG . . . . . 0.501 ' HG2' ' HG2' ' B' ' 303' ' ' GLU . 18.1 mmm180 -66.96 -35.72 80.61 Favored 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 111.905 0.335 . . . . 0.0 111.905 -179.163 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 376' ' ' GLN . . . . . . . . . . . . . 24.1 tp60 . . . . . 0 C--N 1.332 -0.171 0 CA-C-N 116.617 -0.265 . . . . 0.0 111.478 -179.554 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' B' B ' 302' ' ' VAL . . . . . 0.499 HG13 ' N ' ' B' ' 303' ' ' GLU . 4.0 p . . . . . 0 C--O 1.234 0.286 0 CA-C-O 120.81 0.338 . . . . 0.0 111.319 . . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 303' ' ' GLU . . . . . 0.501 ' HG2' ' HG2' ' A' ' 375' ' ' ARG . 0.0 OUTLIER -58.78 -21.84 56.82 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.675 -179.499 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' B' B ' 304' ' ' PHE . . . . . . . . . . . . . 73.4 t80 -55.96 -82.22 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.518 -0.31 . . . . 0.0 110.839 -179.763 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 305' ' ' ASN . . . . . . . . . . . . . 8.7 p30 -62.21 -33.58 74.83 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.459 -179.48 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 306' ' ' HIS . . . . . . . . . . . . . 7.8 t-160 -63.31 -71.02 0.18 Allowed 'General case' 0 C--O 1.233 0.221 0 CA-C-O 120.661 0.267 . . . . 0.0 111.651 -179.163 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 307' ' ' ALA . . . . . 0.654 ' HB3' HG23 ' A' ' 367' ' ' VAL . . . -55.51 -47.93 75.45 Favored 'General case' 0 C--N 1.33 -0.266 0 N-CA-C 112.003 0.372 . . . . 0.0 112.003 -179.062 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 308' ' ' ILE . . . . . . . . . . . . . 22.4 mm -53.07 -57.57 4.41 Favored 'Isoleucine or valine' 0 C--O 1.233 0.226 0 CA-C-O 120.669 0.271 . . . . 0.0 111.444 -179.759 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 309' ' ' ASN . . . . . . . . . . . . . 93.5 m-20 -61.27 -26.19 67.6 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.404 -0.362 . . . . 0.0 111.236 -179.623 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 310' ' ' TYR . . . . . 0.476 ' OH ' ' HB2' ' B' ' 375' ' ' GLU . 0.3 OUTLIER -71.4 -50.52 31.18 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.567 -0.288 . . . . 0.0 111.327 -179.838 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' B' B ' 311' ' ' VAL . . . . . 0.511 HG23 ' O ' ' B' ' 307' ' ' ALA . 15.2 t -63.46 -39.0 83.69 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.225 0 CA-C-N 116.506 -0.315 . . . . 0.0 111.071 -179.546 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 312' ' ' ASN . . . . . . . . . . . . . 6.7 t30 -69.39 -41.93 75.82 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.145 -179.95 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 313' ' ' LYS . . . . . 0.46 ' HB3' ' NZ ' ' B' ' 313' ' ' LYS . 0.0 OUTLIER -61.32 -46.42 90.36 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.018 -0.537 . . . . 0.0 111.746 -179.631 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' B' B ' 314' ' ' ILE . . . . . . . . . . . . . 79.9 mt -74.71 -36.45 40.37 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 N-CA-C 111.827 0.306 . . . . 0.0 111.827 -179.248 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 315' ' ' LYS . . . . . . . . . . . . . 1.6 tmmt? -67.24 -30.56 70.5 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.551 -0.295 . . . . 0.0 111.243 -179.656 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 316' ' ' ASN . . . . . . . . . . . . . 46.9 t-20 -88.85 -45.04 10.05 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.52 -0.309 . . . . 0.0 111.086 -179.854 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 317' ' ' ARG . . . . . . . . . . . . . 22.5 tpp180 -68.79 -63.86 0.98 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.423 -0.353 . . . . 0.0 111.124 -179.757 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 318' ' ' PHE . . . . . . . . . . . . . 97.2 m-85 -80.13 27.87 0.31 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.139 -179.827 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 319' ' ' GLN . . . . . . . . . . . . . 56.9 tt0 -61.46 -32.23 72.22 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.914 179.992 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 320' ' ' GLY . . . . . . . . . . . . . . . -74.35 -15.85 80.09 Favored Glycine 0 N--CA 1.45 -0.385 0 C-N-CA 120.873 -0.68 . . . . 0.0 112.637 -179.877 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 321' ' ' GLN . . . . . 0.474 ' HG2' HD12 ' B' ' 324' ' ' ILE . 6.2 tp-100 -109.75 92.68 12.81 Favored Pre-proline 0 C--N 1.33 -0.239 0 CA-C-O 120.401 0.143 . . . . 0.0 110.803 179.914 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 322' ' ' PRO . . . . . . . . . . . . . 90.9 Cg_endo -79.66 -19.01 10.25 Favored 'Trans proline' 0 C--N 1.346 0.426 0 C-N-CA 122.604 2.203 . . . . 0.0 112.723 -179.921 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 323' ' ' ASP . . . . . . . . . . . . . 25.9 m-20 -70.05 -54.51 12.78 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.389 -0.369 . . . . 0.0 111.217 -179.652 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 324' ' ' ILE . . . . . 0.474 HD12 ' HG2' ' B' ' 321' ' ' GLN . 56.0 mt -62.05 -47.82 91.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.253 -0.43 . . . . 0.0 111.338 -179.871 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 325' ' ' TYR . . . . . 0.408 ' O ' ' HG ' ' B' ' 329' ' ' LEU . 18.0 t80 -59.35 -51.6 69.24 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.275 -0.42 . . . . 0.0 111.278 -179.51 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 326' ' ' LYS . . . . . . . . . . . . . 87.8 tttt -55.7 -50.41 70.38 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.37 -0.377 . . . . 0.0 111.28 -179.868 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 327' ' ' ALA . . . . . . . . . . . . . . . -52.75 -50.13 64.08 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.083 -179.998 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 328' ' ' PHE . . . . . . . . . . . . . 51.4 t80 -54.59 -43.72 72.37 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.481 179.893 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 329' ' ' LEU . . . . . 0.408 ' HG ' ' O ' ' B' ' 325' ' ' TYR . 86.4 mt -63.07 -36.32 83.18 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.862 -0.608 . . . . 0.0 110.865 179.635 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 330' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -65.09 -37.7 88.35 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.702 179.74 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 331' ' ' ILE . . . . . 0.41 HG22 HG22 ' B' ' 358' ' ' VAL . 72.9 mt -66.91 -52.24 46.41 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.12 179.818 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 332' ' ' LEU . . . . . 0.51 ' HB3' HG11 ' A' ' 369' ' ' VAL . 8.4 mp -64.45 -32.89 74.71 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.233 -0.439 . . . . 0.0 111.339 -179.86 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 333' ' ' HIS . . . . . . . . . . . . . 56.7 t-80 -66.02 -57.81 6.93 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.059 0.457 . . . . 0.0 110.032 179.38 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 334' ' ' THR . . . . . . . . . . . . . 10.8 m -60.1 -26.23 66.05 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.252 179.402 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 335' ' ' TYR . . . . . . . . . . . . . 77.4 t80 -65.98 -49.6 67.28 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.011 179.205 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 336' ' ' GLN . . . . . . . . . . . . . 7.3 mm100 -62.53 -33.57 75.17 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.203 179.088 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 337' ' ' LYS . . . . . . . . . . . . . 37.2 ttpt -63.35 -58.98 5.33 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.986 -0.552 . . . . 0.0 111.251 179.682 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 338' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -63.97 -28.91 70.14 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.35 -0.386 . . . . 0.0 111.383 -179.535 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 339' ' ' GLN . . . . . . . . . . . . . 65.5 tt0 -68.16 -49.83 58.44 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.938 0.399 . . . . 0.0 110.573 179.885 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 340' ' ' ARG . . . . . . . . . . . . . 83.1 mtp180 -63.94 -51.72 63.09 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.74 179.781 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 341' ' ' ASN . . . . . . . . . . . . . 4.6 m-20 -52.32 -47.45 65.99 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.076 -0.511 . . . . 0.0 111.06 179.757 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 342' ' ' ALA . . . . . . . . . . . . . . . -67.84 -31.22 70.9 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.892 179.857 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 343' ' ' LYS . . . . . . . . . . . . . 87.3 tttt -75.9 -20.51 57.97 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.611 179.896 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 344' ' ' GLU . . . . . . . . . . . . . 18.5 mm-40 -84.25 -44.26 14.06 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.966 -0.561 . . . . 0.0 111.06 179.949 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 345' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.33 -0.241 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.982 179.929 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' B' B ' 351' ' ' PRO . . . . . . . . . . . . . 36.2 Cg_exo . . . . . 0 C--O 1.233 0.247 0 CA-C-O 120.775 0.239 . . . . 0.0 112.228 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' B' B ' 352' ' ' ALA . . . . . . . . . . . . . . . -111.97 -55.66 2.48 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.683 -179.612 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 353' ' ' LEU . . . . . . . . . . . . . 5.3 mp -105.99 111.04 23.51 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.902 0.382 . . . . 0.0 111.491 -179.542 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 354' ' ' THR . . . . . . . . . . . . . 60.9 p -95.94 -170.05 2.05 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.259 179.259 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 355' ' ' GLU . . . . . . . . . . . . . 41.2 mt-10 -62.03 -30.05 70.7 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 120.999 0.428 . . . . 0.0 110.38 179.659 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 356' ' ' GLN . . . . . . . . . . . . . 1.6 mp0 -72.9 -43.29 62.64 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.785 -0.643 . . . . 0.0 111.361 -179.889 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 357' ' ' GLU . . . . . . . . . . . . . 8.4 tp10 -55.98 -48.5 75.72 Favored 'General case' 0 C--O 1.233 0.194 0 CA-C-O 120.903 0.382 . . . . 0.0 110.839 -179.636 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 358' ' ' VAL . . . . . 0.492 ' O ' HG23 ' B' ' 362' ' ' VAL . 86.5 t -68.19 -59.0 4.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.019 -0.537 . . . . 0.0 111.559 -179.63 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 359' ' ' TYR . . . . . . . . . . . . . 40.2 t80 -52.43 -29.67 25.62 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.632 -0.258 . . . . 0.0 111.655 -179.01 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 360' ' ' ALA . . . . . . . . . . . . . . . -74.09 -60.68 2.15 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.847 0.356 . . . . 0.0 111.178 -179.943 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 361' ' ' GLN . . . . . . . . . . . . . 56.0 mt-30 -54.25 -36.96 64.15 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.466 179.842 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 362' ' ' VAL . . . . . 0.492 HG23 ' O ' ' B' ' 358' ' ' VAL . 87.9 t -72.06 -37.79 61.38 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-N 115.868 -0.605 . . . . 0.0 110.341 179.332 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 363' ' ' ALA . . . . . 0.741 ' HA ' HD21 ' B' ' 373' ' ' LEU . . . -57.86 -38.36 75.56 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.572 179.694 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 364' ' ' ARG . . . . . . . . . . . . . 63.3 mtm180 -90.73 -19.35 23.64 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.861 -0.609 . . . . 0.0 110.779 179.519 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 365' ' ' LEU . . . . . . . . . . . . . 24.4 tp -58.16 -37.76 75.32 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.049 -0.523 . . . . 0.0 111.511 -179.705 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 366' ' ' PHE . . . . . . . . . . . . . 75.5 m-85 -98.13 164.25 12.41 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.918 0.39 . . . . 0.0 111.425 -179.504 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 367' ' ' LYS . . . . . 0.422 ' C ' ' H ' ' B' ' 369' ' ' GLN . 65.7 mttm -96.06 87.71 4.64 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.951 -179.893 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 368' ' ' ASN . . . . . . . . . . . . . 2.4 m-20 62.05 -0.49 0.46 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.683 179.675 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 369' ' ' GLN . . . . . 0.422 ' H ' ' C ' ' B' ' 367' ' ' LYS . 3.0 tp-100 -63.69 102.84 0.49 Allowed 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.827 0.346 . . . . 0.0 110.158 179.752 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 370' ' ' GLU . . . . . . . . . . . . . 46.3 tt0 -91.82 -25.56 18.94 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.132 -0.485 . . . . 0.0 111.823 -179.048 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 371' ' ' ASP . . . . . . . . . . . . . 19.0 m-20 -49.36 -63.51 1.08 Allowed 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.879 0.371 . . . . 0.0 110.812 -179.989 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 372' ' ' LEU . . . . . 0.446 ' H ' HD12 ' B' ' 372' ' ' LEU . 7.4 mp -55.44 -45.66 76.78 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.695 179.273 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 373' ' ' LEU . . . . . 0.741 HD21 ' HA ' ' B' ' 363' ' ' ALA . 1.2 mp -59.22 -27.13 65.46 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.74 -0.664 . . . . 0.0 111.459 -179.729 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 374' ' ' SER . . . . . . . . . . . . . 67.4 m -77.92 -57.84 3.58 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.84 0.352 . . . . 0.0 110.82 -179.83 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 375' ' ' GLU . . . . . 0.476 ' HB2' ' OH ' ' B' ' 310' ' ' TYR . 10.8 mm-40 -59.87 -28.67 67.74 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.077 -0.511 . . . . 0.0 110.309 179.807 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 376' ' ' PHE . . . . . 0.529 ' HA ' ' HB2' ' B' ' 379' ' ' PHE . 79.2 t80 -83.1 -33.44 26.35 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.144 179.3 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 377' ' ' GLY . . . . . . . . . . . . . . . -60.1 -43.16 98.58 Favored Glycine 0 N--CA 1.45 -0.417 0 C-N-CA 120.747 -0.739 . . . . 0.0 111.384 179.249 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 378' ' ' GLN . . . . . . . . . . . . . 25.2 mm-40 -79.53 -18.04 52.73 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.105 0.479 . . . . 0.0 109.988 179.075 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 379' ' ' PHE . . . . . 0.529 ' HB2' ' HA ' ' B' ' 376' ' ' PHE . 0.6 OUTLIER -63.78 -29.33 70.55 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.642 -0.708 . . . . 0.0 110.287 179.621 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' B' B ' 380' ' ' LEU . . . . . 0.417 HD23 ' SD ' ' A' ' 373' ' ' MET . 42.2 mt -62.93 153.0 81.95 Favored Pre-proline 0 C--N 1.33 -0.242 0 CA-C-N 115.715 -0.675 . . . . 0.0 110.989 -179.87 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 381' ' ' PRO . . . . . . . . . . . . . 55.0 Cg_endo . . . . . 0 C--N 1.347 0.474 0 C-N-CA 122.544 2.163 . . . . 0.0 112.301 179.97 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 366' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.234 0.269 0 CA-C-O 120.929 0.395 . . . . 0.0 110.735 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 367' ' ' VAL . . . . . . . . . . . . . 41.4 t -57.88 -30.2 37.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 115.797 -0.638 . . . . 0.0 110.648 179.688 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 368' ' ' TYR . . . . . . . . . . . . . 84.1 t80 -67.36 -37.11 82.71 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.099 -0.501 . . . . 0.0 110.464 179.578 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 369' ' ' VAL . . . . . . . . . . . . . 10.9 t -68.63 -56.57 11.82 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 115.87 -0.605 . . . . 0.0 110.788 179.704 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 370' ' ' LEU . . . . . 0.534 ' HB2' ' HB1' ' B' ' 307' ' ' ALA . 94.5 mt -58.21 -40.42 81.55 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.925 -0.58 . . . . 0.0 111.092 -179.854 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 371' ' ' SER . . . . . 0.534 ' HA ' ' HB3' ' B' ' 303' ' ' GLU . 84.1 p -60.97 -59.12 5.88 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.092 -179.913 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 372' ' ' SER . . . . . . . . . . . . . 47.1 t -54.54 -33.87 60.82 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.789 0.328 . . . . 0.0 111.201 -179.835 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 373' ' ' MET . . . . . . . . . . . . . 53.9 ttm -64.14 -48.31 76.54 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.515 -179.811 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 374' ' ' ALA . . . . . 0.574 ' HB3' ' HG3' ' B' ' 303' ' ' GLU . . . -87.05 -6.14 58.82 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.488 -0.324 . . . . 0.0 111.852 -179.519 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 375' ' ' ARG . . . . . 0.539 ' HB2' ' HG2' ' B' ' 303' ' ' GLU . 29.6 ttt180 -91.94 -31.17 15.74 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.874 0.369 . . . . 0.0 110.932 -179.861 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 376' ' ' GLN . . . . . . . . . . . . . 52.4 tt0 . . . . . 0 C--N 1.33 -0.246 0 CA-C-N 116.004 -0.544 . . . . 0.0 111.779 -179.31 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' B' B ' 302' ' ' VAL . . . . . 0.434 HG13 ' N ' ' B' ' 303' ' ' GLU . 2.5 p . . . . . 0 C--O 1.233 0.218 0 CA-C-O 120.814 0.34 . . . . 0.0 111.4 . . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 303' ' ' GLU . . . . . 0.574 ' HG3' ' HB3' ' A' ' 374' ' ' ALA . 2.4 mp0 -73.7 -43.75 58.41 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.259 -0.428 . . . . 0.0 112.134 -179.244 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 304' ' ' PHE . . . . . . . . . . . . . 54.6 m-85 -62.18 -39.92 94.29 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.712 0.292 . . . . 0.0 111.365 -179.589 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 305' ' ' ASN . . . . . . . . . . . . . 6.8 t30 -71.54 -47.31 55.91 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.48 -179.626 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 306' ' ' HIS . . . . . . . . . . . . . 18.5 t-160 -65.51 -40.76 93.38 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.792 0.33 . . . . 0.0 111.214 -179.559 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 307' ' ' ALA . . . . . 0.534 ' HB1' ' HB2' ' A' ' 370' ' ' LEU . . . -65.95 -51.8 55.36 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.685 -179.406 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 308' ' ' ILE . . . . . 0.426 HD13 ' O ' ' B' ' 308' ' ' ILE . 0.0 OUTLIER -58.93 -43.08 87.81 Favored 'Isoleucine or valine' 0 C--O 1.233 0.23 0 CA-C-O 120.724 0.297 . . . . 0.0 110.685 -179.827 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' B' B ' 309' ' ' ASN . . . . . . . . . . . . . 27.0 t-20 -67.32 -30.04 69.77 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.619 179.622 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 310' ' ' TYR . . . . . . . . . . . . . 56.8 t80 -66.11 -52.01 52.65 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.806 179.872 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 311' ' ' VAL . . . . . . . . . . . . . 47.3 t -61.53 -44.0 97.86 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.2 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.83 179.798 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 312' ' ' ASN . . . . . . . . . . . . . 23.5 t-20 -63.74 -33.8 76.47 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.817 179.777 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 313' ' ' LYS . . . . . . . . . . . . . 1.1 tmmt? -64.96 -50.7 65.37 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.895 -179.975 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 314' ' ' ILE . . . . . . . . . . . . . 66.4 mt -71.76 -25.2 23.94 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.264 -179.881 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 315' ' ' LYS . . . . . . . . . . . . . 1.5 tmmt? -71.73 -39.74 69.89 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.875 -179.884 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 316' ' ' ASN . . . . . . . . . . . . . 27.2 t-20 -80.67 -41.68 23.34 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.293 -179.882 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 317' ' ' ARG . . . . . . . . . . . . . 29.1 tpt180 -68.68 -61.89 1.62 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.04 -179.806 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 318' ' ' PHE . . . . . . . . . . . . . 76.4 m-85 -83.67 31.56 0.47 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.089 -179.938 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 319' ' ' GLN . . . . . . . . . . . . . 24.4 tp60 -62.1 -20.63 64.25 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.264 -0.426 . . . . 0.0 110.646 179.779 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 320' ' ' GLY . . . . . . . . . . . . . . . -92.52 -13.33 57.2 Favored Glycine 0 C--N 1.33 0.204 0 C-N-CA 120.928 -0.653 . . . . 0.0 112.502 179.968 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 321' ' ' GLN . . . . . . . . . . . . . 87.0 mm-40 -108.79 92.75 10.96 Favored Pre-proline 0 C--N 1.329 -0.292 0 CA-C-O 120.548 0.213 . . . . 0.0 110.637 179.819 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 322' ' ' PRO . . . . . . . . . . . . . 98.3 Cg_endo -78.97 -26.57 5.24 Favored 'Trans proline' 0 C--N 1.347 0.48 0 C-N-CA 122.537 2.158 . . . . 0.0 112.603 -179.792 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 323' ' ' ASP . . . . . . . . . . . . . 15.7 t70 -68.9 -54.9 12.96 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.123 -179.715 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 324' ' ' ILE . . . . . . . . . . . . . 80.2 mt -64.18 -43.74 97.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.37 -179.949 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 325' ' ' TYR . . . . . . . . . . . . . 16.3 t80 -60.4 -44.67 95.45 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.718 -179.975 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 326' ' ' LYS . . . . . 0.4 ' O ' ' HG2' ' B' ' 330' ' ' GLU . 63.8 tttp -63.29 -50.89 68.33 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.969 179.977 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 327' ' ' ALA . . . . . . . . . . . . . . . -51.86 -49.77 62.25 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.134 -179.951 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 328' ' ' PHE . . . . . . . . . . . . . 69.8 t80 -56.02 -52.92 62.51 Favored 'General case' 0 C--O 1.237 0.401 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.519 179.826 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 329' ' ' LEU . . . . . . . . . . . . . 89.9 mt -61.12 -24.19 66.07 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.815 -0.629 . . . . 0.0 110.754 179.8 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 330' ' ' GLU . . . . . 0.4 ' HG2' ' O ' ' B' ' 326' ' ' LYS . 16.3 mm-40 -75.92 -34.27 59.89 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.562 179.49 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 331' ' ' ILE . . . . . . . . . . . . . 80.9 mt -68.89 -44.2 81.84 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.207 0 CA-C-N 116.204 -0.453 . . . . 0.0 109.995 179.183 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 332' ' ' LEU . . . . . . . . . . . . . 45.7 mt -69.31 -39.32 78.33 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.802 -0.636 . . . . 0.0 111.007 179.684 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 333' ' ' HIS . . . . . . . . . . . . . 68.9 t60 -63.69 -51.61 64.29 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.762 179.96 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 334' ' ' THR . . . . . 0.454 ' HA ' ' HZ2' ' B' ' 337' ' ' LYS . 42.1 m -62.28 -35.58 79.46 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.732 179.793 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 335' ' ' TYR . . . . . . . . . . . . . 61.0 t80 -59.31 -62.36 1.94 Allowed 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.075 -0.512 . . . . 0.0 110.825 179.731 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 336' ' ' GLN . . . . . . . . . . . . . 26.0 tp60 -54.15 -42.93 70.14 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.121 -0.49 . . . . 0.0 111.391 -179.683 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 337' ' ' LYS . . . . . 0.454 ' HZ2' ' HA ' ' B' ' 334' ' ' THR . 6.4 ttpm? -53.83 -54.62 35.86 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.892 0.377 . . . . 0.0 111.005 -179.816 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 338' ' ' GLU . . . . . . . . . . . . . 41.6 mt-10 -62.76 -31.58 72.56 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.032 -179.8 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 339' ' ' GLN . . . . . . . . . . . . . 15.8 mm100 -64.99 -47.67 76.7 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.846 0.355 . . . . 0.0 110.546 179.55 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 340' ' ' ARG . . . . . . . . . . . . . 96.0 mtt180 -59.59 -51.39 70.03 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.269 179.38 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 341' ' ' ASN . . . . . . . . . . . . . 2.3 m-20 -59.51 -31.94 69.84 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.366 179.568 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 342' ' ' ALA . . . . . . . . . . . . . . . -70.68 -33.32 70.79 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.938 179.896 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 343' ' ' LYS . . . . . . . . . . . . . 61.3 mttp -79.03 -27.81 43.24 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.882 179.843 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 344' ' ' GLU . . . . . . . . . . . . . 19.9 mm-40 -74.99 -45.31 42.84 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.048 -179.924 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 345' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.33 -0.281 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.991 179.989 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' B' B ' 351' ' ' PRO . . . . . . . . . . . . . 51.6 Cg_exo . . . . . 0 C--O 1.232 0.191 0 CA-C-O 120.716 0.215 . . . . 0.0 112.218 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' B' B ' 352' ' ' ALA . . . . . 0.482 ' HB3' HD23 ' B' ' 353' ' ' LEU . . . -81.1 -61.4 1.97 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.564 -179.539 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 353' ' ' LEU . . . . . 0.5 ' HB3' ' HG2' ' B' ' 357' ' ' GLU . 0.2 OUTLIER -106.68 131.6 53.63 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 121.012 0.434 . . . . 0.0 111.414 -179.588 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' B' B ' 354' ' ' THR . . . . . . . . . . . . . 65.2 p -113.84 -160.84 0.74 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.827 -0.624 . . . . 0.0 110.662 179.868 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 355' ' ' GLU . . . . . . . . . . . . . 41.5 mt-10 -57.17 -28.02 62.43 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.412 -0.358 . . . . 0.0 110.876 179.755 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 356' ' ' GLN . . . . . . . . . . . . . 23.6 tm0? -69.86 -50.01 46.82 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.044 -0.525 . . . . 0.0 111.008 -179.77 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 357' ' ' GLU . . . . . 0.5 ' HG2' ' HB3' ' B' ' 353' ' ' LEU . 7.1 tp10 -64.43 -36.97 85.91 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.484 -0.325 . . . . 0.0 110.979 -179.673 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 358' ' ' VAL . . . . . 0.508 ' O ' HG23 ' B' ' 362' ' ' VAL . 48.7 t -64.12 -59.85 3.63 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.981 179.973 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 359' ' ' TYR . . . . . . . . . . . . . 37.3 t80 -59.59 -30.1 68.43 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.474 -0.33 . . . . 0.0 111.331 -179.534 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 360' ' ' ALA . . . . . . . . . . . . . . . -69.75 -60.49 2.28 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.69 0.281 . . . . 0.0 111.324 -179.646 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 361' ' ' GLN . . . . . . . . . . . . . 76.8 mt-30 -56.19 -44.88 79.86 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.235 -0.438 . . . . 0.0 110.903 179.99 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 362' ' ' VAL . . . . . 0.508 HG23 ' O ' ' B' ' 358' ' ' VAL . 64.2 t -64.63 -35.39 74.62 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.716 179.759 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 363' ' ' ALA . . . . . 0.61 ' HA ' HD11 ' B' ' 373' ' ' LEU . . . -61.69 -42.83 99.46 Favored 'General case' 0 CA--C 1.521 -0.171 0 CA-C-O 120.955 0.407 . . . . 0.0 110.263 179.327 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 364' ' ' ARG . . . . . . . . . . . . . 68.2 ttt180 -81.55 -18.23 45.65 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.877 -0.601 . . . . 0.0 110.201 179.42 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 365' ' ' LEU . . . . . 0.402 ' HB2' ' HA ' ' B' ' 362' ' ' VAL . 8.1 tp -60.96 -25.52 66.88 Favored 'General case' 0 C--O 1.232 0.164 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.381 179.659 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 366' ' ' PHE . . . . . . . . . . . . . 60.4 m-85 -125.97 162.21 25.75 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.142 179.546 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 367' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -115.61 -87.8 0.59 Allowed 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 120.753 0.311 . . . . 0.0 111.596 -179.408 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 368' ' ' ASN . . . . . . . . . . . . . 3.7 m-20 -79.74 -0.95 36.42 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.443 -0.344 . . . . 0.0 111.276 -179.513 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 369' ' ' GLN . . . . . . . . . . . . . 46.9 mt-30 -98.44 84.24 3.17 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.393 -0.367 . . . . 0.0 111.218 -179.896 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 370' ' ' GLU . . . . . . . . . . . . . 44.7 mt-10 -93.9 -6.01 46.6 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.759 179.671 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 371' ' ' ASP . . . . . . . . . . . . . 19.9 t70 -57.71 -62.03 2.09 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.004 -179.812 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 372' ' ' LEU . . . . . 0.564 HD12 ' N ' ' B' ' 373' ' ' LEU . 0.3 OUTLIER -64.32 -22.51 66.97 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.257 -0.428 . . . . 0.0 111.114 179.87 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' B' B ' 373' ' ' LEU . . . . . 0.61 HD11 ' HA ' ' B' ' 363' ' ' ALA . 5.3 tp -71.53 -38.12 71.11 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.535 -179.793 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 374' ' ' SER . . . . . . . . . . . . . 48.9 m -73.66 -48.27 33.59 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.08 -0.509 . . . . 0.0 109.767 179.074 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 375' ' ' GLU . . . . . . . . . . . . . 8.5 tp10 -55.58 -38.52 69.48 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.677 -0.692 . . . . 0.0 109.813 179.133 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 376' ' ' PHE . . . . . 0.444 ' O ' ' HB2' ' B' ' 379' ' ' PHE . 76.0 t80 -75.2 -32.73 61.29 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 115.861 -0.609 . . . . 0.0 109.903 179.15 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 377' ' ' GLY . . . . . . . . . . . . . . . -60.11 -33.11 78.18 Favored Glycine 0 N--CA 1.449 -0.486 0 C-N-CA 120.606 -0.807 . . . . 0.0 111.259 179.054 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 378' ' ' GLN . . . . . . . . . . . . . 26.8 mm-40 -67.98 -31.92 71.96 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.751 0.31 . . . . 0.0 110.881 179.318 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 379' ' ' PHE . . . . . 0.444 ' HB2' ' O ' ' B' ' 376' ' ' PHE . 15.1 m-85 -56.57 -41.13 76.39 Favored 'General case' 0 C--N 1.334 -0.105 0 CA-C-N 116.319 -0.4 . . . . 0.0 110.943 179.71 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 380' ' ' LEU . . . . . . . . . . . . . 96.0 mt -56.38 131.1 76.16 Favored Pre-proline 0 C--N 1.329 -0.302 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.633 179.824 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 381' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_exo . . . . . 0 C--N 1.347 0.473 0 C-N-CA 122.355 2.037 . . . . 0.0 112.337 -179.955 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 366' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.232 0.146 0 CA-C-O 121.013 0.435 . . . . 0.0 110.686 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 367' ' ' VAL . . . . . . . . . . . . . 61.8 t -53.7 -31.23 19.71 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 115.706 -0.679 . . . . 0.0 111.452 -179.885 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 368' ' ' TYR . . . . . . . . . . . . . 65.8 m-85 -60.39 -50.4 73.75 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.758 0.313 . . . . 0.0 111.32 -179.929 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 369' ' ' VAL . . . . . 0.643 HG13 ' HG2' ' B' ' 336' ' ' GLN . 24.0 t -67.93 -52.35 40.27 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.568 -179.534 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 370' ' ' LEU . . . . . 0.547 HD13 ' HA ' ' B' ' 307' ' ' ALA . 86.9 mt -55.93 -46.51 78.45 Favored 'General case' 0 C--O 1.235 0.341 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.215 -179.808 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 371' ' ' SER . . . . . . . . . . . . . 45.8 t -60.04 -59.42 5.45 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.089 -179.949 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 372' ' ' SER . . . . . . . . . . . . . 50.6 m -51.06 -35.02 32.48 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.459 -0.337 . . . . 0.0 111.468 -179.616 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 373' ' ' MET . . . . . . . . . . . . . 54.1 tpp -65.0 -56.18 14.63 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.419 -0.355 . . . . 0.0 111.599 -179.441 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 374' ' ' ALA . . . . . 0.52 ' HB3' ' OE1' ' B' ' 303' ' ' GLU . . . -80.96 -6.15 58.38 Favored 'General case' 0 C--N 1.33 -0.267 0 N-CA-C 112.256 0.465 . . . . 0.0 112.256 -178.885 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 375' ' ' ARG . . . . . . . . . . . . . 32.7 tpt180 -96.65 -27.31 14.85 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 120.611 0.243 . . . . 0.0 111.263 -179.688 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 376' ' ' GLN . . . . . . . . . . . . . 45.4 mm-40 . . . . . 0 C--N 1.329 -0.285 0 CA-C-N 116.466 -0.334 . . . . 0.0 111.435 -179.961 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' B' B ' 302' ' ' VAL . . . . . . . . . . . . . 7.3 p . . . . . 0 C--O 1.233 0.196 0 CA-C-O 120.793 0.33 . . . . 0.0 111.296 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' B' B ' 303' ' ' GLU . . . . . 0.52 ' OE1' ' HB3' ' A' ' 374' ' ' ALA . 55.8 mm-40 -70.33 -45.58 65.9 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.178 -0.464 . . . . 0.0 111.41 -179.44 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 304' ' ' PHE . . . . . . . . . . . . . 89.7 m-85 -64.35 -50.24 68.52 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.098 -179.7 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 305' ' ' ASN . . . . . . . . . . . . . 27.7 t-20 -58.18 -54.47 46.58 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.436 -179.613 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 306' ' ' HIS . . . . . . . . . . . . . 9.8 m-70 -59.48 -61.26 2.76 Favored 'General case' 0 C--N 1.331 -0.234 0 N-CA-C 112.012 0.375 . . . . 0.0 112.012 -179.327 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 307' ' ' ALA . . . . . 0.547 ' HA ' HD13 ' A' ' 370' ' ' LEU . . . -52.7 -60.52 3.15 Favored 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 112.492 0.553 . . . . 0.0 112.492 -178.798 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 308' ' ' ILE . . . . . . . . . . . . . 90.9 mt -51.55 -54.28 12.9 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.218 0 N-CA-C 111.647 0.24 . . . . 0.0 111.647 -179.26 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 309' ' ' ASN . . . . . . . . . . . . . 3.6 m-20 -62.52 -24.07 67.3 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.456 -0.338 . . . . 0.0 111.09 -179.744 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 310' ' ' TYR . . . . . . . . . . . . . 34.3 t80 -69.3 -58.92 3.4 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.424 -0.353 . . . . 0.0 111.093 -179.693 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 311' ' ' VAL . . . . . 0.431 ' O ' ' HG3' ' B' ' 315' ' ' LYS . 27.1 t -58.94 -44.83 91.84 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.117 0 CA-C-O 120.816 0.341 . . . . 0.0 110.514 179.9 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 312' ' ' ASN . . . . . . . . . . . . . 57.6 t30 -57.96 -41.59 83.19 Favored 'General case' 0 C--O 1.232 0.179 0 CA-C-O 121.005 0.431 . . . . 0.0 110.631 179.641 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 313' ' ' LYS . . . . . . . . . . . . . 37.4 tttt -59.06 -60.01 4.55 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.771 -0.649 . . . . 0.0 111.123 179.703 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 314' ' ' ILE . . . . . . . . . . . . . 19.9 mt -59.61 -27.47 37.68 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 115.778 -0.646 . . . . 0.0 111.708 -179.04 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 315' ' ' LYS . . . . . 0.45 ' HZ2' ' HB2' ' B' ' 315' ' ' LYS . 8.7 mtmp? -71.59 -40.4 69.9 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.805 0.335 . . . . 0.0 110.805 179.681 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 316' ' ' ASN . . . . . . . . . . . . . 58.8 t30 -84.75 -12.88 52.81 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.772 179.912 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 317' ' ' ARG . . . . . 0.452 HH21 HE22 ' B' ' 369' ' ' GLN . 29.8 tpt180 -90.3 -66.63 0.91 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.798 179.814 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 318' ' ' PHE . . . . . . . . . . . . . 96.7 m-85 -88.28 39.68 0.92 Allowed 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.788 179.862 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 319' ' ' GLN . . . . . . . . . . . . . 4.9 pp0? -61.13 -9.17 4.23 Favored 'General case' 0 N--CA 1.45 -0.467 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.532 -179.785 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 320' ' ' GLY . . . . . . . . . . . . . . . -96.23 -40.25 4.04 Favored Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.83 -0.7 . . . . 0.0 112.901 179.968 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 321' ' ' GLN . . . . . . . . . . . . . 6.2 tp-100 -105.88 98.08 17.19 Favored Pre-proline 0 C--N 1.33 -0.242 0 CA-C-O 120.418 0.151 . . . . 0.0 110.925 -179.82 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 322' ' ' PRO . . . . . . . . . . . . . 93.2 Cg_endo -80.43 -13.36 12.27 Favored 'Trans proline' 0 C--N 1.348 0.552 0 C-N-CA 122.472 2.115 . . . . 0.0 112.533 179.913 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 323' ' ' ASP . . . . . . . . . . . . . 14.7 t70 -65.87 -55.11 18.73 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.007 179.992 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 324' ' ' ILE . . . . . . . . . . . . . 61.1 mt -63.32 -37.93 80.81 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.936 179.899 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 325' ' ' TYR . . . . . 0.415 ' O ' HD13 ' B' ' 329' ' ' LEU . 55.7 t80 -60.21 -58.39 8.71 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.657 179.766 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 326' ' ' LYS . . . . . 0.407 ' HG2' ' OE1' ' B' ' 330' ' ' GLU . 38.2 ttmt -58.89 -40.76 85.39 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.835 -0.62 . . . . 0.0 110.993 179.994 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 327' ' ' ALA . . . . . . . . . . . . . . . -55.47 -50.48 69.76 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-O 120.891 0.376 . . . . 0.0 110.991 -179.917 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 328' ' ' PHE . . . . . . . . . . . . . 24.4 t80 -57.42 -57.46 12.56 Favored 'General case' 0 C--O 1.239 0.504 0 CA-C-O 121.334 0.587 . . . . 0.0 110.189 179.637 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 329' ' ' LEU . . . . . 0.415 HD13 ' O ' ' B' ' 325' ' ' TYR . 10.5 mp -59.13 -20.31 52.55 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.523 -0.762 . . . . 0.0 110.904 -179.989 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 330' ' ' GLU . . . . . 0.407 ' OE1' ' HG2' ' B' ' 326' ' ' LYS . 21.8 mt-10 -77.84 -35.68 50.85 Favored 'General case' 0 C--N 1.332 -0.158 0 N-CA-C 109.829 -0.434 . . . . 0.0 109.829 178.825 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 331' ' ' ILE . . . . . . . . . . . . . 96.8 mt -64.93 -44.25 96.16 Favored 'Isoleucine or valine' 0 C--O 1.233 0.189 0 N-CA-C 109.312 -0.625 . . . . 0.0 109.312 178.524 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 332' ' ' LEU . . . . . 0.526 ' HB3' HG11 ' A' ' 369' ' ' VAL . 8.9 mp -68.62 -41.03 80.06 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.621 -0.718 . . . . 0.0 110.783 179.225 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 333' ' ' HIS . . . . . . . . . . . . . 42.5 t-80 -59.68 -53.93 52.3 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.309 179.752 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 334' ' ' THR . . . . . . . . . . . . . 93.1 m -60.92 -33.16 72.72 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.277 179.143 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 335' ' ' TYR . . . . . 0.441 ' HB3' ' O ' ' B' ' 332' ' ' LEU . 74.2 t80 -55.65 -65.35 0.61 Allowed 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.646 179.463 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 336' ' ' GLN . . . . . 0.643 ' HG2' HG13 ' A' ' 369' ' ' VAL . 63.9 mm-40 -65.18 -22.3 66.88 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.36 -0.382 . . . . 0.0 111.018 179.846 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 337' ' ' LYS . . . . . . . . . . . . . 61.0 tttp -61.32 -65.67 0.66 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.382 -0.372 . . . . 0.0 110.424 179.695 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 338' ' ' GLU . . . . . . . . . . . . . 42.9 mt-10 -63.51 -33.88 76.55 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.53 179.53 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 339' ' ' GLN . . . . . . . . . . . . . 7.7 tp60 -57.38 -53.91 52.75 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.532 179.609 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 340' ' ' ARG . . . . . . . . . . . . . 99.7 mtt180 -59.28 -50.87 72.33 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.372 179.484 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 341' ' ' ASN . . . . . . . . . . . . . 82.3 m-20 -56.09 -26.82 51.15 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.861 179.637 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 342' ' ' ALA . . . . . . . . . . . . . . . -74.44 -46.7 38.23 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.056 179.948 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 343' ' ' LYS . . . . . . . . . . . . . 14.2 mptt -76.37 -12.63 60.09 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.068 179.738 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 344' ' ' GLU . . . . . . . . . . . . . 23.2 mm-40 -89.08 -40.92 12.61 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.925 179.742 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 345' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.331 -0.215 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.936 179.937 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' B' B ' 351' ' ' PRO . . . . . . . . . . . . . 26.3 Cg_exo . . . . . 0 C--O 1.232 0.193 0 CA-C-O 120.807 0.253 . . . . 0.0 112.334 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' B' B ' 352' ' ' ALA . . . . . . . . . . . . . . . -104.38 -71.11 0.75 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.486 -179.911 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 353' ' ' LEU . . . . . 0.571 ' HB3' ' HG2' ' B' ' 357' ' ' GLU . 0.3 OUTLIER -92.6 145.7 24.23 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 121.464 0.649 . . . . 0.0 112.398 -179.392 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' B' B ' 354' ' ' THR . . . . . . . . . . . . . 81.4 p -115.14 -166.65 1.14 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.447 -0.797 . . . . 0.0 110.333 179.34 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 355' ' ' GLU . . . . . . . . . . . . . 37.5 mt-10 -59.89 -33.09 71.38 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 121.155 0.503 . . . . 0.0 110.271 179.418 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 356' ' ' GLN . . . . . . . . . . . . . 26.2 mp0 -70.17 -44.81 67.99 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.695 -0.684 . . . . 0.0 111.176 -179.78 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 357' ' ' GLU . . . . . 0.571 ' HG2' ' HB3' ' B' ' 353' ' ' LEU . 6.5 tp10 -61.68 -44.0 97.78 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-O 120.706 0.289 . . . . 0.0 110.534 -179.984 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 358' ' ' VAL . . . . . . . . . . . . . 87.0 t -59.76 -54.57 32.79 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.633 179.499 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 359' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -60.99 -28.03 68.73 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.864 -179.869 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 360' ' ' ALA . . . . . . . . . . . . . . . -72.4 -60.98 1.96 Allowed 'General case' 0 C--O 1.233 0.22 0 CA-C-N 116.41 -0.359 . . . . 0.0 111.273 -179.767 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 361' ' ' GLN . . . . . 0.41 ' O ' ' HB2' ' B' ' 365' ' ' LEU . 47.3 mt-30 -58.96 -34.0 71.28 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.438 179.855 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 362' ' ' VAL . . . . . . . . . . . . . 11.5 t -69.99 -40.16 78.26 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 115.826 -0.625 . . . . 0.0 110.785 179.577 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 363' ' ' ALA . . . . . 0.587 ' HA ' HD21 ' B' ' 373' ' ' LEU . . . -62.14 -38.73 90.09 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.39 179.488 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 364' ' ' ARG . . . . . . . . . . . . . 64.9 ttt180 -83.63 -19.35 35.59 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.252 179.141 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 365' ' ' LEU . . . . . 0.41 ' HB2' ' O ' ' B' ' 361' ' ' GLN . 13.2 tp -58.89 -34.62 71.87 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.853 -179.959 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 366' ' ' PHE . . . . . 0.49 ' HB3' ' HB2' ' B' ' 369' ' ' GLN . 59.7 m-85 -117.25 164.66 14.48 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.732 179.983 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 367' ' ' LYS . . . . . . . . . . . . . 60.9 mttp -116.54 -75.15 0.58 Allowed 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.931 179.915 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 368' ' ' ASN . . . . . . . . . . . . . 15.9 m120 -87.48 -3.98 59.0 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.78 -179.956 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 369' ' ' GLN . . . . . 0.49 ' HB2' ' HB3' ' B' ' 366' ' ' PHE . 17.7 mm-40 -97.3 83.01 3.22 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.025 -179.867 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 370' ' ' GLU . . . . . . . . . . . . . 40.2 tt0 -93.41 -15.61 25.47 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.629 179.648 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 371' ' ' ASP . . . . . . . . . . . . . 7.3 m-20 -55.36 -39.13 69.71 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.94 -0.573 . . . . 0.0 111.122 -179.9 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 372' ' ' LEU . . . . . 0.405 HD12 ' N ' ' B' ' 372' ' ' LEU . 6.1 mp -71.3 -38.88 71.73 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.772 179.844 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 373' ' ' LEU . . . . . 0.587 HD21 ' HA ' ' B' ' 363' ' ' ALA . 3.0 mp -56.74 -50.52 71.99 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.997 -0.547 . . . . 0.0 111.028 179.885 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 374' ' ' SER . . . . . . . . . . . . . 41.7 t -69.6 -48.0 61.58 Favored 'General case' 0 C--O 1.235 0.329 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.616 179.651 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 375' ' ' GLU . . . . . 0.427 ' O ' ' HG2' ' B' ' 378' ' ' GLN . 40.9 tt0 -54.67 -29.63 53.29 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 115.857 -0.611 . . . . 0.0 110.108 179.642 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 376' ' ' PHE . . . . . 0.446 ' O ' ' HB2' ' B' ' 379' ' ' PHE . 90.4 t80 -87.18 -27.68 22.88 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.934 -0.576 . . . . 0.0 110.004 178.71 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 377' ' ' GLY . . . . . . . . . . . . . . . -61.41 -38.67 96.12 Favored Glycine 0 N--CA 1.45 -0.376 0 C-N-CA 120.884 -0.674 . . . . 0.0 112.342 179.749 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 378' ' ' GLN . . . . . 0.427 ' HG2' ' O ' ' B' ' 375' ' ' GLU . 13.4 pt20 -63.31 -26.6 68.84 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.524 0.202 . . . . 0.0 111.053 179.731 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 379' ' ' PHE . . . . . 0.446 ' HB2' ' O ' ' B' ' 376' ' ' PHE . 29.3 m-85 -62.02 -33.96 75.32 Favored 'General case' 0 C--N 1.333 -0.122 0 CA-C-N 116.607 -0.269 . . . . 0.0 110.855 179.681 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 380' ' ' LEU . . . . . . . . . . . . . 79.3 mt -53.95 133.77 58.04 Favored Pre-proline 0 C--N 1.33 -0.26 0 CA-C-N 116.334 -0.393 . . . . 0.0 110.328 179.938 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 381' ' ' PRO . . . . . . . . . . . . . 64.1 Cg_exo . . . . . 0 C--N 1.347 0.483 0 C-N-CA 122.434 2.089 . . . . 0.0 112.353 -179.596 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 366' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.234 0.289 0 CA-C-O 121.095 0.474 . . . . 0.0 110.538 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 367' ' ' VAL . . . . . 0.403 HG13 ' HB3' ' B' ' 307' ' ' ALA . 18.4 t -57.97 -28.38 33.5 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 115.707 -0.679 . . . . 0.0 110.541 179.521 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 368' ' ' TYR . . . . . . . . . . . . . 46.1 t80 -70.16 -33.95 72.41 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.452 179.747 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 369' ' ' VAL . . . . . 0.558 HG22 ' HB2' ' B' ' 336' ' ' GLN . 20.7 t -71.48 -52.8 23.75 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.784 179.795 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 370' ' ' LEU . . . . . 0.43 HD13 ' HA ' ' B' ' 307' ' ' ALA . 87.7 mt -62.74 -41.2 99.07 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.831 -0.622 . . . . 0.0 111.183 -179.848 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 371' ' ' SER . . . . . . . . . . . . . 84.3 p -62.81 -55.78 23.29 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.768 179.901 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 372' ' ' SER . . . . . . . . . . . . . 69.1 m -53.03 -39.65 63.34 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.921 179.998 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 373' ' ' MET . . . . . . . . . . . . . 55.3 ttm -62.42 -43.07 99.7 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.768 179.779 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 374' ' ' ALA . . . . . . . . . . . . . . . -83.18 -8.44 59.49 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.557 -179.972 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 375' ' ' ARG . . . . . 0.567 ' HA ' ' HE ' ' A' ' 375' ' ' ARG . 4.1 mmp_? -102.62 -13.73 17.01 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.491 -0.322 . . . . 0.0 111.174 -179.854 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 376' ' ' GLN . . . . . 0.451 ' HB3' ' HG3' ' B' ' 381' ' ' PRO . 44.4 tt0 . . . . . 0 C--N 1.329 -0.293 0 CA-C-N 116.321 -0.4 . . . . 0.0 110.727 -179.956 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 302' ' ' VAL . . . . . . . . . . . . . 28.5 m . . . . . 0 C--O 1.233 0.187 0 CA-C-O 120.913 0.387 . . . . 0.0 110.95 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' B' B ' 303' ' ' GLU . . . . . . . . . . . . . 40.5 mt-10 -55.6 -82.88 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.75 -0.659 . . . . 0.0 111.877 -179.212 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 304' ' ' PHE . . . . . . . . . . . . . 79.6 m-85 -57.56 -39.71 77.33 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.788 -179.067 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 305' ' ' ASN . . . . . . . . . . . . . 22.5 t-20 -53.68 -69.34 0.12 Allowed 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 111.86 0.318 . . . . 0.0 111.86 -179.1 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 306' ' ' HIS . . . . . . . . . . . . . 13.4 m-70 -61.94 -53.97 48.32 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.185 -0.461 . . . . 0.0 112.243 -178.697 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 307' ' ' ALA . . . . . 0.43 ' HA ' HD13 ' A' ' 370' ' ' LEU . . . -52.3 -61.96 1.94 Allowed 'General case' 0 C--N 1.33 -0.242 0 N-CA-C 112.372 0.508 . . . . 0.0 112.372 -178.904 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 308' ' ' ILE . . . . . . . . . . . . . 86.1 mt -55.4 -54.54 24.1 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.231 0 N-CA-C 111.809 0.3 . . . . 0.0 111.809 -179.346 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 309' ' ' ASN . . . . . . . . . . . . . 39.2 t-20 -54.05 -29.91 45.92 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-O 120.899 0.38 . . . . 0.0 111.042 -179.554 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 310' ' ' TYR . . . . . 0.456 ' O ' ' HG3' ' B' ' 313' ' ' LYS . 8.6 t80 -70.86 -61.77 1.64 Allowed 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.073 -179.729 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 311' ' ' VAL . . . . . . . . . . . . . 38.4 t -59.09 -22.09 21.17 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-O 120.922 0.392 . . . . 0.0 110.656 179.875 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 312' ' ' ASN . . . . . . . . . . . . . 41.1 t30 -73.53 -57.38 4.04 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.534 -179.893 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 313' ' ' LYS . . . . . 0.456 ' HG3' ' O ' ' B' ' 310' ' ' TYR . 0.0 OUTLIER -62.46 -27.98 69.49 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 116.323 -0.399 . . . . 0.0 111.327 -179.55 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' B' B ' 314' ' ' ILE . . . . . . . . . . . . . 92.8 mt -77.43 -44.98 29.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.497 -0.32 . . . . 0.0 111.177 179.737 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 315' ' ' LYS . . . . . . . . . . . . . 27.4 ttpp -69.25 -24.74 64.03 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.223 -179.65 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 316' ' ' ASN . . . . . . . . . . . . . 6.7 t30 -85.8 -57.59 2.99 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.321 -0.399 . . . . 0.0 111.247 -179.694 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 317' ' ' ARG . . . . . . . . . . . . . 21.4 tpp180 -65.33 -59.56 3.91 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.058 -179.801 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 318' ' ' PHE . . . . . . . . . . . . . 90.3 m-85 -83.49 40.26 0.71 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.213 -0.448 . . . . 0.0 110.853 -179.89 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 319' ' ' GLN . . . . . . . . . . . . . 17.7 tt0 -71.76 -7.38 47.82 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.042 -0.527 . . . . 0.0 110.884 -179.864 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 320' ' ' GLY . . . . . . . . . . . . . . . -107.23 1.14 35.1 Favored Glycine 0 N--CA 1.452 -0.26 0 C-N-CA 120.658 -0.782 . . . . 0.0 112.83 -179.758 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 321' ' ' GLN . . . . . . . . . . . . . 27.7 mm-40 -112.5 88.49 11.13 Favored Pre-proline 0 C--N 1.33 -0.261 0 CA-C-O 120.491 0.186 . . . . 0.0 110.89 179.969 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 322' ' ' PRO . . . . . . . . . . . . . 73.9 Cg_endo -74.15 -29.46 9.78 Favored 'Trans proline' 0 C--N 1.347 0.475 0 C-N-CA 122.625 2.217 . . . . 0.0 112.654 -179.815 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 323' ' ' ASP . . . . . . . . . . . . . 13.8 t70 -68.87 -51.02 44.78 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.332 -0.395 . . . . 0.0 111.084 -179.647 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 324' ' ' ILE . . . . . . . . . . . . . 73.3 mt -68.23 -44.16 84.22 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.16 179.943 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 325' ' ' TYR . . . . . . . . . . . . . 35.3 t80 -58.04 -53.44 58.23 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.855 -179.826 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 326' ' ' LYS . . . . . 0.416 ' O ' ' HG3' ' B' ' 330' ' ' GLU . 86.1 tttt -60.09 -58.44 8.54 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.372 -179.865 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 327' ' ' ALA . . . . . 0.425 ' HB3' HD11 ' B' ' 365' ' ' LEU . . . -45.69 -53.07 9.9 Favored 'General case' 0 C--O 1.234 0.248 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.592 -179.654 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 328' ' ' PHE . . . . . . . . . . . . . 52.2 t80 -54.01 -53.52 51.84 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.146 0.498 . . . . 0.0 110.649 179.947 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 329' ' ' LEU . . . . . . . . . . . . . 84.6 mt -60.5 -24.38 65.26 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.712 -0.676 . . . . 0.0 110.984 179.891 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 330' ' ' GLU . . . . . 0.416 ' HG3' ' O ' ' B' ' 326' ' ' LYS . 48.0 mt-10 -76.17 -33.38 59.35 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.569 179.587 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 331' ' ' ILE . . . . . 0.432 HG22 HG22 ' B' ' 358' ' ' VAL . 76.8 mt -70.77 -44.53 76.2 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.222 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.275 179.378 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 332' ' ' LEU . . . . . . . . . . . . . 30.1 mt -69.34 -39.91 77.85 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.987 179.569 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 333' ' ' HIS . . . . . . . . . . . . . 53.5 t-80 -62.84 -54.04 44.87 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.977 0.418 . . . . 0.0 110.378 179.641 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 334' ' ' THR . . . . . . . . . . . . . 70.7 m -60.0 -33.69 72.32 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.361 179.545 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 335' ' ' TYR . . . . . 0.408 ' O ' ' HG2' ' B' ' 339' ' ' GLN . 74.7 t80 -61.35 -48.18 82.49 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.664 179.518 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 336' ' ' GLN . . . . . 0.558 ' HB2' HG22 ' A' ' 369' ' ' VAL . 20.6 tt0 -60.75 -46.5 90.21 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.742 179.727 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 337' ' ' LYS . . . . . . . . . . . . . 41.0 ttmt -57.34 -43.08 83.12 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.031 -0.531 . . . . 0.0 111.008 179.985 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 338' ' ' GLU . . . . . . . . . . . . . 29.8 mm-40 -68.04 -36.84 80.57 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.378 -179.664 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 339' ' ' GLN . . . . . 0.408 ' HG2' ' O ' ' B' ' 335' ' ' TYR . 27.0 mm-40 -66.41 -44.33 83.26 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.744 0.307 . . . . 0.0 110.837 179.949 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 340' ' ' ARG . . . . . . . . . . . . . 99.7 mtt180 -62.76 -54.11 44.02 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.738 179.895 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 341' ' ' ASN . . . . . . . . . . . . . 2.7 m-20 -57.52 -44.95 85.49 Favored 'General case' 0 C--O 1.234 0.249 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.947 179.865 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 342' ' ' ALA . . . . . . . . . . . . . . . -63.8 -30.22 71.33 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.846 179.881 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 343' ' ' LYS . . . . . . . . . . . . . 26.8 ttpp -76.1 -31.29 58.63 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.64 179.756 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 344' ' ' GLU . . . . . . . . . . . . . 22.7 mm-40 -69.63 -55.24 10.59 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.03 -0.532 . . . . 0.0 111.076 179.939 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 345' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.33 -0.258 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.814 179.997 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' B' B ' 351' ' ' PRO . . . . . . . . . . . . . 52.7 Cg_exo . . . . . 0 C--O 1.231 0.14 0 CA-C-O 120.821 0.259 . . . . 0.0 112.262 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' B' B ' 352' ' ' ALA . . . . . . . . . . . . . . . -93.48 -23.05 18.51 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.163 -179.82 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 353' ' ' LEU . . . . . 0.546 ' HB3' ' HG2' ' B' ' 357' ' ' GLU . 0.2 OUTLIER -159.15 140.31 12.9 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 121.229 0.538 . . . . 0.0 111.743 179.91 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' B' B ' 354' ' ' THR . . . . . . . . . . . . . 60.4 p -114.63 -167.09 1.17 Allowed 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.754 -0.657 . . . . 0.0 110.744 179.733 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 355' ' ' GLU . . . . . 0.4 ' OE1' ' HD2' ' B' ' 381' ' ' PRO . 42.7 mt-10 -56.8 -27.62 60.15 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.957 0.408 . . . . 0.0 110.521 179.547 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 356' ' ' GLN . . . . . . . . . . . . . 87.8 mt-30 -70.55 -49.53 47.08 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.814 -0.63 . . . . 0.0 111.115 -179.828 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 357' ' ' GLU . . . . . 0.546 ' HG2' ' HB3' ' B' ' 353' ' ' LEU . 7.0 tp10 -62.7 -44.06 97.21 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.103 -179.634 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 358' ' ' VAL . . . . . 0.432 HG22 HG22 ' B' ' 331' ' ' ILE . 95.1 t -62.32 -58.08 9.17 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.351 -0.386 . . . . 0.0 111.29 -179.911 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 359' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -58.81 -31.55 68.56 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.523 -179.246 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 360' ' ' ALA . . . . . . . . . . . . . . . -72.16 -60.9 2.0 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.729 0.299 . . . . 0.0 111.252 -179.811 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 361' ' ' GLN . . . . . . . . . . . . . 97.6 mt-30 -55.37 -35.7 65.55 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 121.045 0.45 . . . . 0.0 110.348 179.555 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 362' ' ' VAL . . . . . . . . . . . . . 14.4 t -70.82 -36.85 66.24 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 CA-C-N 115.734 -0.666 . . . . 0.0 110.485 179.316 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 363' ' ' ALA . . . . . 0.698 ' HA ' HD21 ' B' ' 373' ' ' LEU . . . -63.13 -38.33 90.75 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.735 179.903 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 364' ' ' ARG . . . . . . . . . . . . . 36.1 ttt180 -88.71 -18.14 28.48 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.793 179.73 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 365' ' ' LEU . . . . . 0.425 HD11 ' HB3' ' B' ' 327' ' ' ALA . 20.7 tp -56.22 -64.86 0.72 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.019 -0.537 . . . . 0.0 111.011 -179.861 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 366' ' ' PHE . . . . . . . . . . . . . 74.0 m-85 -71.56 167.83 18.89 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.024 -0.535 . . . . 0.0 111.096 -179.675 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 367' ' ' LYS . . . . . . . . . . . . . 35.1 mmtp -82.18 75.32 9.11 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.955 -179.796 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 368' ' ' ASN . . . . . . . . . . . . . 85.3 m-20 58.92 10.42 1.54 Allowed 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.11 -0.496 . . . . 0.0 111.356 179.967 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 369' ' ' GLN . . . . . . . . . . . . . 83.0 mm-40 -61.02 113.25 2.44 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.785 0.326 . . . . 0.0 110.852 179.979 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 370' ' ' GLU . . . . . . . . . . . . . 9.7 tp10 -91.25 -26.77 18.84 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.218 -0.447 . . . . 0.0 110.862 179.916 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 371' ' ' ASP . . . . . . . . . . . . . 18.0 t70 -56.6 -54.6 44.12 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.69 179.91 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 372' ' ' LEU . . . . . 0.461 ' H ' HD12 ' B' ' 372' ' ' LEU . 6.4 mp -65.17 -43.26 92.29 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.777 179.81 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 373' ' ' LEU . . . . . 0.698 HD21 ' HA ' ' B' ' 363' ' ' ALA . 2.1 mp -56.69 -34.53 67.49 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.926 179.789 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 374' ' ' SER . . . . . . . . . . . . . 59.7 m -75.97 -56.25 4.84 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.627 -179.948 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 375' ' ' GLU . . . . . . . . . . . . . 10.1 mm-40 -50.9 -33.53 24.58 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.599 179.647 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 376' ' ' PHE . . . . . 0.418 ' HB2' ' OH ' ' B' ' 310' ' ' TYR . 79.4 t80 -80.76 -38.77 28.02 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.426 179.55 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 377' ' ' GLY . . . . . . . . . . . . . . . -58.61 -28.61 62.84 Favored Glycine 0 N--CA 1.448 -0.519 0 C-N-CA 120.653 -0.784 . . . . 0.0 111.928 179.583 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 378' ' ' GLN . . . . . . . . . . . . . 50.3 mt-30 -61.31 -35.62 77.88 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.729 0.299 . . . . 0.0 110.807 179.603 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 379' ' ' PHE . . . . . . . . . . . . . 68.2 m-85 -58.96 -40.38 84.56 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.772 179.766 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 380' ' ' LEU . . . . . . . . . . . . . 48.7 mt -51.32 131.92 33.24 Favored Pre-proline 0 C--N 1.331 -0.221 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.441 179.907 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 381' ' ' PRO . . . . . 0.451 ' HG3' ' HB3' ' A' ' 376' ' ' GLN . 76.3 Cg_exo . . . . . 0 C--N 1.348 0.529 0 C-N-CA 122.235 1.956 . . . . 0.0 112.234 -179.806 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 358' ' ' ASP . . . . . . . . . . . . . 17.5 t70 . . . . . 0 N--CA 1.487 1.385 0 CA-C-O 120.796 0.331 . . . . 0.0 111.094 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 359' ' ' PHE . . . . . . . . . . . . . 88.8 t80 -138.47 138.61 38.26 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.088 -179.82 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 360' ' ' THR . . . . . . . . . . . . . 69.4 p -133.67 104.69 11.91 Favored Pre-proline 0 C--N 1.33 -0.252 0 CA-C-N 115.967 -0.561 . . . . 0.0 110.69 179.686 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 361' ' ' PRO . . . . . . . . . . . . . 28.0 Cg_endo -62.18 -170.34 0.08 OUTLIER 'Trans proline' 0 C--N 1.349 0.562 0 C-N-CA 122.449 2.099 . . . . 0.0 112.534 -179.704 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 362' ' ' MET . . . . . . . . . . . . . 26.4 ttt -66.7 -11.18 53.18 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.813 179.979 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 363' ' ' ASP . . . . . . . . . . . . . 18.6 m-20 62.3 21.93 12.84 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.014 -179.908 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 364' ' ' SER . . . . . . . . . . . . . 48.1 t -128.38 -83.89 0.58 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.001 179.994 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 365' ' ' SER . . . . . . . . . . . . . 69.9 m -161.1 19.28 0.12 Allowed 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.985 -179.697 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 366' ' ' ALA . . . . . . . . . . . . . . . -56.16 -40.59 74.1 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.307 -179.924 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 367' ' ' VAL . . . . . . . . . . . . . 16.4 m -62.63 -26.39 40.52 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.152 179.831 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 368' ' ' TYR . . . . . . . . . . . . . 42.6 t80 -73.36 -54.92 7.15 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.251 -0.432 . . . . 0.0 111.169 -179.825 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 369' ' ' VAL . . . . . 0.515 HG13 HD22 ' A' ' 370' ' ' LEU . 7.7 p -57.99 -42.22 82.13 Favored 'Isoleucine or valine' 0 C--O 1.232 0.169 0 CA-C-O 120.782 0.325 . . . . 0.0 110.799 -179.992 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 370' ' ' LEU . . . . . 0.515 HD22 HG13 ' A' ' 369' ' ' VAL . 2.7 mm? -63.16 -46.38 87.45 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 121.011 0.434 . . . . 0.0 110.124 179.093 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 371' ' ' SER . . . . . . . . . . . . . 30.6 t -64.78 -24.21 67.48 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 115.843 -0.617 . . . . 0.0 110.641 179.36 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 372' ' ' SER . . . . . . . . . . . . . 46.6 t -72.59 -50.37 25.87 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.678 -179.972 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 373' ' ' MET . . . . . . . . . . . . . 66.4 mtt -62.02 -41.08 97.7 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.75 179.652 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 374' ' ' ALA . . . . . . . . . . . . . . . -65.71 -55.77 15.59 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.089 -0.505 . . . . 0.0 112.021 -179.329 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 375' ' ' ARG . . . . . . . . . . . . . 25.3 mmm180 -60.08 -44.6 94.65 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.506 -0.315 . . . . 0.0 111.668 -179.509 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 376' ' ' GLN . . . . . . . . . . . . . 24.2 mm-40 -66.89 -10.06 44.51 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.431 -0.35 . . . . 0.0 111.812 -179.407 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 377' ' ' ARG . . . . . 0.544 ' HA ' ' HA ' ' B' ' 381' ' ' PRO . 79.7 ttt180 -67.9 123.82 21.63 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.681 0.277 . . . . 0.0 110.646 179.977 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 378' ' ' ARG . . . . . . . . . . . . . 28.5 tpt180 61.69 10.56 3.44 Favored 'General case' 0 CA--C 1.531 0.234 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.839 -179.933 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 379' ' ' ALA . . . . . . . . . . . . . . . -98.51 161.72 13.53 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.149 180.0 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 380' ' ' SER . . . . . . . . . . . . . 47.4 t . . . . . 0 C--O 1.249 1.05 0 CA-C-O 118.207 -0.902 . . . . 0.0 111.024 179.968 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' B' B ' 295' ' ' SER . . . . . . . . . . . . . 47.3 t . . . . . 0 N--CA 1.486 1.364 0 CA-C-O 120.787 0.327 . . . . 0.0 110.914 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' B' B ' 296' ' ' LEU . . . . . 0.474 HD22 ' N ' ' B' ' 296' ' ' LEU . 3.2 mm? -102.79 178.26 4.62 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.719 179.96 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 297' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -112.89 -178.69 3.45 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.033 179.924 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 298' ' ' ASN . . . . . . . . . . . . . 37.1 m-80 -145.07 -20.11 0.5 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.922 -179.946 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 299' ' ' ASN . . . . . . . . . . . . . 7.6 t30 -89.78 125.73 35.41 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.963 -179.871 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 300' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 57.25 72.9 0.85 Allowed Pre-proline 0 C--N 1.331 -0.236 0 CA-C-N 115.971 -0.559 . . . . 0.0 111.079 179.825 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 301' ' ' PRO . . . . . 0.501 ' HB2' ' HB2' ' B' ' 304' ' ' PHE . 92.1 Cg_endo -80.33 117.84 3.52 Favored 'Trans proline' 0 C--N 1.347 0.48 0 C-N-CA 122.52 2.147 . . . . 0.0 111.987 179.453 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 302' ' ' VAL . . . . . 0.59 HG23 ' H ' ' B' ' 303' ' ' GLU . 5.1 m -91.98 -59.23 3.08 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.819 -179.456 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 303' ' ' GLU . . . . . 0.59 ' H ' HG23 ' B' ' 302' ' ' VAL . 10.6 pt-20 -57.33 -39.63 76.29 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 111.761 0.282 . . . . 0.0 111.761 -179.152 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 304' ' ' PHE . . . . . 0.501 ' HB2' ' HB2' ' B' ' 301' ' ' PRO . 81.5 m-85 -60.22 -77.08 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 112.048 0.388 . . . . 0.0 112.048 -179.217 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 305' ' ' ASN . . . . . . . . . . . . . 37.5 t30 -50.47 -45.36 56.12 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 112.779 0.659 . . . . 0.0 112.779 -178.596 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 306' ' ' HIS . . . . . 0.426 ' HB2' ' O ' ' B' ' 302' ' ' VAL . 0.4 OUTLIER -64.39 -64.87 0.77 Allowed 'General case' 0 C--N 1.33 -0.27 0 N-CA-C 112.315 0.487 . . . . 0.0 112.315 -178.418 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 307' ' ' ALA . . . . . . . . . . . . . . . -54.88 -48.69 72.67 Favored 'General case' 0 N--CA 1.464 0.27 0 N-CA-C 112.183 0.438 . . . . 0.0 112.183 -178.929 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 308' ' ' ILE . . . . . . . . . . . . . 97.6 mt -55.66 -54.19 28.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-O 120.707 0.289 . . . . 0.0 111.097 -179.889 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 309' ' ' ASN . . . . . 0.403 ' O ' ' HG2' ' B' ' 313' ' ' LYS . 5.1 m-20 -63.45 -22.34 66.83 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.436 -0.347 . . . . 0.0 110.99 179.985 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 310' ' ' TYR . . . . . 0.445 ' HA ' ' HE2' ' B' ' 313' ' ' LYS . 64.0 t80 -70.4 -61.11 1.9 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.218 -0.447 . . . . 0.0 110.826 179.887 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 311' ' ' VAL . . . . . . . . . . . . . 50.6 t -62.37 -28.39 44.55 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.771 179.823 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 312' ' ' ASN . . . . . . . . . . . . . 6.8 t30 -69.18 -55.32 10.98 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.379 -179.873 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 313' ' ' LYS . . . . . 0.564 ' HG3' ' N ' ' B' ' 314' ' ' ILE . 40.5 pttt -58.18 -43.61 87.61 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.377 -0.374 . . . . 0.0 111.345 -179.542 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 314' ' ' ILE . . . . . 0.564 ' N ' ' HG3' ' B' ' 313' ' ' LYS . 96.0 mt -68.66 -34.97 67.86 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.437 -0.347 . . . . 0.0 111.368 -179.473 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 315' ' ' LYS . . . . . . . . . . . . . 22.4 ttmm -66.65 -37.17 84.24 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.822 0.344 . . . . 0.0 110.711 179.648 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 316' ' ' ASN . . . . . . . . . . . . . 25.4 t-20 -83.61 -21.45 32.54 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.978 -179.836 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 317' ' ' ARG . . . . . . . . . . . . . 21.9 tpt180 -75.92 -65.84 0.86 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.994 -179.998 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 318' ' ' PHE . . . . . . . . . . . . . 99.1 m-85 -91.24 35.66 0.93 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.933 179.991 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 319' ' ' GLN . . . . . . . . . . . . . 11.6 pt20 -58.34 -18.27 26.2 Favored 'General case' 0 N--CA 1.449 -0.519 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.17 179.905 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 320' ' ' GLY . . . . . . . . . . . . . . . -96.03 -22.66 19.61 Favored Glycine 0 N--CA 1.451 -0.347 0 C-N-CA 120.805 -0.712 . . . . 0.0 112.58 179.937 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 321' ' ' GLN . . . . . . . . . . . . . 7.6 tp-100 -109.0 96.2 19.85 Favored Pre-proline 0 C--N 1.33 -0.26 0 CA-C-O 120.465 0.174 . . . . 0.0 110.825 -179.946 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 322' ' ' PRO . . . . . . . . . . . . . 87.8 Cg_endo -81.76 -12.25 11.11 Favored 'Trans proline' 0 C--N 1.348 0.511 0 C-N-CA 122.625 2.217 . . . . 0.0 112.847 -179.735 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 323' ' ' ASP . . . . . . . . . . . . . 9.6 m-20 -70.29 -55.69 8.59 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.517 -0.311 . . . . 0.0 111.168 -179.788 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 324' ' ' ILE . . . . . . . . . . . . . 58.8 mt -65.46 -37.37 79.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.277 -0.42 . . . . 0.0 111.065 -179.774 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 325' ' ' TYR . . . . . . . . . . . . . 28.1 t80 -64.05 -50.09 69.78 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.592 179.971 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 326' ' ' LYS . . . . . . . . . . . . . 38.9 ttmt -61.04 -38.66 86.94 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.035 -0.529 . . . . 0.0 110.692 179.613 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 327' ' ' ALA . . . . . 0.405 ' HB3' HD21 ' B' ' 365' ' ' LEU . . . -58.87 -54.96 41.24 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.916 179.905 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 328' ' ' PHE . . . . . . . . . . . . . 90.0 t80 -53.59 -49.96 66.65 Favored 'General case' 0 C--O 1.235 0.29 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.613 179.726 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 329' ' ' LEU . . . . . . . . . . . . . 96.4 mt -58.0 -35.53 71.36 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.96 179.892 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 330' ' ' GLU . . . . . . . . . . . . . 41.7 mt-10 -67.83 -34.84 77.52 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.617 179.652 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 331' ' ' ILE . . . . . . . . . . . . . 74.2 mt -65.65 -49.77 75.62 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.197 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.751 179.565 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 332' ' ' LEU . . . . . 0.467 ' HB3' HG11 ' A' ' 369' ' ' VAL . 5.2 mp -67.22 -30.56 70.51 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.359 -0.382 . . . . 0.0 111.104 179.939 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 333' ' ' HIS . . . . . . . . . . . . . 49.7 t-80 -65.26 -55.7 16.94 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.872 0.368 . . . . 0.0 110.279 179.565 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 334' ' ' THR . . . . . . . . . . . . . 77.6 m -63.18 -36.52 83.9 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.337 179.486 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 335' ' ' TYR . . . . . . . . . . . . . 87.9 t80 -66.92 -33.21 75.1 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.311 179.435 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 336' ' ' GLN . . . . . . . . . . . . . 8.1 tt0 -68.58 -49.7 57.38 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.84 -0.618 . . . . 0.0 110.66 179.815 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 337' ' ' LYS . . . . . 0.524 ' O ' ' HG2' ' B' ' 340' ' ' ARG . 39.1 ttpt -62.83 -36.89 84.69 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.068 179.955 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 338' ' ' GLU . . . . . . . . . . . . . 18.9 mm-40 -71.15 -32.53 69.07 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.974 0.416 . . . . 0.0 110.238 179.345 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 339' ' ' GLN . . . . . . . . . . . . . 58.4 tt0 -72.24 -43.3 64.59 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.798 -0.637 . . . . 0.0 110.736 179.512 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 340' ' ' ARG . . . . . 0.569 ' HG3' ' N ' ' B' ' 341' ' ' ASN . 36.3 ptt180 -63.74 -53.64 47.84 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 121.015 0.436 . . . . 0.0 110.772 179.933 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 341' ' ' ASN . . . . . 0.569 ' N ' ' HG3' ' B' ' 340' ' ' ARG . 51.1 t-20 -55.8 -51.98 65.58 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.677 -0.692 . . . . 0.0 110.837 179.502 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 342' ' ' ALA . . . . . . . . . . . . . . . -58.73 -32.76 69.51 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.015 179.897 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 343' ' ' LYS . . . . . . . . . . . . . 62.5 tttm -70.53 -38.28 74.19 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.948 179.882 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 344' ' ' GLU . . . . . . . . . . . . . 20.8 mm-40 -78.29 -22.75 47.76 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.056 -179.899 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 345' ' ' ALA . . . . . . . . . . . . . . . -76.66 -41.12 46.79 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.095 -179.967 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 346' ' ' GLY . . . . . . . . . . . . . . . 116.44 -69.08 0.28 Allowed Glycine 0 N--CA 1.451 -0.331 0 C-N-CA 120.761 -0.733 . . . . 0.0 112.504 -179.98 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 347' ' ' GLY . . . . . . . . . . . . . . . -172.34 -13.77 0.02 OUTLIER Glycine 0 N--CA 1.452 -0.293 0 C-N-CA 120.712 -0.756 . . . . 0.0 112.662 179.974 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 348' ' ' ASN . . . . . . . . . . . . . 2.0 m-20 -77.35 -0.72 26.71 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.852 0.358 . . . . 0.0 110.822 179.931 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 349' ' ' TYR . . . . . . . . . . . . . 60.0 t80 -95.29 150.36 20.34 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.807 -179.937 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 350' ' ' THR . . . . . . . . . . . . . 81.7 m -112.29 95.02 29.03 Favored Pre-proline 0 C--N 1.329 -0.303 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.981 179.981 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 351' ' ' PRO . . . . . . . . . . . . . 50.1 Cg_exo -54.35 133.89 58.4 Favored 'Trans proline' 0 C--N 1.348 0.512 0 C-N-CA 122.556 2.17 . . . . 0.0 112.529 179.928 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 352' ' ' ALA . . . . . . . . . . . . . . . -68.83 -54.34 16.31 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.838 179.838 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 353' ' ' LEU . . . . . 0.446 ' HG ' ' HG2' ' B' ' 357' ' ' GLU . 7.7 mp -107.42 131.23 54.5 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.989 -0.55 . . . . 0.0 111.068 179.972 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 354' ' ' THR . . . . . 0.401 ' H ' ' HB2' ' B' ' 357' ' ' GLU . 71.2 p -113.64 -177.39 3.12 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.64 179.601 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 355' ' ' GLU . . . . . . . . . . . . . 48.0 mt-10 -56.53 -35.79 68.48 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.953 0.406 . . . . 0.0 110.669 179.823 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 356' ' ' GLN . . . . . . . . . . . . . 86.2 mm-40 -74.28 -34.2 63.47 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.824 -0.625 . . . . 0.0 111.217 -179.907 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 357' ' ' GLU . . . . . 0.446 ' HG2' ' HG ' ' B' ' 353' ' ' LEU . 5.2 tp10 -63.71 -47.81 79.62 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.865 0.365 . . . . 0.0 110.513 -179.966 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 358' ' ' VAL . . . . . 0.485 ' O ' HG23 ' B' ' 362' ' ' VAL . 93.7 t -67.52 -55.31 17.66 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.334 -179.933 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 359' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER -53.34 -37.81 62.68 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.575 0.226 . . . . 0.0 111.29 -179.332 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 360' ' ' ALA . . . . . . . . . . . . . . . -67.12 -60.8 2.31 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.589 -0.278 . . . . 0.0 111.396 -179.784 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 361' ' ' GLN . . . . . . . . . . . . . 97.2 mt-30 -52.96 -45.44 67.76 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.341 -0.39 . . . . 0.0 110.81 179.918 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 362' ' ' VAL . . . . . 0.485 HG23 ' O ' ' B' ' 358' ' ' VAL . 99.1 t -62.02 -38.75 81.55 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.224 -0.443 . . . . 0.0 110.386 179.371 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 363' ' ' ALA . . . . . . . . . . . . . . . -65.97 -28.05 68.61 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.503 179.484 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 364' ' ' ARG . . . . . . . . . . . . . 61.1 ttp180 -84.63 -26.98 27.47 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.905 -0.588 . . . . 0.0 110.544 179.5 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 365' ' ' LEU . . . . . 0.405 HD21 ' HB3' ' B' ' 327' ' ' ALA . 1.2 mp -61.99 -37.43 84.78 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.022 -0.536 . . . . 0.0 110.675 179.758 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 366' ' ' PHE . . . . . . . . . . . . . 20.2 m-85 -117.09 156.91 26.77 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.922 -179.622 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 367' ' ' LYS . . . . . . . . . . . . . 63.4 tttp -123.36 -73.83 0.63 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.736 179.885 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 368' ' ' ASN . . . . . . . . . . . . . 27.7 t-20 -72.69 -18.05 61.58 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.554 179.789 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 369' ' ' GLN . . . . . . . . . . . . . 23.7 mp0 -94.71 86.99 4.9 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.846 179.937 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 370' ' ' GLU . . . . . . . . . . . . . 42.8 tt0 -93.69 -14.75 26.0 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.609 179.89 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 371' ' ' ASP . . . . . . . . . . . . . 18.5 t70 -55.69 -37.73 68.73 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.914 -0.585 . . . . 0.0 110.864 179.899 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 372' ' ' LEU . . . . . 0.4 ' H ' HD12 ' B' ' 372' ' ' LEU . 6.4 mp -67.06 -38.63 86.13 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.117 179.891 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 373' ' ' LEU . . . . . . . . . . . . . 27.3 mt -64.31 -44.27 92.1 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.404 -0.362 . . . . 0.0 110.926 -179.777 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 374' ' ' SER . . . . . . . . . . . . . 59.2 m -65.79 -55.0 19.5 Favored 'General case' 0 C--O 1.236 0.352 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.507 179.649 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 375' ' ' GLU . . . . . 0.447 ' HG3' ' NZ ' ' B' ' 313' ' ' LYS . 20.6 mm-40 -52.78 -38.55 61.25 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.993 -0.548 . . . . 0.0 110.075 179.409 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 376' ' ' PHE . . . . . . . . . . . . . 91.0 t80 -66.42 -41.67 88.89 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.026 179.268 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 377' ' ' GLY . . . . . . . . . . . . . . . -55.62 -35.84 63.25 Favored Glycine 0 N--CA 1.448 -0.503 0 C-N-CA 120.621 -0.8 . . . . 0.0 111.269 179.103 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 378' ' ' GLN . . . . . . . . . . . . . 18.8 mm-40 -56.99 -34.84 68.52 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.928 0.394 . . . . 0.0 110.421 179.01 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 379' ' ' PHE . . . . . . . . . . . . . 89.6 m-85 -74.31 -38.49 63.31 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.031 -0.532 . . . . 0.0 110.712 179.566 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 380' ' ' LEU . . . . . . . . . . . . . 10.9 tp -45.31 115.0 2.45 Favored Pre-proline 0 C--N 1.331 -0.231 0 CA-C-N 115.861 -0.609 . . . . 0.0 111.037 -179.475 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 381' ' ' PRO . . . . . 0.544 ' HA ' ' HA ' ' A' ' 377' ' ' ARG . 99.1 Cg_exo -45.05 124.7 6.16 Favored 'Trans proline' 0 C--N 1.35 0.645 0 C-N-CA 122.704 2.269 . . . . 0.0 112.628 -179.777 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 382' ' ' ASP . . . . . 0.521 ' H ' ' HA ' ' A' ' 377' ' ' ARG . 14.4 t70 -88.1 136.85 32.78 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.359 -0.382 . . . . 0.0 111.029 -179.967 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 383' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.1 0 CA-C-O 118.227 -0.892 . . . . 0.0 111.025 179.87 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 358' ' ' ASP . . . . . . . . . . . . . 5.0 p-10 . . . . . 0 N--CA 1.485 1.308 0 CA-C-O 120.71 0.291 . . . . 0.0 110.94 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 359' ' ' PHE . . . . . . . . . . . . . 24.8 p90 -136.08 172.36 13.13 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.956 -179.832 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 360' ' ' THR . . . . . . . . . . . . . 39.7 m -142.54 100.79 5.61 Favored Pre-proline 0 C--N 1.33 -0.241 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.974 179.945 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 361' ' ' PRO . . . . . . . . . . . . . 60.4 Cg_endo -72.78 -164.51 0.19 Allowed 'Trans proline' 0 C--N 1.349 0.58 0 C-N-CA 122.371 2.048 . . . . 0.0 112.128 179.912 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 362' ' ' MET . . . . . 0.472 ' SD ' HD13 ' B' ' 329' ' ' LEU . 12.1 tpt -54.34 -69.16 0.13 Allowed 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.584 179.686 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 363' ' ' ASP . . . . . 0.425 ' OD2' ' HG3' ' A' ' 362' ' ' MET . 4.0 p30 -167.79 -53.06 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.721 179.33 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 364' ' ' SER . . . . . 0.419 ' H ' ' H ' ' A' ' 365' ' ' SER . 47.7 t 177.14 6.39 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.088 -0.506 . . . . 0.0 110.599 179.993 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 365' ' ' SER . . . . . 0.419 ' H ' ' H ' ' A' ' 364' ' ' SER . 81.1 p -112.92 -21.01 11.35 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.501 -179.53 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 366' ' ' ALA . . . . . . . . . . . . . . . -58.38 -47.44 83.82 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.915 0.388 . . . . 0.0 110.993 179.898 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 367' ' ' VAL . . . . . . . . . . . . . 14.8 t -65.49 -22.09 30.34 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.868 -179.89 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 368' ' ' TYR . . . . . . . . . . . . . 61.5 t80 -65.14 -53.55 43.39 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.025 179.993 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 369' ' ' VAL . . . . . 0.4 HG23 ' N ' ' A' ' 370' ' ' LEU . 17.4 m -70.96 -45.23 74.03 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-N 116.457 -0.338 . . . . 0.0 111.093 179.881 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 370' ' ' LEU . . . . . 0.4 ' N ' HG23 ' A' ' 369' ' ' VAL . 98.9 mt -56.43 -37.97 70.94 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.386 -0.37 . . . . 0.0 110.739 179.762 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 371' ' ' SER . . . . . . . . . . . . . 83.1 p -70.51 -60.66 2.13 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.148 -179.994 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 372' ' ' SER . . . . . . . . . . . . . 79.3 p -52.56 -33.22 44.85 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.508 -0.315 . . . . 0.0 111.814 -179.28 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 373' ' ' MET . . . . . . . . . . . . . 95.8 mtp -74.4 -45.89 43.82 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 111.701 0.26 . . . . 0.0 111.701 -179.318 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 374' ' ' ALA . . . . . . . . . . . . . . . -84.48 -6.58 59.39 Favored 'General case' 0 C--N 1.331 -0.234 0 N-CA-C 112.339 0.496 . . . . 0.0 112.339 -179.217 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 375' ' ' ARG . . . . . 0.471 ' HE ' ' HA ' ' A' ' 375' ' ' ARG . 2.6 mmp_? -106.32 -27.51 10.95 Favored 'General case' 0 C--N 1.33 -0.276 0 N-CA-C 111.64 0.237 . . . . 0.0 111.64 -179.296 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 376' ' ' GLN . . . . . . . . . . . . . 34.9 tt0 -54.42 -85.38 0.01 OUTLIER 'General case' 0 C--N 1.333 -0.14 0 CA-C-O 120.702 0.287 . . . . 0.0 111.065 -179.8 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 377' ' ' ARG . . . . . 0.63 ' H ' ' HB3' ' B' ' 381' ' ' PRO . 81.5 mtp180 50.94 -158.66 0.09 Allowed 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.998 179.842 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 378' ' ' ARG . . . . . . . . . . . . . 78.5 ttt180 -60.85 -57.05 14.29 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.016 179.97 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 379' ' ' ALA . . . . . . . . . . . . . . . 60.42 -87.5 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.216 -179.817 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 380' ' ' SER . . . . . . . . . . . . . 43.6 t . . . . . 0 C--O 1.25 1.102 0 CA-C-O 118.31 -0.852 . . . . 0.0 111.111 179.897 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' B' B ' 295' ' ' SER . . . . . . . . . . . . . 64.9 m . . . . . 0 N--CA 1.486 1.346 0 CA-C-O 120.757 0.313 . . . . 0.0 110.85 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' B' B ' 296' ' ' LEU . . . . . 0.466 HD22 ' N ' ' B' ' 296' ' ' LEU . 3.3 mm? -94.41 -25.46 16.92 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.995 -179.789 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 297' ' ' GLN . . . . . . . . . . . . . 13.9 pt20 -162.48 9.82 0.06 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.023 179.871 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 298' ' ' ASN . . . . . . . . . . . . . 68.3 m-20 -95.59 134.48 38.42 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.003 179.926 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 299' ' ' ASN . . . . . . . . . . . . . 19.1 m120 60.21 102.27 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.092 -0.504 . . . . 0.0 111.068 179.977 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 300' ' ' GLN . . . . . . . . . . . . . 11.8 pt20 -99.52 151.61 37.51 Favored Pre-proline 0 C--N 1.33 -0.252 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.95 -179.998 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 301' ' ' PRO . . . . . . . . . . . . . 57.7 Cg_endo -70.71 119.38 6.28 Favored 'Trans proline' 0 C--N 1.348 0.524 0 C-N-CA 122.395 2.063 . . . . 0.0 112.296 -179.925 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 302' ' ' VAL . . . . . . . . . . . . . 22.1 m -89.39 -36.8 9.1 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-O 121.06 0.457 . . . . 0.0 111.29 -179.948 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 303' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -56.7 -68.76 0.19 Allowed 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.665 -0.698 . . . . 0.0 111.805 -178.859 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 304' ' ' PHE . . . . . 0.57 ' HA ' HD13 ' B' ' 308' ' ' ILE . 77.5 t80 -50.0 -63.58 1.07 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.867 -179.257 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 305' ' ' ASN . . . . . . . . . . . . . 53.9 t30 -46.57 -63.58 0.98 Allowed 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 112.355 0.502 . . . . 0.0 112.355 -178.803 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 306' ' ' HIS . . . . . . . . . . . . . 12.7 m-70 -55.23 -68.71 0.17 Allowed 'General case' 0 C--N 1.33 -0.266 0 N-CA-C 112.765 0.654 . . . . 0.0 112.765 -178.661 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 307' ' ' ALA . . . . . . . . . . . . . . . -48.68 -61.97 1.75 Allowed 'General case' 0 CA--C 1.532 0.254 0 N-CA-C 112.903 0.705 . . . . 0.0 112.903 -178.304 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 308' ' ' ILE . . . . . 0.57 HD13 ' HA ' ' B' ' 304' ' ' PHE . 1.8 mp -52.48 -61.22 0.82 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 N-CA-C 112.221 0.452 . . . . 0.0 112.221 -179.04 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 309' ' ' ASN . . . . . . . . . . . . . 54.0 t30 -55.4 -27.24 46.47 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.725 0.298 . . . . 0.0 111.518 -179.256 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 310' ' ' TYR . . . . . . . . . . . . . 82.3 t80 -68.02 -57.25 6.46 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.369 -0.378 . . . . 0.0 111.225 -179.726 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 311' ' ' VAL . . . . . . . . . . . . . 27.8 t -58.17 -44.77 88.38 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.163 0 CA-C-N 116.367 -0.379 . . . . 0.0 110.705 -179.969 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 312' ' ' ASN . . . . . . . . . . . . . 34.8 t30 -61.65 -37.15 82.96 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.13 -0.487 . . . . 0.0 110.628 179.722 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 313' ' ' LYS . . . . . . . . . . . . . 28.0 tttp -60.11 -57.11 14.25 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.963 179.827 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 314' ' ' ILE . . . . . . . . . . . . . 58.7 mt -67.51 -23.37 29.81 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.412 -179.619 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 315' ' ' LYS . . . . . . . . . . . . . 1.3 tmmt? -73.24 -36.58 66.45 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.318 -0.401 . . . . 0.0 111.142 -179.727 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 316' ' ' ASN . . . . . . . . . . . . . 24.0 t-20 -86.59 -43.19 12.87 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.412 -0.358 . . . . 0.0 111.469 -179.547 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 317' ' ' ARG . . . . . 0.43 ' HA ' ' HE ' ' B' ' 317' ' ' ARG . 5.7 tpm_? -64.02 -65.82 0.63 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.383 -0.371 . . . . 0.0 111.188 -179.779 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 318' ' ' PHE . . . . . . . . . . . . . 68.1 m-85 -81.62 31.59 0.35 Allowed 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.433 -179.639 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 319' ' ' GLN . . . . . . . . . . . . . 50.1 tt0 -68.69 -15.6 63.57 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.7 179.886 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 320' ' ' GLY . . . . . . . . . . . . . . . -74.53 -48.25 13.98 Favored Glycine 0 N--CA 1.452 -0.297 0 C-N-CA 120.888 -0.672 . . . . 0.0 112.604 179.964 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 321' ' ' GLN . . . . . . . . . . . . . 6.0 tp-100 -100.92 100.94 14.06 Favored Pre-proline 0 C--N 1.33 -0.242 0 CA-C-N 116.579 0.19 . . . . 0.0 110.754 179.878 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 322' ' ' PRO . . . . . . . . . . . . . 33.6 Cg_endo -64.58 -24.71 62.83 Favored 'Trans proline' 0 C--N 1.349 0.6 0 C-N-CA 122.495 2.13 . . . . 0.0 112.525 -179.914 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 323' ' ' ASP . . . . . . . . . . . . . 8.0 m-20 -62.79 -37.07 85.23 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.059 -179.741 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 324' ' ' ILE . . . . . . . . . . . . . 48.8 mm -68.85 -61.0 1.87 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.374 -0.376 . . . . 0.0 111.039 -179.882 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 325' ' ' TYR . . . . . . . . . . . . . 23.2 t80 -51.75 -51.86 53.08 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.911 -0.586 . . . . 0.0 111.013 -179.938 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 326' ' ' LYS . . . . . . . . . . . . . 63.0 tttm -58.3 -46.02 86.89 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.145 -179.844 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 327' ' ' ALA . . . . . . . . . . . . . . . -52.23 -55.28 22.26 Favored 'General case' 0 C--O 1.233 0.237 0 CA-C-O 120.875 0.369 . . . . 0.0 111.078 -179.986 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 328' ' ' PHE . . . . . . . . . . . . . 60.6 t80 -54.05 -45.17 71.59 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.473 179.77 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 329' ' ' LEU . . . . . 0.472 HD13 ' SD ' ' A' ' 362' ' ' MET . 73.4 mt -59.44 -35.16 73.51 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.737 179.569 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 330' ' ' GLU . . . . . . . . . . . . . 47.1 mt-10 -67.69 -37.1 81.82 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.446 179.653 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 331' ' ' ILE . . . . . . . . . . . . . 70.8 mt -63.69 -53.5 43.97 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.596 179.376 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 332' ' ' LEU . . . . . . . . . . . . . 8.4 mp -63.02 -35.42 80.17 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.838 179.732 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 333' ' ' HIS . . . . . . . . . . . . . 45.6 t60 -62.27 -52.9 61.89 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.905 0.384 . . . . 0.0 110.005 179.442 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 334' ' ' THR . . . . . 0.43 HG22 HD13 ' B' ' 353' ' ' LEU . 58.8 m -60.1 -32.07 70.64 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.984 -0.553 . . . . 0.0 109.886 179.004 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 335' ' ' TYR . . . . . . . . . . . . . 57.3 t80 -63.88 -38.66 91.9 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.641 -0.709 . . . . 0.0 109.879 179.273 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 336' ' ' GLN . . . . . . . . . . . . . 17.7 tt0 -66.35 -48.99 68.44 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.689 -0.687 . . . . 0.0 110.42 179.529 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 337' ' ' LYS . . . . . . . . . . . . . 38.6 ttpt -56.09 -50.62 70.52 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.807 -0.633 . . . . 0.0 111.018 179.987 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 338' ' ' GLU . . . . . . . . . . . . . 38.3 mm-40 -63.36 -35.67 81.16 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.139 -179.819 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 339' ' ' GLN . . . . . . . . . . . . . 23.3 tp60 -65.38 -45.65 83.22 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.719 179.936 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 340' ' ' ARG . . . . . . . . . . . . . 80.3 mtp180 -60.84 -50.53 73.07 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.604 179.705 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 341' ' ' ASN . . . . . . . . . . . . . 81.8 m-20 -54.9 -44.13 73.86 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.7 179.685 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 342' ' ' ALA . . . . . . . . . . . . . . . -64.76 -33.04 75.04 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.815 179.704 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 343' ' ' LYS . . . . . . . . . . . . . 39.5 ttpt -71.52 -40.07 70.33 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.862 179.799 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 344' ' ' GLU . . . . . . . . . . . . . 13.3 mm-40 -69.29 -33.56 73.38 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.906 179.993 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 345' ' ' ALA . . . . . . . . . . . . . . . -67.16 -32.67 73.92 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.165 -0.471 . . . . 0.0 111.021 179.922 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 346' ' ' GLY . . . . . . . . . . . . . . . 127.16 -46.06 1.11 Allowed Glycine 0 N--CA 1.451 -0.328 0 C-N-CA 120.788 -0.72 . . . . 0.0 112.514 179.988 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 347' ' ' GLY . . . . . . . . . . . . . . . 154.62 -25.65 0.66 Allowed Glycine 0 N--CA 1.452 -0.289 0 C-N-CA 120.806 -0.711 . . . . 0.0 112.448 -179.898 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 348' ' ' ASN . . . . . . . . . . . . . 26.5 t-20 -67.01 -21.92 65.92 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.713 0.292 . . . . 0.0 110.935 179.946 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 349' ' ' TYR . . . . . . . . . . . . . 63.1 t80 -63.52 147.19 52.04 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.779 -179.976 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 350' ' ' THR . . . . . . . . . . . . . 65.6 m -108.16 100.62 37.74 Favored Pre-proline 0 C--N 1.33 -0.257 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.03 -179.992 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 351' ' ' PRO . . . . . . . . . . . . . 57.7 Cg_exo -52.13 131.03 37.64 Favored 'Trans proline' 0 C--N 1.349 0.557 0 C-N-CA 122.42 2.08 . . . . 0.0 112.258 179.809 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 352' ' ' ALA . . . . . . . . . . . . . . . -59.78 -44.05 94.09 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.256 -179.796 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 353' ' ' LEU . . . . . 0.434 ' HG ' ' HG2' ' B' ' 357' ' ' GLU . 6.3 mp -112.02 120.16 40.92 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 120.998 0.428 . . . . 0.0 111.28 179.879 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 354' ' ' THR . . . . . . . . . . . . . 56.2 p -113.06 -164.18 0.9 Allowed 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.802 -0.635 . . . . 0.0 110.369 179.422 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 355' ' ' GLU . . . . . 0.402 ' H ' ' CD ' ' B' ' 355' ' ' GLU . 2.0 mp0 -61.29 -38.09 85.53 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 121.025 0.441 . . . . 0.0 110.368 179.681 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 356' ' ' GLN . . . . . . . . . . . . . 91.6 mt-30 -72.75 -40.91 65.65 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 115.868 -0.605 . . . . 0.0 111.317 -179.852 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 357' ' ' GLU . . . . . 0.434 ' HG2' ' HG ' ' B' ' 353' ' ' LEU . 4.8 tp10 -59.49 -53.1 62.02 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-O 120.785 0.326 . . . . 0.0 110.702 -179.793 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 358' ' ' VAL . . . . . 0.514 ' O ' HG23 ' B' ' 362' ' ' VAL . 49.9 t -61.82 -54.87 28.81 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.205 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.973 179.928 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 359' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER -52.28 -37.25 55.06 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.566 -0.288 . . . . 0.0 110.938 -179.524 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 360' ' ' ALA . . . . . . . . . . . . . . . -65.08 -58.64 5.53 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.43 -0.35 . . . . 0.0 111.411 -179.826 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 361' ' ' GLN . . . . . . . . . . . . . 52.4 mt-30 -55.83 -38.71 70.38 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.897 -179.889 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 362' ' ' VAL . . . . . 0.514 HG23 ' O ' ' B' ' 358' ' ' VAL . 60.4 t -71.01 -34.01 53.82 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.291 179.581 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 363' ' ' ALA . . . . . 0.547 ' HA ' HD21 ' B' ' 373' ' ' LEU . . . -64.2 -36.23 83.38 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.266 179.356 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 364' ' ' ARG . . . . . . . . . . . . . 58.9 mtp180 -87.18 -20.32 27.16 Favored 'General case' 0 N--CA 1.453 -0.286 0 CA-C-N 115.806 -0.634 . . . . 0.0 110.2 179.251 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 365' ' ' LEU . . . . . . . . . . . . . 23.6 tp -60.3 -21.11 61.58 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 115.824 -0.626 . . . . 0.0 109.916 179.239 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 366' ' ' PHE . . . . . . . . . . . . . 44.8 m-85 -131.13 -174.54 3.42 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.527 -0.76 . . . . 0.0 109.925 179.391 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 367' ' ' LYS . . . . . . . . . . . . . 66.5 mttm -133.89 -80.37 0.46 Allowed 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.745 0.307 . . . . 0.0 111.214 -179.943 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 368' ' ' ASN . . . . . . . . . . . . . 3.0 p-10 -90.18 8.83 30.98 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.955 -179.854 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 369' ' ' GLN . . . . . 0.439 ' HB3' HD13 ' B' ' 372' ' ' LEU . 73.7 mm-40 -91.49 84.51 5.55 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.869 179.832 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 370' ' ' GLU . . . . . . . . . . . . . 2.2 mp0 -89.92 -11.43 41.82 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.535 -0.302 . . . . 0.0 110.653 179.749 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 371' ' ' ASP . . . . . . . . . . . . . 5.3 m-20 -63.67 -46.89 83.49 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.468 179.629 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 372' ' ' LEU . . . . . 0.439 HD13 ' HB3' ' B' ' 369' ' ' GLN . 6.3 mp -68.17 -45.81 72.44 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.553 179.477 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 373' ' ' LEU . . . . . 0.547 HD21 ' HA ' ' B' ' 363' ' ' ALA . 1.1 mp -59.08 -33.58 70.98 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.739 -0.664 . . . . 0.0 111.046 -179.898 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 374' ' ' SER . . . . . . . . . . . . . 47.7 t -74.16 -57.51 3.91 Favored 'General case' 0 C--O 1.236 0.344 0 CA-C-O 120.949 0.404 . . . . 0.0 110.673 179.794 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 375' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -54.35 -32.81 57.71 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.133 179.505 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 376' ' ' PHE . . . . . 0.465 ' O ' ' HB2' ' B' ' 379' ' ' PHE . 66.9 t80 -79.6 -31.36 41.71 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.02 179.196 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 377' ' ' GLY . . . . . . . . . . . . . . . -61.71 -33.17 84.2 Favored Glycine 0 N--CA 1.448 -0.532 0 C-N-CA 120.593 -0.813 . . . . 0.0 111.236 179.12 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 378' ' ' GLN . . . . . . . . . . . . . 90.8 mt-30 -69.53 -26.73 64.66 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.753 0.311 . . . . 0.0 110.884 179.303 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 379' ' ' PHE . . . . . 0.465 ' HB2' ' O ' ' B' ' 376' ' ' PHE . 12.9 m-85 -61.67 -38.22 86.95 Favored 'General case' 0 C--N 1.333 -0.14 0 CA-C-N 116.277 -0.419 . . . . 0.0 111.298 -179.9 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 380' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -53.22 141.43 41.09 Favored Pre-proline 0 C--N 1.331 -0.213 0 CA-C-N 116.523 -0.308 . . . . 0.0 110.62 -179.966 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 381' ' ' PRO . . . . . 0.63 ' HB3' ' H ' ' A' ' 377' ' ' ARG . 39.6 Cg_endo -66.65 145.71 76.72 Favored 'Trans proline' 0 C--N 1.346 0.405 0 C-N-CA 122.404 2.069 . . . . 0.0 112.164 -179.817 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 382' ' ' ASP . . . . . 0.415 ' H ' ' HG2' ' A' ' 377' ' ' ARG . 5.3 m-20 -94.73 108.28 20.28 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.019 179.994 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 383' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.027 0 CA-C-O 118.216 -0.897 . . . . 0.0 111.104 179.851 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 358' ' ' ASP . . . . . . . . . . . . . 3.9 p30 . . . . . 0 N--CA 1.485 1.308 0 CA-C-O 120.758 0.313 . . . . 0.0 110.87 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 359' ' ' PHE . . . . . . . . . . . . . 86.4 t80 -150.17 133.99 16.81 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.983 179.989 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 360' ' ' THR . . . . . . . . . . . . . 49.6 m -112.44 94.34 26.85 Favored Pre-proline 0 C--N 1.33 -0.265 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.039 179.877 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 361' ' ' PRO . . . . . . . . . . . . . 56.9 Cg_endo -71.07 -170.59 0.49 Allowed 'Trans proline' 0 C--N 1.347 0.492 0 C-N-CA 122.387 2.058 . . . . 0.0 112.512 -179.881 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 362' ' ' MET . . . . . 0.634 ' HG3' HD13 ' B' ' 329' ' ' LEU . 20.6 ttt -59.56 -71.52 0.12 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.996 -0.547 . . . . 0.0 111.043 -179.882 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 363' ' ' ASP . . . . . . . . . . . . . 16.7 t70 -174.42 -40.65 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.11 -179.822 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 364' ' ' SER . . . . . . . . . . . . . 48.4 t -111.09 -67.16 1.02 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.732 -0.667 . . . . 0.0 110.428 179.675 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 365' ' ' SER . . . . . . . . . . . . . 33.7 t -175.03 92.05 0.06 Allowed 'General case' 0 C--N 1.333 -0.149 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.958 179.761 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 366' ' ' ALA . . . . . . . . . . . . . . . -77.29 -34.13 55.61 Favored 'General case' 0 C--O 1.235 0.305 0 CA-C-O 121.326 0.584 . . . . 0.0 110.355 179.465 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 367' ' ' VAL . . . . . . . . . . . . . 35.2 m -62.16 -16.59 16.32 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 115.608 -0.724 . . . . 0.0 110.414 179.376 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 368' ' ' TYR . . . . . . . . . . . . . 66.9 t80 -71.39 -56.84 5.17 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.54 179.743 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 369' ' ' VAL . . . . . 0.586 HG11 ' HB3' ' B' ' 332' ' ' LEU . 3.4 p -61.21 -44.53 98.54 Favored 'Isoleucine or valine' 0 C--O 1.232 0.147 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.455 179.533 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 370' ' ' LEU . . . . . . . . . . . . . 91.9 mt -64.0 -36.49 84.16 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.71 179.821 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 371' ' ' SER . . . . . 0.545 ' HA ' ' HB3' ' B' ' 303' ' ' GLU . 29.9 t -60.85 -61.44 2.58 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.896 179.772 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 372' ' ' SER . . . . . 0.407 ' O ' ' HG3' ' A' ' 376' ' ' GLN . 79.3 p -57.43 -33.07 67.53 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.991 -179.783 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 373' ' ' MET . . . . . . . . . . . . . 52.3 ttm -58.93 -56.96 15.5 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.365 -179.804 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 374' ' ' ALA . . . . . 0.506 ' HB3' ' OE1' ' B' ' 303' ' ' GLU . . . -84.23 -6.92 59.46 Favored 'General case' 0 C--N 1.33 -0.246 0 N-CA-C 112.016 0.376 . . . . 0.0 112.016 -179.379 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 375' ' ' ARG . . . . . . . . . . . . . 21.2 tpp180 -80.97 -40.86 23.72 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.734 0.302 . . . . 0.0 110.753 179.94 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 376' ' ' GLN . . . . . 0.407 ' HG3' ' O ' ' A' ' 372' ' ' SER . 56.6 mt-30 -57.05 -82.51 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.882 179.843 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 377' ' ' ARG . . . . . . . . . . . . . 47.1 ttp180 51.86 24.78 2.67 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-O 121.085 0.469 . . . . 0.0 110.709 179.902 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 378' ' ' ARG . . . . . . . . . . . . . 98.2 mtt180 -77.24 142.36 39.58 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.988 -179.739 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 379' ' ' ALA . . . . . . . . . . . . . . . -147.14 -30.06 0.35 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.196 -0.457 . . . . 0.0 111.165 -179.975 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 380' ' ' SER . . . . . . . . . . . . . 59.1 p . . . . . 0 C--O 1.249 1.034 0 CA-C-O 118.323 -0.846 . . . . 0.0 110.885 -179.987 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' B' B ' 295' ' ' SER . . . . . . . . . . . . . 54.4 m . . . . . 0 N--CA 1.484 1.239 0 CA-C-O 120.769 0.319 . . . . 0.0 110.997 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' B' B ' 296' ' ' LEU . . . . . . . . . . . . . 78.1 mt -141.02 172.49 12.6 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.719 -179.916 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 297' ' ' GLN . . . . . . . . . . . . . 83.7 mm-40 -130.86 -36.65 1.35 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.813 179.803 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 298' ' ' ASN . . . . . . . . . . . . . 84.2 m-20 -106.52 171.21 7.48 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.85 179.861 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 299' ' ' ASN . . . . . . . . . . . . . 1.9 m-20 61.45 97.29 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.926 -179.96 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 300' ' ' GLN . . . . . 0.581 ' HB2' ' HD3' ' B' ' 301' ' ' PRO . 46.5 mt-30 -65.03 -49.57 66.7 Favored Pre-proline 0 CA--C 1.534 0.336 0 CA-C-N 116.198 -0.456 . . . . 0.0 111.371 -179.897 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 301' ' ' PRO . . . . . 0.581 ' HD3' ' HB2' ' B' ' 300' ' ' GLN . 23.3 Cg_exo -65.05 93.75 0.22 Allowed 'Trans proline' 0 C--N 1.355 0.889 0 C-N-CA 122.16 1.906 . . . . 0.0 112.078 179.812 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 302' ' ' VAL . . . . . 0.457 HG13 ' N ' ' B' ' 303' ' ' GLU . 4.2 p -92.17 -48.73 13.53 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.278 -179.964 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 303' ' ' GLU . . . . . 0.545 ' HB3' ' HA ' ' A' ' 371' ' ' SER . 72.7 mm-40 -67.32 -40.17 85.94 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.092 -0.504 . . . . 0.0 111.815 -179.314 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 304' ' ' PHE . . . . . . . . . . . . . 83.8 m-85 -58.85 -62.06 2.16 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.416 -179.482 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 305' ' ' ASN . . . . . . . . . . . . . 47.4 t-20 -59.59 -43.14 93.78 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.845 -179.228 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 306' ' ' HIS . . . . . . . . . . . . . 7.0 t-160 -61.29 -65.4 0.7 Allowed 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 111.881 0.326 . . . . 0.0 111.881 -179.063 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 307' ' ' ALA . . . . . . . . . . . . . . . -54.23 -43.86 71.23 Favored 'General case' 0 C--N 1.33 -0.242 0 N-CA-C 112.147 0.425 . . . . 0.0 112.147 -179.036 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 308' ' ' ILE . . . . . . . . . . . . . 62.7 mt -58.87 -54.75 29.48 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-O 120.676 0.274 . . . . 0.0 111.393 -179.735 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 309' ' ' ASN . . . . . . . . . . . . . 4.9 m-20 -58.47 -30.88 67.32 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.835 0.35 . . . . 0.0 111.041 -179.962 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 310' ' ' TYR . . . . . 0.421 ' O ' ' HG3' ' B' ' 313' ' ' LYS . 24.0 t80 -65.38 -62.3 1.61 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.83 179.967 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 311' ' ' VAL . . . . . . . . . . . . . 56.4 t -61.3 -23.37 30.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.975 179.94 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 312' ' ' ASN . . . . . . . . . . . . . 27.2 t-20 -69.45 -56.72 6.6 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.486 -179.6 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 313' ' ' LYS . . . . . 0.421 ' HG3' ' O ' ' B' ' 310' ' ' TYR . 0.0 OUTLIER -64.69 -33.45 75.97 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.362 -0.381 . . . . 0.0 111.372 -179.381 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 314' ' ' ILE . . . . . . . . . . . . . 79.3 mt -72.22 -36.92 57.49 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-O 120.755 0.312 . . . . 0.0 111.278 179.774 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 315' ' ' LYS . . . . . . . . . . . . . 25.8 ttpp -67.93 -45.76 73.38 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.37 -0.377 . . . . 0.0 111.095 -179.761 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 316' ' ' ASN . . . . . . . . . . . . . 52.1 t-20 -68.58 -48.74 63.43 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.187 -0.461 . . . . 0.0 111.317 -179.625 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 317' ' ' ARG . . . . . . . . . . . . . 49.5 ttt180 -59.48 -64.2 1.03 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.481 -179.474 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 318' ' ' PHE . . . . . . . . . . . . . 96.8 m-85 -84.38 33.08 0.5 Allowed 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.323 -179.59 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 319' ' ' GLN . . . . . . . . . . . . . 7.1 tp60 -64.87 -20.16 66.28 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.416 -0.356 . . . . 0.0 110.702 179.795 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 320' ' ' GLY . . . . . . . . . . . . . . . -85.72 -21.15 54.45 Favored Glycine 0 C--N 1.33 0.213 0 C-N-CA 120.858 -0.687 . . . . 0.0 112.626 179.936 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 321' ' ' GLN . . . . . . . . . . . . . 29.6 mm-40 -106.87 96.45 14.71 Favored Pre-proline 0 C--N 1.33 -0.261 0 CA-C-O 120.539 0.209 . . . . 0.0 110.809 179.91 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 322' ' ' PRO . . . . . . . . . . . . . 86.7 Cg_endo -78.4 -28.46 4.51 Favored 'Trans proline' 0 C--N 1.348 0.537 0 C-N-CA 122.417 2.078 . . . . 0.0 112.72 -179.817 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 323' ' ' ASP . . . . . . . . . . . . . 31.3 m-20 -65.29 -48.01 74.64 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.354 -0.384 . . . . 0.0 111.103 -179.725 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 324' ' ' ILE . . . . . . . . . . . . . 71.6 mt -66.2 -47.25 85.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.236 -179.962 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 325' ' ' TYR . . . . . 0.404 ' CE2' HD11 ' B' ' 329' ' ' LEU . 41.1 t80 -55.82 -57.73 10.8 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.982 -179.989 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 326' ' ' LYS . . . . . 0.476 ' O ' ' HG3' ' B' ' 330' ' ' GLU . 98.5 mttt -55.53 -48.85 74.04 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.046 -0.524 . . . . 0.0 111.259 -179.898 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 327' ' ' ALA . . . . . . . . . . . . . . . -49.08 -51.67 30.22 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.372 -0.377 . . . . 0.0 111.231 -179.922 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 328' ' ' PHE . . . . . . . . . . . . . 84.1 t80 -56.33 -46.03 80.07 Favored 'General case' 0 C--O 1.235 0.324 0 CA-C-N 116.191 -0.459 . . . . 0.0 109.975 179.316 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 329' ' ' LEU . . . . . 0.634 HD13 ' HG3' ' A' ' 362' ' ' MET . 83.5 mt -58.71 -31.22 68.06 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 115.711 -0.677 . . . . 0.0 110.186 179.042 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 330' ' ' GLU . . . . . 0.476 ' HG3' ' O ' ' B' ' 326' ' ' LYS . 38.8 mt-10 -71.73 -36.05 70.36 Favored 'General case' 0 C--N 1.333 -0.13 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.679 179.65 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 331' ' ' ILE . . . . . . . . . . . . . 61.5 mt -65.48 -47.8 85.32 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.152 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.872 179.881 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 332' ' ' LEU . . . . . 0.586 ' HB3' HG11 ' A' ' 369' ' ' VAL . 14.0 mt -67.36 -37.82 83.8 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.412 -0.358 . . . . 0.0 110.899 179.97 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 333' ' ' HIS . . . . . . . . . . . . . 48.4 t-80 -61.29 -57.89 10.52 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.649 179.635 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 334' ' ' THR . . . . . 0.448 HG22 HD13 ' B' ' 353' ' ' LEU . 86.3 m -59.56 -35.17 73.73 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.915 -0.584 . . . . 0.0 111.005 179.842 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 335' ' ' TYR . . . . . . . . . . . . . 83.4 t80 -61.1 -60.35 3.9 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.902 -179.935 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 336' ' ' GLN . . . . . . . . . . . . . 6.5 tp60 -56.98 -33.62 67.28 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.715 -179.856 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 337' ' ' LYS . . . . . . . . . . . . . 23.9 ttmm -59.02 -54.27 48.97 Favored 'General case' 0 C--O 1.234 0.251 0 CA-C-O 120.971 0.415 . . . . 0.0 110.528 179.296 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 338' ' ' GLU . . . . . . . . . . . . . 26.2 mm-40 -60.05 -33.69 72.39 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.296 179.468 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 339' ' ' GLN . . . . . . . . . . . . . 57.7 tp60 -64.1 -43.5 95.17 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.464 179.549 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 340' ' ' ARG . . . . . . . . . . . . . 94.7 mtt180 -61.83 -53.89 49.67 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.597 179.68 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 341' ' ' ASN . . . . . . . . . . . . . 47.9 t-20 -57.6 -33.05 67.8 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.507 179.696 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 342' ' ' ALA . . . . . . . . . . . . . . . -65.91 -43.28 88.62 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.937 -0.574 . . . . 0.0 111.023 179.917 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 343' ' ' LYS . . . . . . . . . . . . . 88.2 tttt -66.93 -39.79 87.42 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.839 179.965 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 344' ' ' GLU . . . . . . . . . . . . . 12.6 mm-40 -69.54 -31.79 70.21 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.898 -179.978 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 345' ' ' ALA . . . . . . . . . . . . . . . -66.43 -24.7 66.5 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.243 -179.878 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 346' ' ' GLY . . . . . . . . . . . . . . . 63.99 41.86 98.45 Favored Glycine 0 N--CA 1.452 -0.262 0 C-N-CA 120.873 -0.68 . . . . 0.0 112.47 179.992 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 347' ' ' GLY . . . . . . . . . . . . . . . 96.6 178.77 35.22 Favored Glycine 0 N--CA 1.452 -0.237 0 C-N-CA 120.762 -0.732 . . . . 0.0 112.665 179.806 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 348' ' ' ASN . . . . . . . . . . . . . 76.8 m-20 59.81 13.93 3.85 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-O 120.749 0.309 . . . . 0.0 111.256 179.913 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 349' ' ' TYR . . . . . . . . . . . . . 62.5 t80 -114.24 137.2 52.08 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.843 179.929 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 350' ' ' THR . . . . . . . . . . . . . 90.8 m -110.41 96.95 29.36 Favored Pre-proline 0 C--N 1.331 -0.228 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.019 -179.957 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 351' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_exo -51.41 137.16 48.15 Favored 'Trans proline' 0 C--N 1.349 0.564 0 C-N-CA 122.476 2.118 . . . . 0.0 112.057 179.846 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 352' ' ' ALA . . . . . . . . . . . . . . . -64.32 -58.99 4.92 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.11 -0.495 . . . . 0.0 111.562 -179.485 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 353' ' ' LEU . . . . . 0.448 HD13 HG22 ' B' ' 334' ' ' THR . 6.7 mp -101.12 128.93 46.97 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.923 0.392 . . . . 0.0 111.535 -179.536 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 354' ' ' THR . . . . . . . . . . . . . 61.6 p -113.1 -173.9 2.35 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.528 179.429 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 355' ' ' GLU . . . . . . . . . . . . . 31.2 mt-10 -58.59 -35.2 72.04 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.992 0.425 . . . . 0.0 110.578 179.783 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 356' ' ' GLN . . . . . . . . . . . . . 52.0 tt0 -73.86 -37.91 64.63 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.887 -0.597 . . . . 0.0 111.01 -179.881 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 357' ' ' GLU . . . . . 0.436 ' HG2' ' HG ' ' B' ' 353' ' ' LEU . 6.9 tp10 -62.5 -45.83 91.23 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-O 120.925 0.393 . . . . 0.0 110.575 179.998 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 358' ' ' VAL . . . . . 0.52 ' O ' HG23 ' B' ' 362' ' ' VAL . 70.5 t -66.76 -58.19 7.36 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.02 -0.536 . . . . 0.0 111.114 179.933 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 359' ' ' TYR . . . . . . . . . . . . . 40.3 t80 -52.09 -32.43 34.9 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.611 -0.268 . . . . 0.0 111.087 -179.626 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 360' ' ' ALA . . . . . . . . . . . . . . . -68.91 -56.51 7.66 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.412 -0.358 . . . . 0.0 111.043 179.868 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 361' ' ' GLN . . . . . . . . . . . . . 53.4 mt-30 -57.01 -44.35 82.74 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.73 179.872 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 362' ' ' VAL . . . . . 0.52 HG23 ' O ' ' B' ' 358' ' ' VAL . 45.2 t -65.56 -32.96 60.49 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.524 179.84 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 363' ' ' ALA . . . . . 0.693 ' HA ' HD21 ' B' ' 373' ' ' LEU . . . -62.48 -51.67 66.53 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.722 179.645 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 364' ' ' ARG . . . . . . . . . . . . . 96.7 mtt180 -75.1 -18.38 60.27 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.625 179.58 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 365' ' ' LEU . . . . . . . . . . . . . 7.2 tp -59.66 -31.91 69.98 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.731 179.894 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 366' ' ' PHE . . . . . . . . . . . . . 58.4 m-85 -118.16 173.32 6.86 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.57 179.8 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 367' ' ' LYS . . . . . . . . . . . . . 47.3 mmtm -129.25 -78.16 0.55 Allowed 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.754 0.312 . . . . 0.0 111.373 -179.775 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 368' ' ' ASN . . . . . . . . . . . . . 7.5 t30 -82.95 -10.17 58.93 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.142 -179.65 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 369' ' ' GLN . . . . . . . . . . . . . 19.5 mp0 -94.2 87.59 5.31 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.411 -0.359 . . . . 0.0 111.143 -179.784 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 370' ' ' GLU . . . . . . . . . . . . . 44.0 mt-10 -94.45 -10.59 31.89 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.726 179.516 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 371' ' ' ASP . . . . . . . . . . . . . 13.8 t70 -58.48 -38.05 76.81 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.429 179.674 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 372' ' ' LEU . . . . . 0.45 ' H ' HD12 ' B' ' 372' ' ' LEU . 6.0 mp -70.12 -39.2 75.6 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.905 -0.588 . . . . 0.0 110.49 179.316 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 373' ' ' LEU . . . . . 0.693 HD21 ' HA ' ' B' ' 363' ' ' ALA . 1.4 mp -65.73 -36.27 83.12 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.582 -0.735 . . . . 0.0 111.305 -179.702 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 374' ' ' SER . . . . . . . . . . . . . 87.8 p -71.72 -51.18 24.16 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.883 0.373 . . . . 0.0 110.287 179.663 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 375' ' ' GLU . . . . . . . . . . . . . 11.1 mm-40 -58.33 -33.38 69.45 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.263 179.347 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 376' ' ' PHE . . . . . 0.436 ' HA ' ' HB2' ' B' ' 379' ' ' PHE . 64.6 t80 -80.8 -29.7 36.0 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.151 179.373 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 377' ' ' GLY . . . . . . . . . . . . . . . -62.84 -40.13 98.87 Favored Glycine 0 N--CA 1.45 -0.412 0 C-N-CA 120.715 -0.755 . . . . 0.0 111.388 179.267 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 378' ' ' GLN . . . . . . . . . . . . . 12.9 mm100 -78.04 -16.89 57.68 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.053 0.454 . . . . 0.0 110.093 179.074 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 379' ' ' PHE . . . . . 0.436 ' HB2' ' HA ' ' B' ' 376' ' ' PHE . 0.2 OUTLIER -68.31 -42.3 79.61 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.714 -0.675 . . . . 0.0 110.622 179.803 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 380' ' ' LEU . . . . . . . . . . . . . 64.0 mt -56.82 147.32 53.74 Favored Pre-proline 0 C--N 1.33 -0.247 0 CA-C-N 116.013 -0.54 . . . . 0.0 110.866 -179.932 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 381' ' ' PRO . . . . . . . . . . . . . 70.9 Cg_exo -48.79 108.71 0.2 Allowed 'Trans proline' 0 C--N 1.347 0.497 0 C-N-CA 122.68 2.253 . . . . 0.0 112.554 -179.989 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 382' ' ' ASP . . . . . . . . . . . . . 7.9 m-20 -85.02 -172.05 3.97 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.879 179.918 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 383' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.074 0 CA-C-O 118.23 -0.89 . . . . 0.0 111.222 -179.924 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 358' ' ' ASP . . . . . . . . . . . . . 6.2 m-20 . . . . . 0 N--CA 1.486 1.327 0 CA-C-O 120.822 0.344 . . . . 0.0 110.98 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 359' ' ' PHE . . . . . . . . . . . . . 48.7 p90 -158.15 165.87 33.87 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.758 179.974 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 360' ' ' THR . . . . . . . . . . . . . 61.1 p -128.8 130.72 23.47 Favored Pre-proline 0 C--N 1.33 -0.252 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.955 179.88 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 361' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.17 -162.24 0.08 OUTLIER 'Trans proline' 0 C--N 1.348 0.502 0 C-N-CA 122.436 2.09 . . . . 0.0 112.242 -179.933 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 362' ' ' MET . . . . . 0.512 ' HG3' HD13 ' B' ' 329' ' ' LEU . 23.8 ttt -51.39 -50.22 60.03 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.911 -179.99 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 363' ' ' ASP . . . . . . . . . . . . . 18.5 t70 -171.13 -71.5 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.581 179.962 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 364' ' ' SER . . . . . . . . . . . . . 34.6 t -174.96 20.55 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.541 179.953 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 365' ' ' SER . . . . . 0.414 ' O ' HG23 ' A' ' 369' ' ' VAL . 80.4 p -124.93 -39.77 2.23 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.403 -179.799 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 366' ' ' ALA . . . . . . . . . . . . . . . -53.68 -44.03 69.37 Favored 'General case' 0 C--O 1.233 0.209 0 CA-C-O 120.786 0.327 . . . . 0.0 111.418 -179.664 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 367' ' ' VAL . . . . . . . . . . . . . 20.6 m -60.36 -30.29 45.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.232 179.911 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 368' ' ' TYR . . . . . . . . . . . . . 37.1 t80 -75.87 -40.54 54.35 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.991 -179.76 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 369' ' ' VAL . . . . . 0.45 HG22 ' HB2' ' B' ' 336' ' ' GLN . 20.1 t -63.31 -43.56 98.69 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.162 -179.923 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 370' ' ' LEU . . . . . . . . . . . . . 96.5 mt -71.37 -47.14 58.14 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.018 179.93 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 371' ' ' SER . . . . . 0.474 ' HA ' ' HB2' ' B' ' 303' ' ' GLU . 79.7 p -58.92 -33.0 70.07 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.219 -179.859 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 372' ' ' SER . . . . . . . . . . . . . 79.1 p -76.82 -58.01 3.52 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.417 -0.356 . . . . 0.0 111.409 -179.475 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 373' ' ' MET . . . . . . . . . . . . . 20.4 ptm -55.59 -26.81 45.84 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.382 -0.372 . . . . 0.0 111.605 -179.451 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 374' ' ' ALA . . . . . . . . . . . . . . . -87.04 -44.04 11.87 Favored 'General case' 0 C--N 1.33 -0.271 0 N-CA-C 111.692 0.256 . . . . 0.0 111.692 -179.722 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 375' ' ' ARG . . . . . 0.658 ' HB2' ' HG2' ' B' ' 303' ' ' GLU . 21.4 tpp180 -64.89 -26.67 68.42 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.83 0.348 . . . . 0.0 110.753 -179.969 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 376' ' ' GLN . . . . . . . . . . . . . 15.1 mm100 -69.59 -7.32 37.58 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.045 179.852 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 377' ' ' ARG . . . . . 0.644 ' HG3' ' H ' ' B' ' 382' ' ' ASP . 74.2 ttt180 -58.99 -37.63 77.31 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.907 0.384 . . . . 0.0 110.609 179.69 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 378' ' ' ARG . . . . . 0.449 HH11 ' HD3' ' A' ' 377' ' ' ARG . 0.1 OUTLIER -100.95 146.45 27.37 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.848 179.884 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 379' ' ' ALA . . . . . . . . . . . . . . . -90.66 120.33 31.64 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.05 179.972 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 380' ' ' SER . . . . . . . . . . . . . 68.8 p . . . . . 0 C--O 1.249 1.047 0 CA-C-O 118.128 -0.939 . . . . 0.0 110.946 -179.973 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' B' B ' 295' ' ' SER . . . . . . . . . . . . . 52.6 m . . . . . 0 N--CA 1.484 1.266 0 CA-C-O 120.692 0.282 . . . . 0.0 110.958 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' B' B ' 296' ' ' LEU . . . . . . . . . . . . . 59.1 mt 60.7 100.73 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.148 179.905 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 297' ' ' GLN . . . . . . . . . . . . . 57.3 tp60 -163.61 -42.95 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.835 179.977 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 298' ' ' ASN . . . . . . . . . . . . . 26.1 p-10 -137.91 15.11 2.88 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.815 -179.911 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 299' ' ' ASN . . . . . . . . . . . . . 13.7 m120 -85.59 1.24 49.95 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.119 -0.492 . . . . 0.0 111.128 -179.816 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 300' ' ' GLN . . . . . 0.507 ' N ' ' HD2' ' B' ' 301' ' ' PRO . 6.1 tp-100 -82.51 -51.09 0.75 Allowed Pre-proline 0 CA--C 1.534 0.363 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.425 -179.935 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 301' ' ' PRO . . . . . 0.605 ' HB2' ' HB3' ' B' ' 304' ' ' PHE . 54.3 Cg_endo -69.24 118.93 5.98 Favored 'Trans proline' 0 C--N 1.354 0.819 0 C-N-CA 122.09 1.86 . . . . 0.0 112.124 179.883 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 302' ' ' VAL . . . . . 0.52 HG23 ' H ' ' B' ' 303' ' ' GLU . 8.8 m -92.12 -55.15 6.46 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.752 -179.738 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 303' ' ' GLU . . . . . 0.658 ' HG2' ' HB2' ' A' ' 375' ' ' ARG . 0.0 OUTLIER -72.26 -30.92 65.31 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.266 -0.425 . . . . 0.0 111.72 -179.273 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 304' ' ' PHE . . . . . 0.605 ' HB3' ' HB2' ' B' ' 301' ' ' PRO . 84.7 t80 -72.65 -51.05 21.14 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.678 0.275 . . . . 0.0 110.915 -179.663 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 305' ' ' ASN . . . . . . . . . . . . . 60.6 t30 -64.46 -40.39 95.62 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.858 -179.975 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 306' ' ' HIS . . . . . . . . . . . . . 15.6 t-160 -66.8 -39.48 87.75 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.344 -0.389 . . . . 0.0 111.011 179.954 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 307' ' ' ALA . . . . . . . . . . . . . . . -67.09 -49.93 63.31 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.39 -0.368 . . . . 0.0 111.58 -179.712 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 308' ' ' ILE . . . . . 0.427 HG13 ' N ' ' B' ' 309' ' ' ASN . 47.6 pt -62.38 -38.41 81.16 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.221 0 CA-C-O 120.682 0.277 . . . . 0.0 111.204 -179.681 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 309' ' ' ASN . . . . . 0.427 ' N ' HG13 ' B' ' 308' ' ' ILE . 95.9 m-20 -70.41 -32.64 70.34 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.404 -0.362 . . . . 0.0 110.605 179.681 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 310' ' ' TYR . . . . . . . . . . . . . 49.3 t80 -67.07 -51.63 52.07 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.607 179.808 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 311' ' ' VAL . . . . . . . . . . . . . 97.8 t -60.27 -43.8 94.25 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.212 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.605 179.338 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 312' ' ' ASN . . . . . . . . . . . . . 49.4 t30 -64.37 -31.69 72.99 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.513 179.578 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 313' ' ' LYS . . . . . . . . . . . . . 20.6 tttp -65.04 -56.8 10.95 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.912 -0.586 . . . . 0.0 110.672 179.648 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 314' ' ' ILE . . . . . . . . . . . . . 30.3 mt -62.61 -28.87 45.65 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.777 -179.912 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 315' ' ' LYS . . . . . . . . . . . . . 22.1 ttmm -70.47 -36.75 74.07 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.74 179.726 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 316' ' ' ASN . . . . . . . . . . . . . 66.5 m-20 -82.23 -58.78 2.8 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.942 -0.572 . . . . 0.0 111.445 -179.8 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 317' ' ' ARG . . . . . . . . . . . . . 25.4 tpp180 -54.13 -64.4 0.84 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.096 179.988 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 318' ' ' PHE . . . . . . . . . . . . . 91.6 m-85 -86.71 42.8 1.03 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.97 179.896 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 319' ' ' GLN . . . . . . . . . . . . . 6.6 tp-100 -68.39 -22.57 64.63 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.821 179.904 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 320' ' ' GLY . . . . . . . . . . . . . . . -89.02 -15.77 58.76 Favored Glycine 0 N--CA 1.452 -0.291 0 C-N-CA 120.761 -0.733 . . . . 0.0 112.507 179.969 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 321' ' ' GLN . . . . . . . . . . . . . 24.3 mp0 -111.24 91.89 14.56 Favored Pre-proline 0 C--N 1.33 -0.267 0 CA-C-O 120.586 0.231 . . . . 0.0 110.958 -179.975 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 322' ' ' PRO . . . . . . . . . . . . . 96.7 Cg_endo -82.24 -18.28 7.37 Favored 'Trans proline' 0 C--N 1.348 0.513 0 C-N-CA 122.625 2.217 . . . . 0.0 112.392 179.875 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 323' ' ' ASP . . . . . . . . . . . . . 18.0 t70 -69.65 -50.58 42.76 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.701 -179.907 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 324' ' ' ILE . . . . . . . . . . . . . 56.3 mt -64.58 -43.86 96.76 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-N 116.081 -0.508 . . . . 0.0 110.85 179.857 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 325' ' ' TYR . . . . . 0.402 ' O ' ' HG ' ' B' ' 329' ' ' LEU . 25.8 t80 -59.61 -48.18 82.67 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.647 179.822 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 326' ' ' LYS . . . . . . . . . . . . . 60.6 tttm -60.05 -45.51 92.63 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.937 -179.972 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 327' ' ' ALA . . . . . . . . . . . . . . . -55.08 -50.47 69.08 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.123 179.944 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 328' ' ' PHE . . . . . . . . . . . . . 66.3 t80 -55.78 -49.33 73.45 Favored 'General case' 0 C--O 1.234 0.273 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.53 179.781 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 329' ' ' LEU . . . . . 0.512 HD13 ' HG3' ' A' ' 362' ' ' MET . 93.1 mt -56.26 -34.3 66.28 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.53 179.541 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 330' ' ' GLU . . . . . . . . . . . . . 19.4 mm-40 -69.56 -37.45 77.02 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.869 179.85 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 331' ' ' ILE . . . . . 0.513 HG22 HG22 ' B' ' 358' ' ' VAL . 71.0 mt -62.48 -48.21 89.36 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-N 116.391 -0.368 . . . . 0.0 110.433 179.358 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 332' ' ' LEU . . . . . . . . . . . . . 10.7 mp -68.53 -31.03 69.97 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.97 179.786 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 333' ' ' HIS . . . . . . . . . . . . . 40.4 t60 -63.97 -59.52 4.39 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.93 0.395 . . . . 0.0 110.231 179.532 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 334' ' ' THR . . . . . 0.416 HG22 HD13 ' B' ' 353' ' ' LEU . 94.6 m -58.03 -38.97 77.22 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.87 -0.604 . . . . 0.0 110.471 179.366 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 335' ' ' TYR . . . . . . . . . . . . . 75.2 t80 -58.14 -43.85 87.51 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.744 -0.662 . . . . 0.0 110.306 179.509 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 336' ' ' GLN . . . . . 0.45 ' HB2' HG22 ' A' ' 369' ' ' VAL . 58.5 tt0 -64.57 -42.57 95.55 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.769 -0.651 . . . . 0.0 110.802 179.974 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 337' ' ' LYS . . . . . . . . . . . . . 28.2 ttpp -58.3 -41.38 84.35 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.734 179.82 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 338' ' ' GLU . . . . . . . . . . . . . 24.9 mm-40 -66.13 -42.23 89.43 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.884 179.661 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 339' ' ' GLN . . . . . . . . . . . . . 21.4 tm0? -59.97 -49.29 78.24 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.13 -0.487 . . . . 0.0 110.593 179.668 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 340' ' ' ARG . . . . . . . . . . . . . 99.6 mtt180 -57.0 -53.82 53.7 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.896 179.867 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 341' ' ' ASN . . . . . . . . . . . . . 85.4 m-20 -53.63 -38.47 64.1 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.936 179.923 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 342' ' ' ALA . . . . . . . . . . . . . . . -68.41 -32.95 73.36 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.92 179.875 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 343' ' ' LYS . . . . . . . . . . . . . 61.2 tttp -68.94 -49.23 59.85 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.092 -0.504 . . . . 0.0 111.006 179.822 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 344' ' ' GLU . . . . . . . . . . . . . 14.8 mm-40 -65.15 -36.03 82.97 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.236 -179.817 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 345' ' ' ALA . . . . . . . . . . . . . . . -57.82 -37.48 73.89 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.253 -179.965 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 346' ' ' GLY . . . . . . . . . . . . . . . 70.97 58.36 5.73 Favored Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 120.72 -0.752 . . . . 0.0 112.37 -179.856 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 347' ' ' GLY . . . . . . . . . . . . . . . 79.35 179.02 51.75 Favored Glycine 0 N--CA 1.45 -0.368 0 C-N-CA 120.773 -0.727 . . . . 0.0 112.397 -179.854 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 348' ' ' ASN . . . . . . . . . . . . . 18.5 m120 57.13 20.43 5.57 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.598 0.237 . . . . 0.0 111.283 179.988 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 349' ' ' TYR . . . . . . . . . . . . . 50.0 t80 -122.45 146.53 47.28 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.424 -0.353 . . . . 0.0 110.918 -180.0 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 350' ' ' THR . . . . . . . . . . . . . 59.8 m -120.71 101.46 45.7 Favored Pre-proline 0 C--N 1.328 -0.341 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.017 -179.866 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 351' ' ' PRO . . . . . . . . . . . . . 46.2 Cg_exo -56.36 170.67 1.13 Allowed 'Trans proline' 0 C--N 1.35 0.619 0 C-N-CA 122.505 2.137 . . . . 0.0 112.126 179.795 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 352' ' ' ALA . . . . . . . . . . . . . . . -98.41 -69.44 0.76 Allowed 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.378 -0.374 . . . . 0.0 111.458 -179.858 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 353' ' ' LEU . . . . . 0.446 ' HG ' ' HG2' ' B' ' 357' ' ' GLU . 6.2 mp -87.62 119.68 28.16 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.308 -0.405 . . . . 0.0 111.205 -179.777 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 354' ' ' THR . . . . . . . . . . . . . 81.7 p -107.42 -175.16 2.71 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.978 -0.556 . . . . 0.0 110.368 179.342 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 355' ' ' GLU . . . . . . . . . . . . . 39.9 mt-10 -54.36 -35.93 63.29 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.056 0.455 . . . . 0.0 110.484 179.718 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 356' ' ' GLN . . . . . . . . . . . . . 90.5 mt-30 -72.93 -41.22 64.75 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.928 -179.998 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 357' ' ' GLU . . . . . 0.446 ' HG2' ' HG ' ' B' ' 353' ' ' LEU . 5.3 tp10 -57.52 -50.72 72.14 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.933 0.397 . . . . 0.0 110.58 -179.914 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 358' ' ' VAL . . . . . 0.559 ' O ' HG23 ' B' ' 362' ' ' VAL . 55.0 t -64.33 -58.88 5.38 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 115.982 -0.554 . . . . 0.0 111.013 179.887 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 359' ' ' TYR . . . . . . . . . . . . . 39.0 t80 -51.14 -27.16 7.87 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.491 -0.322 . . . . 0.0 111.279 -179.452 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 360' ' ' ALA . . . . . . . . . . . . . . . -74.09 -54.21 8.31 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.77 0.319 . . . . 0.0 110.838 179.59 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 361' ' ' GLN . . . . . . . . . . . . . 77.2 mt-30 -60.54 -36.01 77.39 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.527 179.705 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 362' ' ' VAL . . . . . 0.559 HG23 ' O ' ' B' ' 358' ' ' VAL . 51.2 t -70.02 -40.31 78.38 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.214 0 CA-C-N 116.013 -0.54 . . . . 0.0 110.347 179.538 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 363' ' ' ALA . . . . . 0.606 ' HA ' HD21 ' B' ' 373' ' ' LEU . . . -61.82 -38.09 86.86 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.346 179.414 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 364' ' ' ARG . . . . . . . . . . . . . 38.3 ttm180 -80.08 -23.84 41.02 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.783 -0.644 . . . . 0.0 110.146 179.317 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 365' ' ' LEU . . . . . . . . . . . . . 2.5 tp -60.64 -29.03 69.0 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.487 179.627 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 366' ' ' PHE . . . . . . . . . . . . . 25.0 m-85 -125.55 -177.98 4.09 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.38 179.747 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 367' ' ' LYS . . . . . . . . . . . . . 68.4 mttm -137.4 -82.87 0.34 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.399 -0.364 . . . . 0.0 111.164 179.919 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 368' ' ' ASN . . . . . . . . . . . . . 27.6 p-10 -82.65 1.03 40.39 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.802 0.334 . . . . 0.0 110.918 179.995 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 369' ' ' GLN . . . . . 0.409 ' HB3' HD13 ' B' ' 372' ' ' LEU . 21.2 mp0 -98.32 58.14 1.26 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.6 179.842 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 370' ' ' GLU . . . . . . . . . . . . . 41.2 mt-10 -69.78 -13.0 62.06 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.852 -179.928 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 371' ' ' ASP . . . . . . . . . . . . . 11.6 m-20 -55.58 -39.69 71.03 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.459 179.809 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 372' ' ' LEU . . . . . 0.421 ' H ' HD12 ' B' ' 372' ' ' LEU . 6.2 mp -69.97 -37.99 75.95 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.567 179.649 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 373' ' ' LEU . . . . . 0.606 HD21 ' HA ' ' B' ' 363' ' ' ALA . 2.7 mp -62.19 -34.65 76.85 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.844 179.828 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 374' ' ' SER . . . . . . . . . . . . . 51.0 m -73.44 -55.66 6.07 Favored 'General case' 0 C--O 1.234 0.28 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.261 179.335 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 375' ' ' GLU . . . . . . . . . . . . . 43.0 mt-10 -54.91 -33.25 61.89 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-N 115.934 -0.576 . . . . 0.0 110.26 179.357 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 376' ' ' PHE . . . . . 0.429 ' O ' ' HB2' ' B' ' 379' ' ' PHE . 87.3 t80 -82.27 -30.21 30.77 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.025 179.333 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 377' ' ' GLY . . . . . . . . . . . . . . . -61.93 -33.51 85.74 Favored Glycine 0 N--CA 1.448 -0.564 0 C-N-CA 120.474 -0.87 . . . . 0.0 111.207 179.114 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 378' ' ' GLN . . . . . . . . . . . . . 98.1 mt-30 -69.75 -29.25 66.56 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.798 0.332 . . . . 0.0 110.56 179.155 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 379' ' ' PHE . . . . . 0.429 ' HB2' ' O ' ' B' ' 376' ' ' PHE . 10.2 m-85 -61.15 -40.35 93.51 Favored 'General case' 0 C--N 1.333 -0.123 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.639 179.541 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 380' ' ' LEU . . . . . . . . . . . . . 95.3 mt -58.19 136.26 84.65 Favored Pre-proline 0 C--N 1.33 -0.265 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.526 179.848 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 381' ' ' PRO . . . . . . . . . . . . . 51.5 Cg_exo -52.73 120.38 7.45 Favored 'Trans proline' 0 C--N 1.348 0.508 0 C-N-CA 122.377 2.051 . . . . 0.0 112.251 -179.574 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 382' ' ' ASP . . . . . 0.644 ' H ' ' HG3' ' A' ' 377' ' ' ARG . 15.4 t70 -88.75 121.68 31.38 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.279 -0.418 . . . . 0.0 110.971 179.966 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 383' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.094 0 CA-C-O 118.21 -0.9 . . . . 0.0 111.086 179.991 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 358' ' ' ASP . . . . . . . . . . . . . 4.2 p30 . . . . . 0 N--CA 1.486 1.366 0 CA-C-O 120.771 0.319 . . . . 0.0 110.884 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 359' ' ' PHE . . . . . . . . . . . . . 81.0 t80 -154.5 133.95 12.68 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.865 179.987 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 360' ' ' THR . . . . . . . . . . . . . 65.1 p -94.24 151.71 39.72 Favored Pre-proline 0 C--N 1.329 -0.293 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.962 179.79 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 361' ' ' PRO . . . . . . . . . . . . . 28.1 Cg_endo -62.16 -172.29 0.11 Allowed 'Trans proline' 0 C--N 1.349 0.562 0 C-N-CA 122.509 2.139 . . . . 0.0 112.418 -179.852 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 362' ' ' MET . . . . . 0.401 ' SD ' ' HB3' ' B' ' 329' ' ' LEU . 26.6 ttt -52.23 -62.77 1.43 Allowed 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.842 -179.814 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 363' ' ' ASP . . . . . . . . . . . . . 15.6 t70 -170.7 -72.08 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.59 179.915 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 364' ' ' SER . . . . . . . . . . . . . 67.4 m -160.58 9.62 0.09 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.765 179.973 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 365' ' ' SER . . . . . . . . . . . . . 48.1 t -101.72 -52.13 3.27 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.282 -179.622 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 366' ' ' ALA . . . . . . . . . . . . . . . -58.55 -45.15 89.54 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.871 0.367 . . . . 0.0 111.353 -179.818 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 367' ' ' VAL . . . . . . . . . . . . . 28.0 m -68.3 -29.51 44.54 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.354 -179.925 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 368' ' ' TYR . . . . . . . . . . . . . 71.3 t80 -72.1 -47.65 49.7 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.47 -0.332 . . . . 0.0 111.252 -179.749 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 369' ' ' VAL . . . . . 0.413 ' O ' ' HB2' ' A' ' 373' ' ' MET . 13.3 m -64.58 -48.37 85.13 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.487 -0.324 . . . . 0.0 111.273 -179.846 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 370' ' ' LEU . . . . . 0.583 HD23 ' HA ' ' B' ' 307' ' ' ALA . 8.3 mp -62.97 -42.92 99.97 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.645 -0.252 . . . . 0.0 111.362 179.997 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 371' ' ' SER . . . . . 0.424 ' O ' ' HB2' ' A' ' 375' ' ' ARG . 88.7 p -57.46 -60.3 3.86 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.481 -0.327 . . . . 0.0 110.942 179.957 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 372' ' ' SER . . . . . . . . . . . . . 44.1 t -62.96 -24.2 67.77 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.31 -0.405 . . . . 0.0 111.15 -179.783 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 373' ' ' MET . . . . . 0.413 ' HB2' ' O ' ' A' ' 369' ' ' VAL . 50.6 tpp -65.11 -49.16 71.06 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.797 0.332 . . . . 0.0 111.196 -179.939 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 374' ' ' ALA . . . . . . . . . . . . . . . -85.32 -17.37 37.03 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.818 -179.391 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 375' ' ' ARG . . . . . 0.424 ' HB2' ' O ' ' A' ' 371' ' ' SER . 0.0 OUTLIER -88.3 -22.21 24.01 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.712 0.291 . . . . 0.0 111.083 -179.68 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 376' ' ' GLN . . . . . . . . . . . . . 57.6 tp60 -59.94 -82.97 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.429 -0.35 . . . . 0.0 110.749 -179.937 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 377' ' ' ARG . . . . . 0.502 ' HG2' ' H ' ' B' ' 382' ' ' ASP . 94.1 mtt180 53.49 -168.24 0.06 Allowed 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.275 179.709 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 378' ' ' ARG . . . . . 0.509 ' HA ' ' HE ' ' A' ' 378' ' ' ARG . 2.9 mmp_? -119.47 6.36 11.1 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.739 179.87 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 379' ' ' ALA . . . . . . . . . . . . . . . -123.35 109.69 14.22 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.088 -0.506 . . . . 0.0 111.108 179.926 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 380' ' ' SER . . . . . . . . . . . . . 71.6 p . . . . . 0 C--O 1.248 1.015 0 CA-C-O 118.334 -0.841 . . . . 0.0 110.881 -179.993 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' B' B ' 295' ' ' SER . . . . . . . . . . . . . 80.6 p . . . . . 0 N--CA 1.486 1.339 0 CA-C-O 120.76 0.314 . . . . 0.0 110.824 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' B' B ' 296' ' ' LEU . . . . . 0.469 HD22 ' N ' ' B' ' 296' ' ' LEU . 3.2 mm? -62.27 145.3 54.07 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.772 -179.946 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 297' ' ' GLN . . . . . . . . . . . . . 57.3 tp60 -138.12 124.07 20.12 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.965 -179.842 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 298' ' ' ASN . . . . . . . . . . . . . 3.0 m-20 -101.5 129.37 47.56 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.823 179.945 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 299' ' ' ASN . . . . . . . . . . . . . 27.5 t-20 -137.76 -71.68 0.43 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.74 179.901 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 300' ' ' GLN . . . . . 0.604 ' HB3' ' HD3' ' B' ' 301' ' ' PRO . 29.9 tt0 -105.44 -50.2 0.11 Allowed Pre-proline 0 CA--C 1.535 0.37 0 CA-C-N 116.119 -0.492 . . . . 0.0 111.489 179.752 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 301' ' ' PRO . . . . . 0.604 ' HD3' ' HB3' ' B' ' 300' ' ' GLN . 7.1 Cg_exo -73.97 78.46 2.52 Favored 'Trans proline' 0 C--N 1.353 0.81 0 C-N-CA 122.41 2.074 . . . . 0.0 112.381 -179.969 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 302' ' ' VAL . . . . . 0.447 HG13 ' N ' ' B' ' 303' ' ' GLU . 7.7 p -92.41 -44.75 14.16 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.03 179.815 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 303' ' ' GLU . . . . . 0.447 ' N ' HG13 ' B' ' 302' ' ' VAL . 29.1 mt-10 -58.15 -33.83 69.63 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.888 -179.958 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 304' ' ' PHE . . . . . . . . . . . . . 76.5 t80 -58.05 -76.94 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.895 -0.593 . . . . 0.0 111.225 -179.612 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 305' ' ' ASN . . . . . . . . . . . . . 3.1 p-10 -49.36 -38.8 29.55 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.757 -179.507 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 306' ' ' HIS . . . . . . . . . . . . . 3.2 m80 -59.24 -74.63 0.07 Allowed 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 112.301 0.482 . . . . 0.0 112.301 -179.391 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 307' ' ' ALA . . . . . 0.583 ' HA ' HD23 ' A' ' 370' ' ' LEU . . . -56.48 -44.75 80.93 Favored 'General case' 0 C--N 1.33 -0.26 0 N-CA-C 112.455 0.539 . . . . 0.0 112.455 -178.542 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 308' ' ' ILE . . . . . . . . . . . . . 46.4 mm -58.11 -64.24 0.57 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 N-CA-C 111.737 0.273 . . . . 0.0 111.737 -179.51 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 309' ' ' ASN . . . . . . . . . . . . . 49.9 t30 -50.77 -37.29 41.32 Favored 'General case' 0 N--CA 1.463 0.196 0 CA-C-O 120.735 0.303 . . . . 0.0 110.972 -179.692 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 310' ' ' TYR . . . . . 0.532 ' O ' HG12 ' B' ' 314' ' ' ILE . 90.9 t80 -58.32 -65.92 0.57 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.731 179.705 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 311' ' ' VAL . . . . . . . . . . . . . 59.6 t -51.23 -29.39 8.57 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.378 -0.374 . . . . 0.0 111.163 -179.759 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 312' ' ' ASN . . . . . . . . . . . . . 27.0 t-20 -65.04 -57.09 9.56 Favored 'General case' 0 C--O 1.234 0.262 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.596 -179.832 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 313' ' ' LYS . . . . . 0.434 ' HG3' ' O ' ' B' ' 310' ' ' TYR . 0.1 OUTLIER -65.62 -28.95 69.49 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 120.587 0.232 . . . . 0.0 111.623 -179.371 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 314' ' ' ILE . . . . . 0.532 HG12 ' O ' ' B' ' 310' ' ' TYR . 20.3 mm -67.7 -44.98 85.57 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-O 120.879 0.371 . . . . 0.0 110.841 179.791 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 315' ' ' LYS . . . . . 0.434 ' HE3' ' HB3' ' B' ' 315' ' ' LYS . 1.2 tmmt? -67.34 -42.37 83.66 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.897 -179.988 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 316' ' ' ASN . . . . . . . . . . . . . 6.0 t30 -61.14 -54.39 45.1 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.398 -0.364 . . . . 0.0 111.326 -179.73 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 317' ' ' ARG . . . . . . . . . . . . . 27.9 mmm180 -59.68 -24.33 63.84 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.831 0.348 . . . . 0.0 111.123 -179.875 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 318' ' ' PHE . . . . . . . . . . . . . 34.9 m-85 -114.46 36.76 3.63 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.809 179.837 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 319' ' ' GLN . . . . . . . . . . . . . 32.1 tt0 -64.84 -18.15 64.89 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.903 -0.589 . . . . 0.0 110.893 -179.996 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 320' ' ' GLY . . . . . . . . . . . . . . . -115.64 27.03 8.6 Favored Glycine 0 N--CA 1.452 -0.269 0 C-N-CA 120.851 -0.69 . . . . 0.0 112.591 -179.956 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 321' ' ' GLN . . . . . 0.571 ' HA ' HE21 ' B' ' 321' ' ' GLN . 0.1 OUTLIER -148.74 89.32 5.03 Favored Pre-proline 0 C--N 1.329 -0.302 0 CA-C-O 120.517 0.199 . . . . 0.0 110.717 179.946 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 322' ' ' PRO . . . . . . . . . . . . . 87.8 Cg_endo -81.27 -22.04 6.09 Favored 'Trans proline' 0 C--N 1.347 0.459 0 C-N-CA 122.608 2.205 . . . . 0.0 112.827 -179.764 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 323' ' ' ASP . . . . . 0.4 ' OD2' HG13 ' B' ' 324' ' ' ILE . 6.4 p-10 -68.37 -53.92 20.75 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.495 -0.321 . . . . 0.0 111.219 -179.667 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 324' ' ' ILE . . . . . 0.419 HD12 ' HG2' ' B' ' 321' ' ' GLN . 56.1 mt -64.89 -44.41 96.22 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-O 120.786 0.326 . . . . 0.0 111.007 179.958 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 325' ' ' TYR . . . . . . . . . . . . . 37.3 t80 -58.72 -43.39 90.14 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.599 179.89 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 326' ' ' LYS . . . . . . . . . . . . . 63.3 tttm -62.85 -43.82 97.76 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.449 179.54 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 327' ' ' ALA . . . . . . . . . . . . . . . -55.9 -44.27 78.05 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.78 179.547 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 328' ' ' PHE . . . . . . . . . . . . . 71.5 t80 -60.67 -50.63 72.72 Favored 'General case' 0 C--O 1.233 0.223 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.484 179.732 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 329' ' ' LEU . . . . . 0.401 ' HB3' ' SD ' ' A' ' 362' ' ' MET . 95.6 mt -58.3 -28.85 65.38 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 115.816 -0.629 . . . . 0.0 110.863 179.662 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 330' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 -73.07 -41.23 64.33 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.894 179.845 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 331' ' ' ILE . . . . . 0.427 HG22 HG22 ' B' ' 358' ' ' VAL . 78.8 mt -62.01 -44.51 99.05 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.199 0 CA-C-O 120.852 0.358 . . . . 0.0 110.357 179.227 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 332' ' ' LEU . . . . . . . . . . . . . 9.6 mp -69.37 -34.98 75.36 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.619 179.603 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 333' ' ' HIS . . . . . . . . . . . . . 49.4 t-80 -62.59 -53.87 48.12 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.297 179.428 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 334' ' ' THR . . . . . . . . . . . . . 86.0 m -59.87 -38.94 83.59 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.306 179.303 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 335' ' ' TYR . . . . . . . . . . . . . 55.6 t80 -62.04 -37.83 86.42 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.211 179.396 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 336' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -64.85 -47.98 75.95 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 115.76 -0.654 . . . . 0.0 110.372 179.806 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 337' ' ' LYS . . . . . . . . . . . . . 39.5 ttpt -55.17 -48.11 74.22 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.66 179.575 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 338' ' ' GLU . . . . . 0.42 ' HB3' ' HB3' ' B' ' 351' ' ' PRO . 13.6 mm-40 -60.37 -40.36 90.55 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.71 179.685 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 339' ' ' GLN . . . . . . . . . . . . . 59.1 tp60 -58.27 -44.9 88.63 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.741 179.883 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 340' ' ' ARG . . . . . . . . . . . . . 59.1 mtp180 -62.02 -53.28 57.77 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.433 179.755 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 341' ' ' ASN . . . . . . . . . . . . . 86.6 m-20 -53.37 -31.87 46.67 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.846 -0.616 . . . . 0.0 110.577 179.341 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 342' ' ' ALA . . . . . . . . . . . . . . . -74.28 -43.15 58.06 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.97 -0.559 . . . . 0.0 111.13 179.932 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 343' ' ' LYS . . . . . . . . . . . . . 64.0 tttm -75.6 -11.8 60.09 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.709 -179.966 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 344' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -92.41 -40.48 10.85 Favored 'General case' 0 N--CA 1.453 -0.298 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.478 179.786 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 345' ' ' ALA . . . . . . . . . . . . . . . -61.41 -26.2 67.7 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.985 179.926 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 346' ' ' GLY . . . . . . . . . . . . . . . 76.76 33.46 46.67 Favored Glycine 0 N--CA 1.451 -0.326 0 C-N-CA 120.784 -0.722 . . . . 0.0 112.692 179.85 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 347' ' ' GLY . . . . . . . . . . . . . . . 99.75 176.7 30.96 Favored Glycine 0 N--CA 1.452 -0.262 0 C-N-CA 120.742 -0.742 . . . . 0.0 112.569 179.938 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 348' ' ' ASN . . . . . . . . . . . . . 66.1 t30 60.27 14.96 4.97 Favored 'General case' 0 C--N 1.333 -0.122 0 CA-C-O 120.979 0.419 . . . . 0.0 110.795 -179.979 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 349' ' ' TYR . . . . . . . . . . . . . 59.8 t80 -117.73 124.95 49.74 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.817 179.994 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 350' ' ' THR . . . . . . . . . . . . . 61.4 m -105.81 103.52 44.43 Favored Pre-proline 0 C--N 1.33 -0.264 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.009 179.95 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 351' ' ' PRO . . . . . 0.42 ' HB3' ' HB3' ' B' ' 338' ' ' GLU . 47.0 Cg_exo -56.61 166.79 3.32 Favored 'Trans proline' 0 C--N 1.349 0.562 0 C-N-CA 122.5 2.133 . . . . 0.0 112.43 179.902 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 352' ' ' ALA . . . . . . . . . . . . . . . -83.08 -63.15 1.42 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.041 179.868 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 353' ' ' LEU . . . . . 0.416 ' HG ' ' HG2' ' B' ' 357' ' ' GLU . 6.3 mp -88.12 116.51 26.36 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.137 -179.99 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 354' ' ' THR . . . . . . . . . . . . . 61.3 p -111.25 -166.06 1.04 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.269 179.397 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 355' ' ' GLU . . . . . . . . . . . . . 8.1 pt-20 -56.8 -42.29 79.27 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.912 0.387 . . . . 0.0 110.638 179.616 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 356' ' ' GLN . . . . . . . . . . . . . 15.0 mm100 -68.07 -42.6 80.2 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.875 -0.602 . . . . 0.0 111.42 -179.888 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 357' ' ' GLU . . . . . 0.416 ' HG2' ' HG ' ' B' ' 353' ' ' LEU . 5.0 tp10 -60.31 -51.45 69.49 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.515 -0.311 . . . . 0.0 111.082 -179.584 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 358' ' ' VAL . . . . . 0.433 ' O ' HG23 ' B' ' 362' ' ' VAL . 4.4 t -60.41 -59.84 3.5 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.352 -0.386 . . . . 0.0 111.24 179.941 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 359' ' ' TYR . . . . . . . . . . . . . 4.4 t80 -51.97 -31.65 30.09 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.616 -0.266 . . . . 0.0 111.05 -179.285 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 360' ' ' ALA . . . . . . . . . . . . . . . -67.99 -59.71 3.06 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.527 -0.306 . . . . 0.0 110.954 179.659 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 361' ' ' GLN . . . . . . . . . . . . . 14.7 mm100 -53.43 -40.49 65.2 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.264 -0.426 . . . . 0.0 110.722 179.7 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 362' ' ' VAL . . . . . 0.433 HG23 ' O ' ' B' ' 358' ' ' VAL . 60.2 t -68.81 -37.03 76.88 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.366 179.502 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 363' ' ' ALA . . . . . 0.55 ' HA ' HD11 ' B' ' 373' ' ' LEU . . . -60.54 -35.72 76.69 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 121.042 0.449 . . . . 0.0 110.003 179.136 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 364' ' ' ARG . . . . . . . . . . . . . 77.3 ttt180 -86.16 -20.02 29.24 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.673 -0.694 . . . . 0.0 109.799 179.048 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 365' ' ' LEU . . . . . . . . . . . . . 24.8 tp -65.6 -42.33 91.75 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 115.594 -0.73 . . . . 0.0 110.393 179.497 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 366' ' ' PHE . . . . . . . . . . . . . 25.4 m-85 -112.83 144.5 42.27 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.289 179.358 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 367' ' ' LYS . . . . . . . . . . . . . 37.4 mtmm -120.76 -79.73 0.61 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.691 0.281 . . . . 0.0 111.358 -179.754 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 368' ' ' ASN . . . . . . . . . . . . . 33.6 m-80 -70.99 -14.83 62.49 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.341 -0.39 . . . . 0.0 110.938 -179.842 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 369' ' ' GLN . . . . . . . . . . . . . 91.5 mt-30 -107.7 94.03 4.86 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.0 179.932 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 370' ' ' GLU . . . . . . . . . . . . . 45.1 mt-10 -93.56 -5.06 49.79 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.996 -179.982 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 371' ' ' ASP . . . . . . . . . . . . . 8.9 m-20 -47.29 -63.78 0.95 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.322 -179.856 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 372' ' ' LEU . . . . . 0.734 HD22 ' H ' ' B' ' 372' ' ' LEU . 0.0 OUTLIER -58.6 -33.34 69.88 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.37 -0.377 . . . . 0.0 111.172 -179.906 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 373' ' ' LEU . . . . . 0.55 HD11 ' HA ' ' B' ' 363' ' ' ALA . 5.4 tp -58.54 -52.93 63.59 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.112 -0.494 . . . . 0.0 111.236 -179.399 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 374' ' ' SER . . . . . . . . . . . . . 46.7 t -64.95 -46.21 82.54 Favored 'General case' 0 C--O 1.233 0.23 0 CA-C-O 120.942 0.401 . . . . 0.0 110.536 179.788 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 375' ' ' GLU . . . . . . . . . . . . . 10.5 tp10 -54.36 -35.11 62.43 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.792 -0.64 . . . . 0.0 110.441 179.647 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 376' ' ' PHE . . . . . . . . . . . . . 85.9 t80 -78.31 -32.77 49.46 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.089 179.49 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 377' ' ' GLY . . . . . . . . . . . . . . . -60.99 -36.0 91.57 Favored Glycine 0 N--CA 1.449 -0.481 0 C-N-CA 120.805 -0.712 . . . . 0.0 111.977 179.581 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 378' ' ' GLN . . . . . . . . . . . . . 88.5 mt-30 -55.49 -28.33 53.96 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-O 120.826 0.346 . . . . 0.0 110.67 179.497 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 379' ' ' PHE . . . . . 0.405 ' HB3' ' H ' ' B' ' 380' ' ' LEU . 67.0 m-85 -72.69 -146.2 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.399 179.39 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 380' ' ' LEU . . . . . 0.405 ' H ' ' HB3' ' B' ' 379' ' ' PHE . 40.4 mt 67.13 143.18 0.08 OUTLIER Pre-proline 0 N--CA 1.462 0.173 0 CA-C-N 116.492 -0.322 . . . . 0.0 110.871 -179.874 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 381' ' ' PRO . . . . . . . . . . . . . 52.2 Cg_exo -53.08 116.78 3.16 Favored 'Trans proline' 0 C--N 1.347 0.456 0 C-N-CA 122.563 2.176 . . . . 0.0 112.398 -179.988 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 382' ' ' ASP . . . . . 0.502 ' H ' ' HG2' ' A' ' 377' ' ' ARG . 15.4 t70 -64.38 138.96 58.7 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.993 -179.973 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 383' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.083 0 CA-C-O 118.352 -0.833 . . . . 0.0 111.098 179.949 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 358' ' ' ASP . . . . . . . . . . . . . 4.2 p30 . . . . . 0 N--CA 1.486 1.329 0 CA-C-O 120.795 0.331 . . . . 0.0 110.866 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 359' ' ' PHE . . . . . . . . . . . . . 43.7 p90 -141.56 139.66 33.22 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.862 179.978 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 360' ' ' THR . . . . . . . . . . . . . 28.7 m -91.54 128.97 44.49 Favored Pre-proline 0 C--N 1.328 -0.341 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.051 -179.87 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 361' ' ' PRO . . . . . . . . . . . . . 43.4 Cg_exo -57.36 -58.86 0.72 Allowed 'Trans proline' 0 C--N 1.349 0.588 0 C-N-CA 122.494 2.13 . . . . 0.0 112.59 -179.978 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 362' ' ' MET . . . . . 0.57 ' HB2' HD12 ' B' ' 329' ' ' LEU . 27.0 ttt -117.76 -71.38 0.74 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.009 -179.771 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 363' ' ' ASP . . . . . . . . . . . . . 24.9 t70 -168.83 -35.85 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.886 -0.597 . . . . 0.0 110.544 -179.936 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 364' ' ' SER . . . . . . . . . . . . . 44.3 t -115.76 -71.26 0.75 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.934 -0.575 . . . . 0.0 110.675 179.704 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 365' ' ' SER . . . . . . . . . . . . . 47.7 t -169.57 82.69 0.12 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.048 -0.524 . . . . 0.0 111.128 179.925 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 366' ' ' ALA . . . . . . . . . . . . . . . -78.33 -22.48 48.0 Favored 'General case' 0 C--O 1.237 0.418 0 CA-C-O 121.229 0.538 . . . . 0.0 110.333 179.429 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 367' ' ' VAL . . . . . . . . . . . . . 32.7 m -59.66 -29.05 41.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 115.441 -0.799 . . . . 0.0 110.52 179.533 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 368' ' ' TYR . . . . . . . . . . . . . 91.6 t80 -62.43 -42.27 99.33 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.35 179.452 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 369' ' ' VAL . . . . . . . . . . . . . 18.6 t -68.29 -52.76 34.25 Favored 'Isoleucine or valine' 0 C--O 1.234 0.285 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.635 179.641 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 370' ' ' LEU . . . . . . . . . . . . . 97.0 mt -57.16 -36.07 70.31 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.995 179.923 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 371' ' ' SER . . . . . . . . . . . . . 67.7 m -69.49 -41.69 75.8 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.587 179.773 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 372' ' ' SER . . . . . . . . . . . . . 64.4 m -61.31 -35.14 76.54 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.642 179.746 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 373' ' ' MET . . . . . . . . . . . . . 65.4 mtt -70.44 -48.54 55.5 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.313 179.728 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 374' ' ' ALA . . . . . . . . . . . . . . . -72.92 -19.2 61.31 Favored 'General case' 0 C--N 1.331 -0.239 0 N-CA-C 112.054 0.39 . . . . 0.0 112.054 -179.283 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 375' ' ' ARG . . . . . . . . . . . . . 28.9 mmt180 -90.84 -32.67 15.97 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 111.582 0.216 . . . . 0.0 111.582 -179.584 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 376' ' ' GLN . . . . . 0.534 ' HG3' ' H ' ' A' ' 378' ' ' ARG . 6.3 tp-100 -61.04 -87.32 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.677 0.275 . . . . 0.0 110.814 -179.996 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 377' ' ' ARG . . . . . . . . . . . . . 75.5 mtp180 57.46 13.28 1.76 Allowed 'General case' 0 N--CA 1.462 0.131 0 CA-C-N 116.4 -0.364 . . . . 0.0 111.48 179.682 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 378' ' ' ARG . . . . . 0.534 ' H ' ' HG3' ' A' ' 376' ' ' GLN . 37.2 mmt180 -103.12 141.84 35.15 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.422 -0.354 . . . . 0.0 110.927 179.985 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 379' ' ' ALA . . . . . . . . . . . . . . . -96.94 -66.69 0.89 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.078 179.944 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 380' ' ' SER . . . . . . . . . . . . . 49.3 m . . . . . 0 C--O 1.249 1.068 0 CA-C-O 118.286 -0.864 . . . . 0.0 110.898 179.97 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' B' B ' 295' ' ' SER . . . . . . . . . . . . . 52.8 m . . . . . 0 N--CA 1.485 1.324 0 CA-C-O 120.753 0.311 . . . . 0.0 110.888 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' B' B ' 296' ' ' LEU . . . . . 0.494 ' N ' HD22 ' B' ' 296' ' ' LEU . 2.9 mm? -77.36 -23.59 50.8 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.662 179.717 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 297' ' ' GLN . . . . . . . . . . . . . 77.7 mt-30 -87.37 161.67 17.77 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.751 179.86 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 298' ' ' ASN . . . . . . . . . . . . . 24.4 p-10 -127.89 164.29 22.58 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.244 -0.434 . . . . 0.0 111.035 -179.949 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 299' ' ' ASN . . . . . . . . . . . . . 19.0 m120 -147.08 154.14 40.81 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.72 179.838 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 300' ' ' GLN . . . . . . . . . . . . . 77.3 mt-30 -113.81 151.48 44.74 Favored Pre-proline 0 C--N 1.331 -0.228 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.853 179.978 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 301' ' ' PRO . . . . . . . . . . . . . 57.9 Cg_endo -71.26 135.18 26.37 Favored 'Trans proline' 0 C--N 1.347 0.477 0 C-N-CA 122.44 2.093 . . . . 0.0 112.277 179.933 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 302' ' ' VAL . . . . . . . . . . . . . 35.9 m -72.44 -12.47 15.79 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.093 -179.942 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 303' ' ' GLU . . . . . . . . . . . . . 46.5 mt-10 -58.04 -83.25 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.0 -0.545 . . . . 0.0 111.422 -179.724 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 304' ' ' PHE . . . . . . . . . . . . . 99.6 m-85 -59.97 -30.46 69.13 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.339 -179.583 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 305' ' ' ASN . . . . . . . . . . . . . 27.3 t-20 -58.21 -69.69 0.17 Allowed 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.402 -0.363 . . . . 0.0 111.45 -179.599 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 306' ' ' HIS . . . . . . . . . . . . . 20.5 m-70 -62.57 -47.16 85.04 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.123 -0.489 . . . . 0.0 112.147 -179.152 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 307' ' ' ALA . . . . . . . . . . . . . . . -56.61 -62.45 1.72 Allowed 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 112.361 0.504 . . . . 0.0 112.361 -178.921 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 308' ' ' ILE . . . . . . . . . . . . . 85.1 mt -56.56 -49.41 77.75 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.247 0 N-CA-C 111.644 0.239 . . . . 0.0 111.644 -179.335 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 309' ' ' ASN . . . . . . . . . . . . . 36.7 t30 -54.21 -42.73 70.12 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.885 0.374 . . . . 0.0 111.011 -179.82 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 310' ' ' TYR . . . . . 0.483 ' O ' HG12 ' B' ' 314' ' ' ILE . 84.5 t80 -61.94 -62.78 1.54 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.949 -179.808 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 311' ' ' VAL . . . . . . . . . . . . . 43.6 t -54.24 -25.61 13.81 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-O 120.859 0.361 . . . . 0.0 110.978 -179.833 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 312' ' ' ASN . . . . . . . . . . . . . 52.9 t30 -67.9 -56.71 8.03 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.026 -179.924 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 313' ' ' LYS . . . . . 0.449 ' HD3' ' N ' ' B' ' 314' ' ' ILE . 0.1 OUTLIER -65.32 -30.53 71.38 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.519 -0.309 . . . . 0.0 111.514 -179.592 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 314' ' ' ILE . . . . . 0.483 HG12 ' O ' ' B' ' 310' ' ' TYR . 25.9 mm -70.06 -40.55 78.55 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.197 0 CA-C-O 120.945 0.402 . . . . 0.0 110.744 179.578 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 315' ' ' LYS . . . . . . . . . . . . . 4.3 ttmp? -66.92 -42.42 85.4 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.936 -0.574 . . . . 0.0 110.911 -179.899 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 316' ' ' ASN . . . . . . . . . . . . . 27.6 t-20 -64.19 -52.61 58.05 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.333 -179.713 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 317' ' ' ARG . . . . . 0.441 ' HA ' ' NE ' ' B' ' 317' ' ' ARG . 4.7 mmp_? -59.38 -60.75 3.36 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.904 0.383 . . . . 0.0 111.197 -179.873 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 318' ' ' PHE . . . . . . . . . . . . . 65.4 m-85 -85.23 38.14 0.71 Allowed 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.093 -0.503 . . . . 0.0 111.379 -179.559 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 319' ' ' GLN . . . . . . . . . . . . . 22.6 tt0 -65.28 -26.17 67.96 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.706 179.863 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 320' ' ' GLY . . . . . . . . . . . . . . . -96.9 -5.43 58.49 Favored Glycine 0 N--CA 1.451 -0.301 0 C-N-CA 120.804 -0.712 . . . . 0.0 112.624 -179.845 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 321' ' ' GLN . . . . . . . . . . . . . 14.8 mm100 -108.33 94.04 12.65 Favored Pre-proline 0 C--N 1.329 -0.298 0 CA-C-O 120.45 0.167 . . . . 0.0 110.945 -179.962 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 322' ' ' PRO . . . . . . . . . . . . . 97.1 Cg_endo -79.69 -33.78 1.16 Allowed 'Trans proline' 0 C--N 1.348 0.531 0 C-N-CA 122.459 2.106 . . . . 0.0 112.458 -179.911 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 323' ' ' ASP . . . . . . . . . . . . . 20.8 m-20 -63.86 -51.7 63.44 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.146 -179.682 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 324' ' ' ILE . . . . . . . . . . . . . 57.1 mt -65.12 -46.24 91.73 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.424 -179.696 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 325' ' ' TYR . . . . . 0.422 ' O ' HD23 ' B' ' 329' ' ' LEU . 35.0 t80 -57.57 -58.43 8.34 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.996 -179.624 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 326' ' ' LYS . . . . . . . . . . . . . 14.2 mptt -54.03 -44.73 71.23 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.017 179.916 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 327' ' ' ALA . . . . . . . . . . . . . . . -53.59 -45.64 70.09 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 121.055 0.455 . . . . 0.0 110.916 179.802 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 328' ' ' PHE . . . . . . . . . . . . . 54.9 t80 -60.54 -54.92 39.7 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.857 -0.611 . . . . 0.0 110.822 179.961 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 329' ' ' LEU . . . . . 0.57 HD12 ' HB2' ' A' ' 362' ' ' MET . 4.0 mm? -59.76 -25.63 65.03 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.652 179.815 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 330' ' ' GLU . . . . . . . . . . . . . 10.2 mm-40 -69.76 -41.97 74.48 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.39 -0.368 . . . . 0.0 110.037 179.107 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 331' ' ' ILE . . . . . . . . . . . . . 84.8 mt -63.88 -42.41 95.71 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.038 178.814 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 332' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -64.48 -44.42 91.09 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.655 -0.702 . . . . 0.0 110.671 179.532 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 333' ' ' HIS . . . . . . . . . . . . . 54.1 t-80 -61.95 -56.27 20.9 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.777 -179.99 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 334' ' ' THR . . . . . 0.415 HG22 HD13 ' B' ' 353' ' ' LEU . 70.9 m -54.16 -37.51 64.52 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.338 179.486 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 335' ' ' TYR . . . . . . . . . . . . . 60.7 t80 -63.27 -38.56 91.66 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.069 179.299 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 336' ' ' GLN . . . . . . . . . . . . . 23.8 tt0 -64.68 -43.83 92.27 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.729 179.454 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 337' ' ' LYS . . . . . . . . . . . . . 26.9 ttpp -59.16 -52.24 66.57 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.821 -179.849 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 338' ' ' GLU . . . . . . . . . . . . . 35.5 mm-40 -58.29 -42.84 87.48 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.797 179.706 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 339' ' ' GLN . . . . . . . . . . . . . 8.7 tt0 -59.36 -41.1 88.46 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.755 -179.963 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 340' ' ' ARG . . . . . . . . . . . . . 99.1 mtt180 -62.41 -52.03 65.2 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.753 179.772 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 341' ' ' ASN . . . . . . . . . . . . . 43.5 m-80 -60.96 -27.2 68.09 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.872 179.881 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 342' ' ' ALA . . . . . . . . . . . . . . . -73.8 -42.22 61.26 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.21 179.973 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 343' ' ' LYS . . . . . . . . . . . . . 98.6 mttt -76.61 -24.66 53.41 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.99 -179.95 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 344' ' ' GLU . . . . . . . . . . . . . 15.6 mm-40 -82.43 -34.01 28.35 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.264 -0.426 . . . . 0.0 110.861 179.814 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 345' ' ' ALA . . . . . . . . . . . . . . . -64.56 -30.37 71.4 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.066 179.911 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 346' ' ' GLY . . . . . . . . . . . . . . . 85.88 -40.48 3.04 Favored Glycine 0 N--CA 1.452 -0.249 0 C-N-CA 120.743 -0.741 . . . . 0.0 112.576 -179.977 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 347' ' ' GLY . . . . . . . . . . . . . . . -178.53 178.12 48.59 Favored Glycine 0 N--CA 1.452 -0.276 0 C-N-CA 120.804 -0.712 . . . . 0.0 112.514 -179.987 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 348' ' ' ASN . . . . . . . . . . . . . 64.7 t30 59.31 17.61 5.97 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.909 0.385 . . . . 0.0 111.008 179.93 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 349' ' ' TYR . . . . . . . . . . . . . 56.0 t80 -107.86 141.59 39.21 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.768 179.984 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 350' ' ' THR . . . . . . . . . . . . . 39.1 m -119.73 96.8 49.74 Favored Pre-proline 0 C--N 1.329 -0.306 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.981 179.891 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 351' ' ' PRO . . . . . . . . . . . . . 51.8 Cg_exo -52.56 131.33 40.56 Favored 'Trans proline' 0 C--N 1.348 0.543 0 C-N-CA 122.451 2.101 . . . . 0.0 112.288 179.97 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 352' ' ' ALA . . . . . . . . . . . . . . . -62.75 -57.27 11.52 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.066 -0.516 . . . . 0.0 111.401 -179.739 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 353' ' ' LEU . . . . . 0.46 ' HG ' ' HG2' ' B' ' 357' ' ' GLU . 5.9 mp -101.33 121.97 42.86 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 120.924 0.392 . . . . 0.0 111.375 -179.846 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 354' ' ' THR . . . . . . . . . . . . . 79.9 p -112.35 -170.76 1.72 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.389 179.158 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 355' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -57.57 -37.45 73.17 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.997 0.427 . . . . 0.0 110.28 179.654 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 356' ' ' GLN . . . . . . . . . . . . . 93.5 mt-30 -71.21 -40.71 70.96 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.807 -0.633 . . . . 0.0 111.029 -179.857 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 357' ' ' GLU . . . . . 0.46 ' HG2' ' HG ' ' B' ' 353' ' ' LEU . 6.6 tp10 -59.34 -52.74 64.32 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 116.345 -0.389 . . . . 0.0 110.908 -179.62 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 358' ' ' VAL . . . . . 0.51 ' O ' HG23 ' B' ' 362' ' ' VAL . 76.3 t -61.51 -54.66 31.87 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.942 179.842 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 359' ' ' TYR . . . . . . . . . . . . . 38.4 t80 -54.57 -28.66 47.59 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.689 0.281 . . . . 0.0 111.196 -179.444 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 360' ' ' ALA . . . . . . . . . . . . . . . -72.09 -60.66 2.12 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.867 0.365 . . . . 0.0 110.981 179.768 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 361' ' ' GLN . . . . . . . . . . . . . 24.2 mm-40 -55.0 -40.33 69.99 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.593 179.788 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 362' ' ' VAL . . . . . 0.51 HG23 ' O ' ' B' ' 358' ' ' VAL . 90.5 t -66.25 -39.87 85.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.304 179.338 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 363' ' ' ALA . . . . . 0.561 ' HA ' HD21 ' B' ' 373' ' ' LEU . . . -58.98 -36.93 75.7 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.139 179.227 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 364' ' ' ARG . . . . . . . . . . . . . 98.2 mtt180 -80.74 -25.29 38.13 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.729 -0.669 . . . . 0.0 110.41 179.387 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 365' ' ' LEU . . . . . . . . . . . . . 14.6 tp -61.14 -29.67 69.93 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.456 179.843 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 366' ' ' PHE . . . . . . . . . . . . . 43.9 m-85 -120.09 -170.2 1.92 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.855 -0.611 . . . . 0.0 110.164 179.545 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 367' ' ' LYS . . . . . . . . . . . . . 61.0 tttp -158.32 -84.24 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.663 0.268 . . . . 0.0 111.38 179.944 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 368' ' ' ASN . . . . . . . . . . . . . 80.6 m-20 -70.0 -7.87 44.41 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.378 -0.373 . . . . 0.0 110.948 -179.83 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 369' ' ' GLN . . . . . . . . . . . . . 15.9 mp0 -110.57 86.83 2.39 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.888 179.999 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 370' ' ' GLU . . . . . . . . . . . . . 42.8 mt-10 -91.36 -12.55 34.57 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.396 -0.365 . . . . 0.0 110.553 179.837 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 371' ' ' ASP . . . . . . . . . . . . . 19.2 t70 -55.1 -34.11 63.4 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 116.158 -0.473 . . . . 0.0 110.155 179.476 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 372' ' ' LEU . . . . . 0.465 ' N ' HD12 ' B' ' 372' ' ' LEU . 6.0 mp -69.97 -38.16 76.0 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.662 -0.699 . . . . 0.0 110.211 179.15 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 373' ' ' LEU . . . . . 0.561 HD21 ' HA ' ' B' ' 363' ' ' ALA . 1.7 mp -63.26 -37.31 86.75 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.733 -0.667 . . . . 0.0 110.783 179.793 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 374' ' ' SER . . . . . . . . . . . . . 61.6 m -72.67 -57.14 4.35 Favored 'General case' 0 C--O 1.235 0.339 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.462 179.532 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 375' ' ' GLU . . . . . . . . . . . . . 17.2 mm-40 -52.56 -40.58 62.72 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.565 179.503 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 376' ' ' PHE . . . . . . . . . . . . . 81.5 t80 -72.8 -34.47 66.92 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.13 -0.487 . . . . 0.0 109.99 179.442 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 377' ' ' GLY . . . . . . . . . . . . . . . -58.97 -32.74 71.36 Favored Glycine 0 N--CA 1.449 -0.485 0 C-N-CA 120.583 -0.818 . . . . 0.0 111.373 179.091 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 378' ' ' GLN . . . . . . . . . . . . . 86.6 mm-40 -56.98 -36.31 70.18 Favored 'General case' 0 C--N 1.333 -0.142 0 CA-C-O 120.929 0.395 . . . . 0.0 110.09 178.829 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 379' ' ' PHE . . . . . . . . . . . . . 70.3 m-85 -68.14 -42.06 80.68 Favored 'General case' 0 C--N 1.333 -0.144 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.243 179.339 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 380' ' ' LEU . . . . . 0.414 HD12 ' HA ' ' B' ' 380' ' ' LEU . 5.8 tp -51.38 121.27 16.62 Favored Pre-proline 0 C--N 1.329 -0.306 0 CA-C-N 115.554 -0.748 . . . . 0.0 110.667 -179.829 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 381' ' ' PRO . . . . . . . . . . . . . 84.9 Cg_exo -46.4 122.14 5.35 Favored 'Trans proline' 0 C--N 1.351 0.677 0 C-N-CA 122.413 2.075 . . . . 0.0 112.462 -179.984 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 382' ' ' ASP . . . . . . . . . . . . . 28.9 t70 -61.26 132.28 53.11 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.92 -179.872 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 383' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.045 0 CA-C-O 118.203 -0.904 . . . . 0.0 111.079 -179.972 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 358' ' ' ASP . . . . . . . . . . . . . 17.3 m-20 . . . . . 0 N--CA 1.485 1.318 0 CA-C-O 120.815 0.34 . . . . 0.0 110.845 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 359' ' ' PHE . . . . . . . . . . . . . 77.7 t80 -142.13 141.93 32.71 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.189 -0.46 . . . . 0.0 111.055 -179.98 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 360' ' ' THR . . . . . 0.679 HG22 ' HB ' ' B' ' 308' ' ' ILE . 0.1 OUTLIER -159.57 -51.82 0.01 OUTLIER Pre-proline 0 CA--C 1.534 0.351 0 CA-C-N 115.999 -0.546 . . . . 0.0 111.559 179.643 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 361' ' ' PRO . . . . . 0.567 ' HD2' ' H ' ' A' ' 360' ' ' THR . 53.7 Cg_endo -88.55 176.48 3.49 Favored 'Trans proline' 0 C--N 1.354 0.844 0 C-N-CA 122.411 2.074 . . . . 0.0 112.087 179.431 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 362' ' ' MET . . . . . 0.439 ' SD ' ' HB3' ' B' ' 329' ' ' LEU . 5.7 ttt -101.26 -71.36 0.71 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.086 0.47 . . . . 0.0 110.655 179.361 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 363' ' ' ASP . . . . . . . . . . . . . 14.5 t70 -170.92 -32.28 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.621 -0.718 . . . . 0.0 110.122 -179.719 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 364' ' ' SER . . . . . . . . . . . . . 78.7 p -115.62 19.19 15.48 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.703 -0.681 . . . . 0.0 110.171 179.434 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 365' ' ' SER . . . . . . . . . . . . . 46.3 t 65.36 80.0 0.24 Allowed 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.632 -0.713 . . . . 0.0 111.283 -179.883 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 366' ' ' ALA . . . . . . . . . . . . . . . -77.99 -20.74 52.02 Favored 'General case' 0 C--O 1.234 0.253 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.643 179.67 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 367' ' ' VAL . . . . . . . . . . . . . 21.4 t -53.28 -32.65 19.74 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 115.892 -0.595 . . . . 0.0 110.986 179.969 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 368' ' ' TYR . . . . . . . . . . . . . 66.3 t80 -68.02 -36.78 80.52 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.675 179.785 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 369' ' ' VAL . . . . . 0.406 HG22 ' HB2' ' B' ' 336' ' ' GLN . 6.0 t -67.26 -52.97 36.99 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.238 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.728 179.85 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 370' ' ' LEU . . . . . 0.412 HD22 ' N ' ' A' ' 370' ' ' LEU . 3.4 mm? -62.32 -32.36 73.1 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.766 179.801 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 371' ' ' SER . . . . . . . . . . . . . 27.2 t -64.12 -58.34 6.94 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.045 179.878 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 372' ' ' SER . . . . . . . . . . . . . 41.7 t -59.68 -32.5 70.54 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.09 -179.86 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 373' ' ' MET . . . . . . . . . . . . . 55.6 ttm -63.99 -47.24 81.09 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.402 -0.363 . . . . 0.0 111.174 179.935 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 374' ' ' ALA . . . . . . . . . . . . . . . -83.17 -13.79 54.77 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.363 -0.38 . . . . 0.0 111.686 -179.715 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 375' ' ' ARG . . . . . 0.533 ' HG2' ' HG2' ' B' ' 303' ' ' GLU . 7.0 mmt180 -86.07 -30.73 22.38 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.487 -0.324 . . . . 0.0 111.25 -179.844 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 376' ' ' GLN . . . . . 0.47 ' HB3' ' HG3' ' B' ' 381' ' ' PRO . 52.6 tt0 -54.16 -82.33 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.255 -0.429 . . . . 0.0 111.179 -179.617 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 377' ' ' ARG . . . . . . . . . . . . . 67.0 mtm180 55.47 -167.28 0.1 Allowed 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.803 0.335 . . . . 0.0 110.985 -179.965 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 378' ' ' ARG . . . . . . . . . . . . . 35.5 mmt180 -115.82 9.64 15.13 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.31 -0.405 . . . . 0.0 111.016 179.82 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 379' ' ' ALA . . . . . . . . . . . . . . . -65.61 -37.06 85.53 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.955 179.845 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 380' ' ' SER . . . . . . . . . . . . . 49.3 m . . . . . 0 C--O 1.25 1.115 0 CA-C-O 118.152 -0.928 . . . . 0.0 111.046 179.811 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' B' B ' 295' ' ' SER . . . . . . . . . . . . . 76.3 p . . . . . 0 N--CA 1.485 1.313 0 CA-C-O 120.821 0.343 . . . . 0.0 111.039 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' B' B ' 296' ' ' LEU . . . . . 0.48 HD22 ' N ' ' B' ' 296' ' ' LEU . 2.8 mm? -111.41 145.99 37.96 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.733 179.864 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 297' ' ' GLN . . . . . . . . . . . . . 20.3 mp0 -104.93 136.47 44.35 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.808 179.888 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 298' ' ' ASN . . . . . . . . . . . . . 26.8 t-20 -114.3 -50.78 2.79 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.788 179.932 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 299' ' ' ASN . . . . . . . . . . . . . 8.8 p30 -82.69 138.78 34.0 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.665 179.864 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 300' ' ' GLN . . . . . . . . . . . . . 12.8 pt20 -96.53 146.68 31.73 Favored Pre-proline 0 C--N 1.329 -0.285 0 CA-C-N 116.268 -0.424 . . . . 0.0 111.012 -179.875 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 301' ' ' PRO . . . . . . . . . . . . . 25.2 Cg_exo -63.01 131.3 32.12 Favored 'Trans proline' 0 C--N 1.348 0.506 0 C-N-CA 122.527 2.151 . . . . 0.0 112.298 179.807 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 302' ' ' VAL . . . . . . . . . . . . . 15.0 p -92.22 -29.58 4.59 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.23 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.805 179.766 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 303' ' ' GLU . . . . . 0.533 ' HG2' ' HG2' ' A' ' 375' ' ' ARG . 35.5 mt-10 -51.64 -80.75 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.77 -0.65 . . . . 0.0 111.879 -179.34 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 304' ' ' PHE . . . . . 0.492 ' O ' HG12 ' B' ' 308' ' ' ILE . 81.0 m-85 -54.79 -55.0 34.78 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.918 -0.583 . . . . 0.0 112.043 -179.023 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 305' ' ' ASN . . . . . . . . . . . . . 46.6 t30 -47.58 -68.89 0.15 Allowed 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 112.87 0.693 . . . . 0.0 112.87 -178.668 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 306' ' ' HIS . . . . . . . . . . . . . 2.5 t-160 -54.98 -46.33 75.1 Favored 'General case' 0 C--N 1.33 -0.266 0 N-CA-C 112.417 0.525 . . . . 0.0 112.417 -178.244 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 307' ' ' ALA . . . . . . . . . . . . . . . -58.6 -62.19 2.04 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 112.37 0.507 . . . . 0.0 112.37 -178.89 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 308' ' ' ILE . . . . . 0.679 ' HB ' HG22 ' A' ' 360' ' ' THR . 30.9 pt -54.68 -37.74 40.72 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.208 0 N-CA-C 111.825 0.306 . . . . 0.0 111.825 -179.173 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 309' ' ' ASN . . . . . 0.433 ' N ' HG13 ' B' ' 308' ' ' ILE . 5.3 m-20 -61.58 -45.27 94.85 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.896 0.379 . . . . 0.0 110.804 179.987 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 310' ' ' TYR . . . . . 0.509 ' O ' HG12 ' B' ' 314' ' ' ILE . 81.4 t80 -61.54 -60.13 4.16 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.847 179.869 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 311' ' ' VAL . . . . . . . . . . . . . 47.5 t -54.13 -31.26 21.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-O 120.896 0.379 . . . . 0.0 111.178 -179.572 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 312' ' ' ASN . . . . . . . . . . . . . 55.6 t30 -65.11 -56.52 12.48 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.361 -179.668 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 313' ' ' LYS . . . . . 0.516 ' NZ ' ' HB2' ' B' ' 313' ' ' LYS . 0.0 OUTLIER -65.31 -23.52 67.04 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 116.493 -0.321 . . . . 0.0 111.595 -179.555 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 314' ' ' ILE . . . . . 0.509 HG12 ' O ' ' B' ' 310' ' ' TYR . 24.6 mm -76.68 -36.61 27.45 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-O 120.814 0.34 . . . . 0.0 111.087 179.723 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 315' ' ' LYS . . . . . . . . . . . . . 1.2 tmmt? -75.84 -35.94 59.8 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.404 -0.362 . . . . 0.0 110.858 -179.982 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 316' ' ' ASN . . . . . . . . . . . . . 27.0 t-20 -74.4 -46.0 43.11 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.045 -0.525 . . . . 0.0 111.525 -179.47 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 317' ' ' ARG . . . . . . . . . . . . . 19.1 tpt180 -68.61 -25.55 64.91 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.448 -0.342 . . . . 0.0 111.177 -179.644 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 318' ' ' PHE . . . . . . . . . . . . . 95.7 m-85 -117.31 37.51 3.85 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.172 -179.837 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 319' ' ' GLN . . . . . . . . . . . . . 20.1 pt20 -63.4 -15.15 56.7 Favored 'General case' 0 N--CA 1.447 -0.586 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.925 179.591 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 320' ' ' GLY . . . . . . . . . . . . . . . -104.98 -7.22 38.79 Favored Glycine 0 C--N 1.331 0.284 0 C-N-CA 120.837 -0.697 . . . . 0.0 112.697 -179.85 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 321' ' ' GLN . . . . . . . . . . . . . 23.5 mp0 -113.05 88.32 11.92 Favored Pre-proline 0 C--N 1.33 -0.281 0 CA-C-O 120.549 0.214 . . . . 0.0 111.004 -179.991 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 322' ' ' PRO . . . . . . . . . . . . . 90.2 Cg_endo -80.87 -26.5 3.6 Favored 'Trans proline' 0 C--N 1.348 0.507 0 C-N-CA 122.474 2.116 . . . . 0.0 112.689 179.778 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 323' ' ' ASP . . . . . . . . . . . . . 12.4 m-20 -67.05 -56.82 8.41 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.383 -179.542 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 324' ' ' ILE . . . . . . . . . . . . . 57.1 mt -64.3 -43.39 97.17 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 CA-C-N 116.299 -0.41 . . . . 0.0 111.195 -179.784 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 325' ' ' TYR . . . . . 0.45 ' O ' HD23 ' B' ' 329' ' ' LEU . 55.1 t80 -57.12 -58.23 9.09 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.714 179.957 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 326' ' ' LYS . . . . . 0.438 ' O ' ' HG2' ' B' ' 330' ' ' GLU . 58.6 mtpt -52.2 -50.02 62.72 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.012 179.833 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 327' ' ' ALA . . . . . 0.439 ' O ' ' HB2' ' B' ' 330' ' ' GLU . . . -50.35 -46.46 55.76 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 116.369 -0.378 . . . . 0.0 111.207 179.997 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 328' ' ' PHE . . . . . . . . . . . . . 71.3 t80 -58.01 -53.5 57.49 Favored 'General case' 0 C--O 1.237 0.44 0 CA-C-O 121.062 0.458 . . . . 0.0 109.985 179.293 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 329' ' ' LEU . . . . . 0.45 HD23 ' O ' ' B' ' 325' ' ' TYR . 4.2 mm? -58.73 -27.73 65.19 Favored 'General case' 0 N--CA 1.452 -0.327 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.372 179.082 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 330' ' ' GLU . . . . . 0.439 ' HB2' ' O ' ' B' ' 327' ' ' ALA . 27.4 mm-40 -69.23 -39.22 78.66 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.035 179.464 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 331' ' ' ILE . . . . . 0.463 HG22 HG22 ' B' ' 358' ' ' VAL . 68.2 mt -63.8 -50.51 77.39 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.23 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.254 179.204 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 332' ' ' LEU . . . . . . . . . . . . . 11.0 mp -66.48 -28.92 68.96 Favored 'General case' 0 C--O 1.233 0.2 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.796 179.643 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 333' ' ' HIS . . . . . . . . . . . . . 34.4 t-80 -66.88 -61.05 2.14 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.401 179.348 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 334' ' ' THR . . . . . . . . . . . . . 95.3 m -56.1 -34.29 65.89 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.925 -0.579 . . . . 0.0 110.242 179.286 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 335' ' ' TYR . . . . . . . . . . . . . 52.4 t80 -63.79 -41.73 97.88 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.809 -0.632 . . . . 0.0 110.245 179.31 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 336' ' ' GLN . . . . . 0.406 ' HB2' HG22 ' A' ' 369' ' ' VAL . 44.4 tt0 -62.77 -47.07 85.08 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.773 179.665 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 337' ' ' LYS . . . . . . . . . . . . . 28.7 ttpp -56.72 -54.32 47.52 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.177 -179.914 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 338' ' ' GLU . . . . . . . . . . . . . 19.7 mm-40 -60.94 -33.34 73.03 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.272 -179.916 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 339' ' ' GLN . . . . . . . . . . . . . 60.5 tt0 -63.14 -61.22 2.52 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.854 -179.949 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 340' ' ' ARG . . . . . . . . . . . . . 95.4 mtt180 -52.54 -52.67 53.68 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.011 -0.54 . . . . 0.0 111.084 -179.99 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 341' ' ' ASN . . . . . . . . . . . . . 80.2 m-20 -54.32 -40.66 68.2 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.952 179.906 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 342' ' ' ALA . . . . . . . . . . . . . . . -66.89 -31.25 71.72 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.119 179.961 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 343' ' ' LYS . . . . . . . . . . . . . 14.0 mmmm -72.35 -46.64 54.61 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.112 -0.494 . . . . 0.0 111.195 -179.885 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 344' ' ' GLU . . . . . . . . . . . . . 14.1 mm-40 -69.7 -29.23 66.59 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.17 -179.706 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 345' ' ' ALA . . . . . . . . . . . . . . . -59.98 -28.91 68.08 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.215 -179.898 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 346' ' ' GLY . . . . . . . . . . . . . . . 135.56 -23.69 3.41 Favored Glycine 0 N--CA 1.45 -0.398 0 C-N-CA 120.786 -0.721 . . . . 0.0 112.531 -179.966 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 347' ' ' GLY . . . . . . . . . . . . . . . 113.96 -17.17 20.19 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.829 -0.701 . . . . 0.0 112.488 179.977 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 348' ' ' ASN . . . . . . . . . . . . . 78.2 m-20 -85.99 -14.89 43.2 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.751 0.31 . . . . 0.0 111.035 -179.967 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 349' ' ' TYR . . . . . . . . . . . . . 80.2 t80 -70.91 130.22 41.07 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.896 179.927 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 350' ' ' THR . . . . . . . . . . . . . 33.0 m -92.9 110.93 48.91 Favored Pre-proline 0 C--N 1.33 -0.267 0 CA-C-N 116.158 -0.474 . . . . 0.0 111.022 179.984 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 351' ' ' PRO . . . . . . . . . . . . . 52.5 Cg_exo -55.65 162.44 6.53 Favored 'Trans proline' 0 C--N 1.348 0.52 0 C-N-CA 122.453 2.102 . . . . 0.0 112.459 -179.878 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 352' ' ' ALA . . . . . . . . . . . . . . . -77.26 -41.71 39.94 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.058 179.947 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 353' ' ' LEU . . . . . 0.453 ' HG ' ' HG2' ' B' ' 357' ' ' GLU . 7.1 mp -114.74 130.32 56.82 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.01 179.969 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 354' ' ' THR . . . . . . . . . . . . . 81.0 p -112.36 -174.86 2.55 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.055 -0.521 . . . . 0.0 110.805 179.769 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 355' ' ' GLU . . . . . . . . . . . . . 8.5 pt-20 -56.54 -42.14 77.97 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 121.209 0.528 . . . . 0.0 110.573 179.985 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 356' ' ' GLN . . . . . . . . . . . . . 15.8 mm100 -65.95 -38.92 89.85 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.5 -0.773 . . . . 0.0 111.055 179.789 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 357' ' ' GLU . . . . . 0.453 ' HG2' ' HG ' ' B' ' 353' ' ' LEU . 5.5 tp10 -61.33 -46.48 90.09 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 120.856 0.36 . . . . 0.0 110.707 -179.833 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 358' ' ' VAL . . . . . 0.512 ' O ' HG23 ' B' ' 362' ' ' VAL . 71.5 t -63.5 -59.92 3.57 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-N 116.101 -0.499 . . . . 0.0 111.173 179.889 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 359' ' ' TYR . . . . . . . . . . . . . 46.5 t80 -52.36 -32.47 38.6 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.375 -0.375 . . . . 0.0 111.569 -179.335 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 360' ' ' ALA . . . . . . . . . . . . . . . -68.42 -60.54 2.36 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.77 0.319 . . . . 0.0 111.075 -179.95 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 361' ' ' GLN . . . . . . . . . . . . . 96.7 mt-30 -55.44 -45.5 76.82 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.68 179.939 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 362' ' ' VAL . . . . . 0.512 HG23 ' O ' ' B' ' 358' ' ' VAL . 57.5 t -61.61 -36.96 76.66 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.217 0 CA-C-N 116.152 -0.477 . . . . 0.0 110.305 179.399 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 363' ' ' ALA . . . . . . . . . . . . . . . -63.84 -34.69 78.49 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.104 179.133 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 364' ' ' ARG . . . . . . . . . . . . . 59.2 ttt180 -75.83 -26.93 57.64 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.821 -0.627 . . . . 0.0 110.085 179.197 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 365' ' ' LEU . . . . . . . . . . . . . 2.5 mp -60.04 -57.97 10.53 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.792 179.333 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 366' ' ' PHE . . . . . 0.423 ' HB3' ' HB2' ' B' ' 369' ' ' GLN . 4.9 m-85 -104.97 133.72 49.29 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.609 179.937 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 367' ' ' LYS . . . . . . . . . . . . . 96.7 mttt -105.23 -78.0 0.58 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.844 0.354 . . . . 0.0 111.15 -179.636 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 368' ' ' ASN . . . . . . . . . . . . . 82.6 m-20 -66.88 -16.59 64.41 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.935 -179.982 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 369' ' ' GLN . . . . . 0.423 ' HB2' ' HB3' ' B' ' 366' ' ' PHE . 96.7 mt-30 -97.02 85.75 3.81 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.947 179.964 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 370' ' ' GLU . . . . . . . . . . . . . 10.5 mm-40 -94.06 -6.03 46.09 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.068 -0.515 . . . . 0.0 111.095 179.847 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 371' ' ' ASP . . . . . . . . . . . . . 20.2 t70 -58.67 -62.77 1.62 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.009 -179.976 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 372' ' ' LEU . . . . . 0.558 HD12 ' N ' ' B' ' 373' ' ' LEU . 0.3 OUTLIER -62.25 -22.52 66.04 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.077 179.927 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 373' ' ' LEU . . . . . 0.558 ' N ' HD12 ' B' ' 372' ' ' LEU . 6.1 tp -70.18 -39.82 75.04 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.25 -179.997 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 374' ' ' SER . . . . . . . . . . . . . 54.7 m -71.98 -48.82 42.24 Favored 'General case' 0 C--O 1.234 0.274 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.065 179.247 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 375' ' ' GLU . . . . . . . . . . . . . 15.3 mm-40 -54.43 -44.79 72.75 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-N 116.009 -0.542 . . . . 0.0 110.057 179.361 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 376' ' ' PHE . . . . . . . . . . . . . 82.3 t80 -65.54 -38.52 89.85 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.015 -0.538 . . . . 0.0 109.934 179.206 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 377' ' ' GLY . . . . . . . . . . . . . . . -58.05 -34.27 72.12 Favored Glycine 0 N--CA 1.449 -0.451 0 C-N-CA 120.683 -0.77 . . . . 0.0 111.721 179.332 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 378' ' ' GLN . . . . . . . . . . . . . 98.1 mt-30 -60.99 -34.73 75.24 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.68 0.276 . . . . 0.0 110.711 179.381 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 379' ' ' PHE . . . . . . . . . . . . . 56.6 m-85 -59.57 -36.5 76.34 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.57 179.656 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 380' ' ' LEU . . . . . . . . . . . . . 93.5 mt -54.22 145.49 35.44 Favored Pre-proline 0 C--N 1.331 -0.204 0 CA-C-N 115.921 -0.581 . . . . 0.0 110.644 179.834 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 381' ' ' PRO . . . . . 0.47 ' HG3' ' HB3' ' A' ' 376' ' ' GLN . 76.6 Cg_exo -50.69 107.49 0.17 Allowed 'Trans proline' 0 C--N 1.346 0.428 0 C-N-CA 122.408 2.072 . . . . 0.0 112.226 179.929 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 382' ' ' ASP . . . . . . . . . . . . . 16.4 m-20 -66.45 134.67 52.94 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.92 -179.962 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 383' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.077 0 CA-C-O 118.206 -0.902 . . . . 0.0 111.173 -179.845 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 358' ' ' ASP . . . . . . . . . . . . . 15.3 t70 . . . . . 0 N--CA 1.486 1.34 0 CA-C-O 120.903 0.382 . . . . 0.0 110.829 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 359' ' ' PHE . . . . . . . . . . . . . 41.9 p90 -87.8 178.99 6.57 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.73 179.901 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 360' ' ' THR . . . . . . . . . . . . . 73.7 p -101.61 130.51 24.49 Favored Pre-proline 0 C--N 1.328 -0.363 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.887 179.838 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 361' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_endo -74.33 -172.04 1.07 Allowed 'Trans proline' 0 C--N 1.348 0.519 0 C-N-CA 122.376 2.05 . . . . 0.0 112.212 179.978 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 362' ' ' MET . . . . . 0.582 ' HG2' HD13 ' B' ' 329' ' ' LEU . 2.1 tmt? -76.24 -71.12 0.4 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.561 179.932 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 363' ' ' ASP . . . . . 0.41 ' HB3' ' SD ' ' A' ' 362' ' ' MET . 14.6 t70 -179.72 -37.98 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 115.89 -0.596 . . . . 0.0 110.039 179.783 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 364' ' ' SER . . . . . . . . . . . . . 35.6 t -124.24 29.35 6.41 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.715 -0.675 . . . . 0.0 110.155 179.608 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 365' ' ' SER . . . . . . . . . . . . . 49.7 m 62.33 96.77 0.04 OUTLIER 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 115.726 -0.67 . . . . 0.0 111.138 -179.781 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 366' ' ' ALA . . . . . . . . . . . . . . . -75.66 -18.1 59.76 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.033 -0.531 . . . . 0.0 110.762 179.75 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 367' ' ' VAL . . . . . . . . . . . . . 21.9 t -59.64 -19.4 16.81 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.744 179.918 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 368' ' ' TYR . . . . . . . . . . . . . 84.7 t80 -65.91 -60.03 3.26 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.061 -179.993 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 369' ' ' VAL . . . . . 0.439 HG21 ' HB3' ' B' ' 332' ' ' LEU . 20.8 m -67.82 -36.82 77.14 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.19 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.555 -179.697 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 370' ' ' LEU . . . . . . . . . . . . . 97.5 mt -62.4 -58.46 7.56 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.958 0.409 . . . . 0.0 110.94 179.88 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 371' ' ' SER . . . . . . . . . . . . . 36.6 t -58.87 -51.4 70.17 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.045 -0.525 . . . . 0.0 111.037 179.8 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 372' ' ' SER . . . . . . . . . . . . . 93.0 p -55.17 -41.32 71.72 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.338 -179.503 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 373' ' ' MET . . . . . 0.575 ' HG2' ' H ' ' B' ' 380' ' ' LEU . 54.3 ttm -62.97 -41.49 99.56 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.458 -0.337 . . . . 0.0 111.186 -179.724 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 374' ' ' ALA . . . . . . . . . . . . . . . -87.03 -6.68 58.65 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.357 -0.383 . . . . 0.0 111.922 -179.595 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 375' ' ' ARG . . . . . . . . . . . . . 22.1 mmm180 -107.81 -12.64 15.16 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.591 0.234 . . . . 0.0 111.603 -179.804 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 376' ' ' GLN . . . . . 0.573 ' HB3' ' HG3' ' B' ' 381' ' ' PRO . 54.0 tt0 -83.25 14.57 3.44 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 121.039 0.447 . . . . 0.0 110.892 -179.727 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 377' ' ' ARG . . . . . 0.441 ' HG2' ' H ' ' B' ' 382' ' ' ASP . 69.8 mtm180 -63.39 -22.16 66.72 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.843 179.9 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 378' ' ' ARG . . . . . . . . . . . . . 27.3 tpt180 -149.55 112.38 4.82 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.077 -0.511 . . . . 0.0 110.745 -179.96 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 379' ' ' ALA . . . . . . . . . . . . . . . -61.64 137.8 58.27 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.001 179.912 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 380' ' ' SER . . . . . . . . . . . . . 58.1 m . . . . . 0 C--O 1.249 1.047 0 CA-C-O 118.26 -0.876 . . . . 0.0 110.941 -179.997 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' B' B ' 295' ' ' SER . . . . . . . . . . . . . 47.7 t . . . . . 0 N--CA 1.485 1.284 0 CA-C-O 120.912 0.387 . . . . 0.0 110.937 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' B' B ' 296' ' ' LEU . . . . . 0.408 HD22 ' N ' ' B' ' 296' ' ' LEU . 3.8 mm? -92.26 115.09 27.77 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.896 -179.93 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 297' ' ' GLN . . . . . . . . . . . . . 28.8 pt20 -151.25 -14.6 0.21 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.817 179.97 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 298' ' ' ASN . . . . . . . . . . . . . 63.1 m-20 58.47 -177.07 0.08 Allowed 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.983 -179.91 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 299' ' ' ASN . . . . . . . . . . . . . 30.4 m-80 -118.63 -65.48 1.17 Allowed 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.85 -179.993 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 300' ' ' GLN . . . . . 0.608 ' H ' ' HD2' ' B' ' 301' ' ' PRO . 35.3 tt0 -169.41 -51.85 0.0 OUTLIER Pre-proline 0 CA--C 1.535 0.368 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.599 -179.947 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 301' ' ' PRO . . . . . 0.608 ' HD2' ' H ' ' B' ' 300' ' ' GLN . 61.1 Cg_endo -73.09 134.23 20.96 Favored 'Trans proline' 0 C--N 1.353 0.786 0 C-N-CA 121.986 1.791 . . . . 0.0 112.443 -179.866 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 302' ' ' VAL . . . . . . . . . . . . . 8.2 p -92.13 -32.06 5.0 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.912 179.809 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 303' ' ' GLU . . . . . 0.408 ' HG3' ' H ' ' B' ' 303' ' ' GLU . 18.7 mt-10 -54.48 -81.18 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.629 -0.714 . . . . 0.0 111.709 -179.244 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 304' ' ' PHE . . . . . 0.561 ' HA ' HD13 ' B' ' 308' ' ' ILE . 80.8 t80 -51.07 -50.15 59.25 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.871 -179.199 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 305' ' ' ASN . . . . . . . . . . . . . 7.3 t30 -50.43 -72.76 0.05 OUTLIER 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 112.634 0.605 . . . . 0.0 112.634 -178.817 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 306' ' ' HIS . . . . . . . . . . . . . 25.5 m80 -58.95 -55.27 37.33 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 113.024 0.75 . . . . 0.0 113.024 -177.994 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 307' ' ' ALA . . . . . . . . . . . . . . . -50.66 -62.37 1.64 Allowed 'General case' 0 CA--C 1.532 0.277 0 N-CA-C 112.554 0.576 . . . . 0.0 112.554 -178.678 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 308' ' ' ILE . . . . . 0.561 HD13 ' HA ' ' B' ' 304' ' ' PHE . 1.8 mp -57.91 -52.79 53.78 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.219 0 N-CA-C 112.024 0.379 . . . . 0.0 112.024 -179.071 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 309' ' ' ASN . . . . . . . . . . . . . 93.5 m-20 -54.33 -28.97 46.24 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.643 0.258 . . . . 0.0 111.427 -179.473 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 310' ' ' TYR . . . . . 0.563 ' O ' ' HG3' ' B' ' 313' ' ' LYS . 43.7 t80 -74.09 -61.26 1.92 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.948 0.404 . . . . 0.0 111.059 -179.674 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 311' ' ' VAL . . . . . . . . . . . . . 58.5 t -58.64 -27.73 35.01 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.428 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.673 179.949 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 312' ' ' ASN . . . . . . . . . . . . . 7.5 t30 -72.49 -56.69 5.01 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.71 -179.148 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 313' ' ' LYS . . . . . 0.563 ' HG3' ' O ' ' B' ' 310' ' ' TYR . 0.0 OUTLIER -56.56 -38.09 71.45 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.648 0.261 . . . . 0.0 111.465 -179.359 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 314' ' ' ILE . . . . . 0.419 HG13 ' O ' ' B' ' 310' ' ' TYR . 11.0 mt -78.08 -31.14 16.4 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.22 0 N-CA-C 111.958 0.355 . . . . 0.0 111.958 -179.409 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 315' ' ' LYS . . . . . 0.409 ' HE3' ' HB3' ' B' ' 315' ' ' LYS . 1.4 tmmt? -70.54 -34.92 72.81 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.61 0.243 . . . . 0.0 111.281 -179.983 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 316' ' ' ASN . . . . . . . . . . . . . 61.5 t30 -86.01 -38.55 17.78 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.478 -0.328 . . . . 0.0 111.746 -179.087 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 317' ' ' ARG . . . . . . . . . . . . . 32.6 tpt180 -75.58 -44.13 44.71 Favored 'General case' 0 C--N 1.327 -0.374 0 N-CA-C 111.733 0.272 . . . . 0.0 111.733 -179.29 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 318' ' ' PHE . . . . . . . . . . . . . 62.9 m-85 -98.0 34.63 1.88 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.537 -0.302 . . . . 0.0 111.394 -179.455 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 319' ' ' GLN . . . . . . . . . . . . . 25.1 pt20 -67.97 -9.13 42.97 Favored 'General case' 0 N--CA 1.447 -0.602 0 CA-C-N 116.443 -0.344 . . . . 0.0 111.068 179.658 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 320' ' ' GLY . . . . . . . . . . . . . . . -96.05 -19.11 29.56 Favored Glycine 0 N--CA 1.451 -0.347 0 C-N-CA 120.845 -0.693 . . . . 0.0 112.711 -179.857 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 321' ' ' GLN . . . . . . . . . . . . . 58.9 mt-30 -108.07 92.27 9.1 Favored Pre-proline 0 C--N 1.33 -0.274 0 CA-C-O 120.473 0.178 . . . . 0.0 111.139 179.935 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 322' ' ' PRO . . . . . . . . . . . . . 93.0 Cg_endo -79.03 -23.57 7.67 Favored 'Trans proline' 0 C--N 1.349 0.601 0 C-N-CA 122.502 2.135 . . . . 0.0 112.355 179.75 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 323' ' ' ASP . . . . . . . . . . . . . 10.0 m-20 -69.36 -52.69 24.67 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.824 179.949 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 324' ' ' ILE . . . . . . . . . . . . . 64.4 mt -69.12 -42.54 81.85 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.98 179.929 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 325' ' ' TYR . . . . . . . . . . . . . 40.3 t80 -58.21 -57.17 14.03 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.697 179.874 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 326' ' ' LYS . . . . . 0.463 ' O ' ' HG2' ' B' ' 330' ' ' GLU . 28.6 mtpp -57.84 -46.8 84.22 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.938 179.789 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 327' ' ' ALA . . . . . . . . . . . . . . . -48.19 -54.14 14.51 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 116.308 -0.405 . . . . 0.0 111.193 -179.916 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 328' ' ' PHE . . . . . . . . . . . . . 84.0 t80 -56.12 -47.29 78.41 Favored 'General case' 0 C--O 1.237 0.405 0 CA-C-O 121.14 0.495 . . . . 0.0 109.903 179.283 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 329' ' ' LEU . . . . . 0.582 HD13 ' HG2' ' A' ' 362' ' ' MET . 91.7 mt -61.36 -26.19 67.66 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.614 -0.721 . . . . 0.0 110.636 179.496 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 330' ' ' GLU . . . . . 0.463 ' HG2' ' O ' ' B' ' 326' ' ' LYS . 16.1 mm-40 -75.63 -32.89 60.42 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.151 -0.477 . . . . 0.0 109.983 179.454 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 331' ' ' ILE . . . . . 0.493 HG22 HG22 ' B' ' 358' ' ' VAL . 74.4 mt -67.22 -47.53 81.2 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.191 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.343 179.063 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 332' ' ' LEU . . . . . 0.439 ' HB3' HG21 ' A' ' 369' ' ' VAL . 9.3 mp -69.21 -35.87 76.66 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.755 179.426 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 333' ' ' HIS . . . . . . . . . . . . . 17.0 t-80 -64.05 -52.94 57.03 Favored 'General case' 0 C--O 1.232 0.182 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.37 179.608 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 334' ' ' THR . . . . . . . . . . . . . 84.4 m -60.44 -36.78 79.02 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.036 -0.529 . . . . 0.0 109.838 179.094 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 335' ' ' TYR . . . . . . . . . . . . . 50.9 t80 -61.36 -37.1 82.13 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.516 -0.765 . . . . 0.0 109.933 179.249 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 336' ' ' GLN . . . . . . . . . . . . . 63.0 tt0 -66.01 -51.6 56.87 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 115.798 -0.637 . . . . 0.0 110.492 179.315 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 337' ' ' LYS . . . . . . . . . . . . . 27.1 ttpp -55.36 -39.21 69.8 Favored 'General case' 0 C--O 1.233 0.195 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.936 179.853 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 338' ' ' GLU . . . . . . . . . . . . . 15.6 mm-40 -66.47 -42.29 87.75 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.94 179.881 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 339' ' ' GLN . . . . . . . . . . . . . 74.0 mt-30 -61.45 -42.4 98.71 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.323 -0.398 . . . . 0.0 110.957 179.608 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 340' ' ' ARG . . . . . . . . . . . . . 73.6 mtp180 -62.39 -55.27 29.52 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.901 -179.875 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 341' ' ' ASN . . . . . . . . . . . . . 82.7 m-20 -57.17 -35.01 69.04 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.874 179.912 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 342' ' ' ALA . . . . . . . . . . . . . . . -66.31 -43.24 86.79 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.061 -0.518 . . . . 0.0 111.102 179.92 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 343' ' ' LYS . . . . . . . . . . . . . 14.4 tmtt? -65.03 -46.64 80.44 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.634 -179.979 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 344' ' ' GLU . . . . . . . . . . . . . 12.5 mm-40 -63.98 -32.44 73.98 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.886 -179.999 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 345' ' ' ALA . . . . . . . . . . . . . . . -67.66 -23.13 65.29 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.029 179.938 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 346' ' ' GLY . . . . . . . . . . . . . . . 112.54 -67.66 0.24 Allowed Glycine 0 N--CA 1.452 -0.258 0 C-N-CA 120.728 -0.749 . . . . 0.0 112.529 179.99 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 347' ' ' GLY . . . . . . . . . . . . . . . 172.14 -17.2 0.05 OUTLIER Glycine 0 N--CA 1.452 -0.274 0 C-N-CA 120.772 -0.728 . . . . 0.0 112.454 -179.964 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 348' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -73.7 -10.37 59.62 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 121.011 0.434 . . . . 0.0 110.513 -179.972 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 349' ' ' TYR . . . . . . . . . . . . . 82.8 t80 -84.44 150.86 25.02 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.961 -0.563 . . . . 0.0 111.058 -179.86 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 350' ' ' THR . . . . . . . . . . . . . 93.3 m -119.87 105.58 42.76 Favored Pre-proline 0 C--N 1.33 -0.282 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.795 179.772 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 351' ' ' PRO . . . . . . . . . . . . . 54.7 Cg_exo -52.39 134.25 51.11 Favored 'Trans proline' 0 C--N 1.349 0.579 0 C-N-CA 122.464 2.109 . . . . 0.0 112.497 -179.956 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 352' ' ' ALA . . . . . . . . . . . . . . . -61.04 -59.43 5.38 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.028 179.936 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 353' ' ' LEU . . . . . 0.447 ' HG ' ' HG2' ' B' ' 357' ' ' GLU . 5.9 mp -89.88 117.6 28.82 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.856 0.36 . . . . 0.0 111.137 179.921 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 354' ' ' THR . . . . . 0.423 ' H ' ' HB2' ' B' ' 357' ' ' GLU . 73.1 p -110.62 -171.19 1.78 Allowed 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.088 -0.506 . . . . 0.0 110.551 179.427 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 355' ' ' GLU . . . . . . . . . . . . . 34.8 mt-10 -54.9 -42.55 72.29 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 121.065 0.46 . . . . 0.0 110.406 179.671 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 356' ' ' GLN . . . . . . . . . . . . . 96.5 mt-30 -67.2 -35.86 80.5 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.667 -0.697 . . . . 0.0 111.054 -179.936 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 357' ' ' GLU . . . . . 0.447 ' HG2' ' HG ' ' B' ' 353' ' ' LEU . 5.7 tp10 -62.41 -53.85 48.95 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.528 -0.306 . . . . 0.0 110.877 -179.703 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 358' ' ' VAL . . . . . 0.502 ' O ' HG23 ' B' ' 362' ' ' VAL . 72.6 t -59.83 -57.03 13.49 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.413 -0.358 . . . . 0.0 111.042 179.984 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 359' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -51.85 -35.19 43.9 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.806 0.336 . . . . 0.0 110.932 -179.527 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 360' ' ' ALA . . . . . . . . . . . . . . . -68.38 -59.21 3.34 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.501 -0.318 . . . . 0.0 111.451 -179.904 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 361' ' ' GLN . . . . . . . . . . . . . 79.5 mm-40 -53.66 -42.68 68.11 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.993 -179.991 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 362' ' ' VAL . . . . . 0.502 HG23 ' O ' ' B' ' 358' ' ' VAL . 49.0 t -68.96 -37.66 77.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.732 179.82 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 363' ' ' ALA . . . . . 0.587 ' HA ' HD21 ' B' ' 373' ' ' LEU . . . -59.62 -38.25 80.82 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.736 179.687 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 364' ' ' ARG . . . . . . . . . . . . . 77.6 ttt180 -90.33 -18.79 24.92 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.826 -0.624 . . . . 0.0 110.723 179.964 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 365' ' ' LEU . . . . . . . . . . . . . 25.2 tp -55.7 -30.82 61.77 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.531 179.749 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 366' ' ' PHE . . . . . . . . . . . . . 69.3 m-85 -112.63 159.89 18.43 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.31 179.724 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 367' ' ' LYS . . . . . . . . . . . . . 34.5 mmtp -89.34 -75.67 0.43 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.407 -0.36 . . . . 0.0 111.551 -179.31 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 368' ' ' ASN . . . . . . . . . . . . . 29.4 m-80 -115.48 14.95 16.74 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.406 -0.361 . . . . 0.0 111.136 -179.59 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 369' ' ' GLN . . . . . . . . . . . . . 70.9 mt-30 -89.61 90.3 8.19 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.891 179.989 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 370' ' ' GLU . . . . . . . . . . . . . 34.3 mt-10 -91.8 -11.44 36.59 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.755 179.986 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 371' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -58.4 -57.58 12.27 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.83 179.947 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 372' ' ' LEU . . . . . . . . . . . . . 23.1 mt -61.74 -38.59 88.51 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.491 179.75 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 373' ' ' LEU . . . . . 0.587 HD21 ' HA ' ' B' ' 363' ' ' ALA . 1.0 OUTLIER -56.71 -38.93 73.02 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.567 179.866 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 374' ' ' SER . . . . . . . . . . . . . 70.8 m -73.25 -44.87 58.64 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.046 -0.524 . . . . 0.0 110.296 179.417 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 375' ' ' GLU . . . . . . . . . . . . . 28.1 mm-40 -56.76 -34.34 67.49 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.347 179.437 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 376' ' ' PHE . . . . . . . . . . . . . 66.8 t80 -82.58 -30.12 29.8 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.878 -0.601 . . . . 0.0 109.854 179.266 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 377' ' ' GLY . . . . . . . . . . . . . . . -64.59 -31.37 80.67 Favored Glycine 0 N--CA 1.45 -0.389 0 C-N-CA 120.837 -0.697 . . . . 0.0 111.909 179.326 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 378' ' ' GLN . . . . . . . . . . . . . 30.1 mm-40 -56.8 -26.76 58.58 Favored 'General case' 0 C--N 1.333 -0.139 0 CA-C-O 120.953 0.406 . . . . 0.0 110.477 179.553 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 379' ' ' PHE . . . . . . . . . . . . . 63.6 m-85 -73.12 -148.19 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.627 179.527 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 380' ' ' LEU . . . . . 0.575 ' H ' ' HG2' ' A' ' 373' ' ' MET . 32.7 mt 66.81 131.13 0.03 OUTLIER Pre-proline 0 CA--C 1.531 0.226 0 CA-C-N 116.482 -0.326 . . . . 0.0 110.789 179.991 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 381' ' ' PRO . . . . . 0.573 ' HG3' ' HB3' ' A' ' 376' ' ' GLN . 62.8 Cg_exo -51.55 125.66 17.36 Favored 'Trans proline' 0 C--N 1.349 0.582 0 C-N-CA 122.28 1.986 . . . . 0.0 112.486 179.989 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 382' ' ' ASP . . . . . 0.441 ' H ' ' HG2' ' A' ' 377' ' ' ARG . 3.3 p30 -132.05 -179.69 5.57 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.894 179.952 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 383' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.077 0 CA-C-O 118.225 -0.893 . . . . 0.0 111.026 -179.929 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 358' ' ' ASP . . . . . . . . . . . . . 7.7 m-20 . . . . . 0 N--CA 1.486 1.36 0 CA-C-O 120.789 0.328 . . . . 0.0 110.899 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 359' ' ' PHE . . . . . . . . . . . . . 5.4 t80 -106.04 145.0 31.96 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.676 -179.926 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 360' ' ' THR . . . . . 0.42 ' HB ' ' HD2' ' A' ' 361' ' ' PRO . 43.9 p -58.01 157.66 15.39 Favored Pre-proline 0 C--N 1.33 -0.281 0 CA-C-N 116.178 -0.464 . . . . 0.0 111.346 179.959 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 361' ' ' PRO . . . . . 0.42 ' HD2' ' HB ' ' A' ' 360' ' ' THR . 30.8 Cg_endo -63.67 -5.08 8.05 Favored 'Trans proline' 0 C--N 1.349 0.596 0 C-N-CA 122.532 2.155 . . . . 0.0 112.51 179.858 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 362' ' ' MET . . . . . 0.581 ' HG3' HD13 ' B' ' 329' ' ' LEU . 26.4 mmt -79.04 11.04 2.95 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.735 179.787 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 363' ' ' ASP . . . . . . . . . . . . . 21.8 t70 -83.57 -6.12 59.36 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.871 179.892 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 364' ' ' SER . . . . . . . . . . . . . 48.8 m -141.79 -22.25 0.72 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.798 179.771 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 365' ' ' SER . . . . . . . . . . . . . 46.9 t -73.66 -63.13 1.27 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.738 179.783 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 366' ' ' ALA . . . . . . . . . . . . . . . -64.12 -17.98 63.98 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.09 179.806 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 367' ' ' VAL . . . . . . . . . . . . . 39.9 t -73.22 -31.39 34.21 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.051 -179.995 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 368' ' ' TYR . . . . . . . . . . . . . 49.1 t80 -70.42 -42.77 71.17 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.932 -179.885 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 369' ' ' VAL . . . . . 0.431 HG13 ' N ' ' A' ' 370' ' ' LEU . 5.7 p -70.56 -46.88 68.05 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.216 0 CA-C-N 116.242 -0.436 . . . . 0.0 111.157 -179.923 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 370' ' ' LEU . . . . . 0.51 HD13 ' HA ' ' B' ' 307' ' ' ALA . 89.8 mt -60.18 -43.85 95.53 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.816 0.341 . . . . 0.0 110.868 179.808 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 371' ' ' SER . . . . . . . . . . . . . 45.2 t -62.01 -57.28 12.25 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.967 179.89 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 372' ' ' SER . . . . . 0.407 ' O ' ' HG2' ' A' ' 376' ' ' GLN . 47.3 t -51.59 -50.85 59.36 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.224 -179.77 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 373' ' ' MET . . . . . . . . . . . . . 94.2 mtp -54.18 -45.54 72.14 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.353 -179.768 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 374' ' ' ALA . . . . . . . . . . . . . . . -79.81 -9.81 59.71 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.583 -0.28 . . . . 0.0 111.635 -179.832 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 375' ' ' ARG . . . . . . . . . . . . . 22.3 mmm180 -100.68 -12.13 19.41 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.558 -0.292 . . . . 0.0 111.363 179.871 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 376' ' ' GLN . . . . . 0.573 ' HB2' ' HG3' ' B' ' 381' ' ' PRO . 18.1 mm-40 -78.18 -7.65 57.34 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.511 -0.313 . . . . 0.0 111.084 179.952 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 377' ' ' ARG . . . . . . . . . . . . . 15.0 ptp180 -63.86 121.67 14.61 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.975 0.417 . . . . 0.0 110.978 -179.641 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 378' ' ' ARG . . . . . . . . . . . . . 99.6 mtt180 53.27 25.53 4.49 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.033 -0.531 . . . . 0.0 111.322 179.798 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 379' ' ' ALA . . . . . . . . . . . . . . . -82.25 -16.99 47.56 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.387 -0.37 . . . . 0.0 111.14 -179.995 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 380' ' ' SER . . . . . . . . . . . . . 64.7 p . . . . . 0 C--O 1.249 1.065 0 CA-C-O 118.33 -0.843 . . . . 0.0 110.947 -179.966 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' B' B ' 295' ' ' SER . . . . . . . . . . . . . 61.1 m . . . . . 0 N--CA 1.486 1.351 0 CA-C-O 120.784 0.326 . . . . 0.0 110.917 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' B' B ' 296' ' ' LEU . . . . . . . . . . . . . 62.0 mt -112.83 -4.44 13.99 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.89 -179.927 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 297' ' ' GLN . . . . . . . . . . . . . 47.5 mt-30 -110.63 157.11 20.05 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.319 -0.401 . . . . 0.0 111.061 -179.921 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 298' ' ' ASN . . . . . . . . . . . . . 4.8 m-20 58.73 -177.5 0.08 Allowed 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.099 179.896 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 299' ' ' ASN . . . . . . . . . . . . . 17.1 m120 -112.55 -40.85 3.97 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.948 -179.94 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 300' ' ' GLN . . . . . . . . . . . . . 6.4 tp-100 -120.42 100.65 47.15 Favored Pre-proline 0 C--N 1.33 -0.278 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.069 -179.869 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 301' ' ' PRO . . . . . . . . . . . . . 40.1 Cg_endo -66.46 114.74 3.19 Favored 'Trans proline' 0 C--N 1.349 0.579 0 C-N-CA 122.301 2.001 . . . . 0.0 112.046 179.776 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 302' ' ' VAL . . . . . . . . . . . . . 10.3 p -83.28 -33.28 9.95 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.147 -179.823 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 303' ' ' GLU . . . . . . . . . . . . . 27.7 mt-10 -52.12 -74.08 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.859 -0.609 . . . . 0.0 112.016 -179.407 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 304' ' ' PHE . . . . . . . . . . . . . 90.3 m-85 -50.07 -66.52 0.38 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.968 -0.56 . . . . 0.0 112.291 -178.96 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 305' ' ' ASN . . . . . . . . . . . . . 40.5 m-80 -41.77 -61.91 1.01 Allowed 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 112.798 0.666 . . . . 0.0 112.798 -178.704 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 306' ' ' HIS . . . . . . . . . . . . . 11.2 m170 -60.46 -67.52 0.39 Allowed 'General case' 0 C--N 1.33 -0.246 0 N-CA-C 112.703 0.631 . . . . 0.0 112.703 -178.519 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 307' ' ' ALA . . . . . 0.51 ' HA ' HD13 ' A' ' 370' ' ' LEU . . . -48.64 -58.11 5.23 Favored 'General case' 0 C--N 1.33 -0.27 0 N-CA-C 112.388 0.514 . . . . 0.0 112.388 -178.542 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 308' ' ' ILE . . . . . . . . . . . . . 42.8 mm -53.37 -60.0 1.51 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 N-CA-C 112.001 0.371 . . . . 0.0 112.001 -179.247 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 309' ' ' ASN . . . . . . . . . . . . . 91.3 m-20 -57.82 -25.02 60.05 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 120.594 0.235 . . . . 0.0 111.615 -179.298 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 310' ' ' TYR . . . . . . . . . . . . . 36.3 t80 -69.87 -56.27 7.53 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.506 -0.315 . . . . 0.0 111.128 -179.541 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 311' ' ' VAL . . . . . . . . . . . . . 40.7 t -59.29 -44.05 91.33 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.719 179.976 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 312' ' ' ASN . . . . . . . . . . . . . 7.2 t30 -62.01 -39.94 93.98 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.925 179.914 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 313' ' ' LYS . . . . . . . . . . . . . 4.5 ttmm -60.62 -60.17 4.22 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.985 -179.924 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 314' ' ' ILE . . . . . . . . . . . . . 32.3 mt -59.48 -27.71 37.94 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.129 -179.5 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 315' ' ' LYS . . . . . . . . . . . . . 23.3 ttmm -70.18 -40.86 74.41 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.534 -0.303 . . . . 0.0 111.031 179.649 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 316' ' ' ASN . . . . . . . . . . . . . 60.3 t30 -88.89 -8.53 54.08 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.352 -0.386 . . . . 0.0 110.976 -179.716 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 317' ' ' ARG . . . . . . . . . . . . . 20.7 tpp180 -95.34 -61.8 1.41 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.084 -179.933 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 318' ' ' PHE . . . . . . . . . . . . . 73.6 m-85 -94.37 34.73 1.26 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.333 -179.767 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 319' ' ' GLN . . . . . . . . . . . . . 20.9 tm0? -61.62 -31.01 71.07 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.37 179.557 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 320' ' ' GLY . . . . . . . . . . . . . . . -60.33 -62.51 5.94 Favored Glycine 0 C--N 1.332 0.312 0 C-N-CA 120.986 -0.626 . . . . 0.0 112.704 -179.858 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 321' ' ' GLN . . . . . . . . . . . . . 81.8 mm-40 -79.36 111.75 23.08 Favored Pre-proline 0 CA--C 1.531 0.22 0 CA-C-N 116.513 0.157 . . . . 0.0 110.989 -179.865 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 322' ' ' PRO . . . . . . . . . . . . . 97.1 Cg_endo -83.96 -22.81 3.36 Favored 'Trans proline' 0 C--N 1.349 0.582 0 C-N-CA 122.547 2.165 . . . . 0.0 112.619 179.989 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 323' ' ' ASP . . . . . . . . . . . . . 6.7 m-20 -70.12 -49.06 54.5 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.268 -0.423 . . . . 0.0 111.155 -179.725 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 324' ' ' ILE . . . . . . . . . . . . . 51.5 mt -64.7 -47.58 88.2 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.205 -179.825 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 325' ' ' TYR . . . . . . . . . . . . . 23.5 t80 -60.09 -52.4 65.52 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.078 -179.767 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 326' ' ' LYS . . . . . 0.402 ' O ' ' HG3' ' B' ' 330' ' ' GLU . 87.8 tttt -59.36 -36.24 75.38 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.726 179.879 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 327' ' ' ALA . . . . . . . . . . . . . . . -59.9 -52.81 63.82 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.722 179.644 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 328' ' ' PHE . . . . . . . . . . . . . 81.2 t80 -55.51 -49.58 72.21 Favored 'General case' 0 C--O 1.236 0.346 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.74 179.818 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 329' ' ' LEU . . . . . 0.581 HD13 ' HG3' ' A' ' 362' ' ' MET . 89.4 mt -57.54 -38.47 74.77 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.931 -0.577 . . . . 0.0 111.023 179.89 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 330' ' ' GLU . . . . . 0.402 ' HG3' ' O ' ' B' ' 326' ' ' LYS . 44.7 mt-10 -67.08 -35.35 79.62 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.361 -0.381 . . . . 0.0 111.086 -179.845 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 331' ' ' ILE . . . . . . . . . . . . . 94.4 mt -64.67 -50.91 73.45 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-O 120.855 0.359 . . . . 0.0 110.442 179.348 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 332' ' ' LEU . . . . . . . . . . . . . 4.8 mp -65.97 -31.64 72.67 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.769 179.709 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 333' ' ' HIS . . . . . . . . . . . . . 52.9 t-80 -64.28 -58.06 7.63 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.025 179.34 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 334' ' ' THR . . . . . . . . . . . . . 96.7 m -58.22 -32.44 68.3 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.78 -0.645 . . . . 0.0 110.232 179.139 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 335' ' ' TYR . . . . . . . . . . . . . 74.9 t80 -63.04 -44.43 95.9 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 115.701 -0.681 . . . . 0.0 110.062 179.239 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 336' ' ' GLN . . . . . . . . . . . . . 54.0 tt0 -63.35 -39.47 94.63 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.739 -0.664 . . . . 0.0 110.33 179.488 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 337' ' ' LYS . . . . . . . . . . . . . 14.6 tppt? -58.68 -59.5 5.3 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.929 179.544 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 338' ' ' GLU . . . . . . . . . . . . . 13.6 mm-40 -60.67 -31.08 70.34 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.969 -0.56 . . . . 0.0 111.086 -179.819 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 339' ' ' GLN . . . . . . . . . . . . . 53.5 tt0 -64.47 -45.64 86.51 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.896 0.379 . . . . 0.0 110.793 179.895 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 340' ' ' ARG . . . . . . . . . . . . . 65.7 mtt180 -65.42 -51.61 59.04 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.003 -0.544 . . . . 0.0 111.049 -179.979 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 341' ' ' ASN . . . . . . . . . . . . . 25.8 t-20 -56.43 -39.0 72.36 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.11 -0.496 . . . . 0.0 111.032 -179.8 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 342' ' ' ALA . . . . . . . . . . . . . . . -69.62 -38.64 77.32 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.297 -0.41 . . . . 0.0 111.146 -179.905 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 343' ' ' LYS . . . . . . . . . . . . . 62.8 tttm -65.02 -43.63 91.82 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.262 -0.427 . . . . 0.0 110.888 -179.997 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 344' ' ' GLU . . . . . . . . . . . . . 18.3 mm-40 -70.02 -35.92 74.7 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.041 -179.963 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 345' ' ' ALA . . . . . . . . . . . . . . . -62.34 -35.64 79.73 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.188 -179.893 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 346' ' ' GLY . . . . . . . . . . . . . . . 123.01 -73.07 0.39 Allowed Glycine 0 N--CA 1.453 -0.228 0 C-N-CA 120.771 -0.728 . . . . 0.0 112.61 179.936 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 347' ' ' GLY . . . . . . . . . . . . . . . -177.74 -12.12 0.02 OUTLIER Glycine 0 N--CA 1.451 -0.326 0 C-N-CA 120.778 -0.725 . . . . 0.0 112.509 -179.924 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 348' ' ' ASN . . . . . . . . . . . . . 6.9 t30 -79.1 -23.09 44.34 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.81 0.338 . . . . 0.0 110.719 -179.979 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 349' ' ' TYR . . . . . . . . . . . . . 71.5 t80 -69.8 141.96 53.25 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.799 179.903 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 350' ' ' THR . . . . . . . . . . . . . 38.3 m -107.39 103.41 48.48 Favored Pre-proline 0 C--N 1.328 -0.326 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.248 -179.894 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 351' ' ' PRO . . . . . . . . . . . . . 48.8 Cg_exo -56.54 157.26 19.31 Favored 'Trans proline' 0 C--N 1.349 0.569 0 C-N-CA 122.461 2.107 . . . . 0.0 112.284 179.868 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 352' ' ' ALA . . . . . . . . . . . . . . . -86.82 -43.11 12.74 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.177 179.978 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 353' ' ' LEU . . . . . 0.437 ' HG ' ' HG2' ' B' ' 357' ' ' GLU . 6.6 mp -115.64 125.78 53.32 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.954 0.407 . . . . 0.0 111.182 -179.99 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 354' ' ' THR . . . . . . . . . . . . . 74.0 p -114.19 -170.23 1.68 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.509 179.329 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 355' ' ' GLU . . . . . 0.401 ' CD ' ' H ' ' B' ' 355' ' ' GLU . 2.8 mp0 -59.81 -33.69 72.07 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.926 0.393 . . . . 0.0 110.511 179.744 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 356' ' ' GLN . . . . . . . . . . . . . 95.8 mt-30 -74.21 -43.93 55.21 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.006 -0.543 . . . . 0.0 111.331 -179.796 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 357' ' ' GLU . . . . . 0.437 ' HG2' ' HG ' ' B' ' 353' ' ' LEU . 6.2 tp10 -57.23 -48.95 77.53 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 120.992 0.425 . . . . 0.0 110.552 -179.981 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 358' ' ' VAL . . . . . 0.506 ' O ' HG23 ' B' ' 362' ' ' VAL . 73.7 t -64.43 -58.41 7.34 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 115.853 -0.612 . . . . 0.0 111.277 -179.941 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 359' ' ' TYR . . . . . . . . . . . . . 50.1 t80 -53.93 -26.62 26.24 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.598 -0.274 . . . . 0.0 111.159 -179.48 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 360' ' ' ALA . . . . . . . . . . . . . . . -72.48 -60.36 2.27 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.773 0.321 . . . . 0.0 111.147 179.855 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 361' ' ' GLN . . . . . . . . . . . . . 72.7 mt-30 -57.3 -39.44 75.77 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.922 179.886 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 362' ' ' VAL . . . . . 0.506 HG23 ' O ' ' B' ' 358' ' ' VAL . 58.1 t -68.39 -38.59 79.58 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.638 179.637 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 363' ' ' ALA . . . . . 0.509 ' HA ' HD11 ' B' ' 373' ' ' LEU . . . -59.21 -43.76 92.29 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.457 179.43 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 364' ' ' ARG . . . . . . . . . . . . . 41.8 ttm180 -79.99 -21.62 43.43 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.859 -0.61 . . . . 0.0 110.484 179.742 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 365' ' ' LEU . . . . . . . . . . . . . 7.5 tp -58.73 -25.9 63.41 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.44 179.657 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 366' ' ' PHE . . . . . . . . . . . . . 47.2 m-85 -129.05 169.12 15.11 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.757 -0.656 . . . . 0.0 110.38 179.818 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 367' ' ' LYS . . . . . . . . . . . . . 55.9 mtmt -132.2 -79.58 0.5 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.786 0.327 . . . . 0.0 111.131 179.974 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 368' ' ' ASN . . . . . . . . . . . . . 22.3 t-20 -73.5 -12.44 60.78 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.827 -179.859 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 369' ' ' GLN . . . . . . . . . . . . . 26.8 mm-40 -96.54 84.12 3.62 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.104 -179.941 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 370' ' ' GLU . . . . . . . . . . . . . 17.4 mm-40 -94.13 -8.9 38.19 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.67 179.438 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 371' ' ' ASP . . . . . . . . . . . . . 7.4 m-20 -57.64 -63.65 1.17 Allowed 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.911 -179.984 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 372' ' ' LEU . . . . . 0.608 HD12 ' N ' ' B' ' 373' ' ' LEU . 0.4 OUTLIER -57.87 -23.14 51.72 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.994 179.872 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 373' ' ' LEU . . . . . 0.608 ' N ' HD12 ' B' ' 372' ' ' LEU . 4.6 tp -72.69 -39.91 66.66 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.253 179.869 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 374' ' ' SER . . . . . . . . . . . . . 47.4 t -69.16 -51.79 34.6 Favored 'General case' 0 C--O 1.235 0.315 0 CA-C-N 116.025 -0.534 . . . . 0.0 109.916 179.058 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 375' ' ' GLU . . . . . . . . . . . . . 43.0 mt-10 -53.23 -43.61 67.44 Favored 'General case' 0 N--CA 1.455 -0.221 0 CA-C-N 115.791 -0.64 . . . . 0.0 109.698 178.915 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 376' ' ' PHE . . . . . 0.403 ' O ' ' HB2' ' B' ' 379' ' ' PHE . 70.9 t80 -62.81 -39.63 94.9 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 115.714 -0.675 . . . . 0.0 110.043 179.172 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 377' ' ' GLY . . . . . . . . . . . . . . . -58.83 -34.9 79.91 Favored Glycine 0 N--CA 1.449 -0.498 0 C-N-CA 120.735 -0.745 . . . . 0.0 111.724 179.32 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 378' ' ' GLN . . . . . . . . . . . . . 55.8 mt-30 -62.99 -30.92 71.97 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.654 0.264 . . . . 0.0 110.962 179.534 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 379' ' ' PHE . . . . . 0.403 ' HB2' ' O ' ' B' ' 376' ' ' PHE . 50.2 m-85 -61.45 -35.34 77.32 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.354 -0.384 . . . . 0.0 110.74 179.715 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 380' ' ' LEU . . . . . . . . . . . . . 89.4 mt -56.07 138.25 72.92 Favored Pre-proline 0 C--N 1.329 -0.289 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.864 179.884 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 381' ' ' PRO . . . . . 0.573 ' HG3' ' HB2' ' A' ' 376' ' ' GLN . 72.3 Cg_exo -51.34 133.65 43.01 Favored 'Trans proline' 0 C--N 1.347 0.473 0 C-N-CA 122.447 2.098 . . . . 0.0 112.309 179.953 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 382' ' ' ASP . . . . . . . . . . . . . 9.8 m-20 -114.65 109.64 18.54 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.886 -179.947 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 383' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.033 0 CA-C-O 118.225 -0.893 . . . . 0.0 111.235 -179.81 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 358' ' ' ASP . . . . . . . . . . . . . 11.0 m-20 . . . . . 0 N--CA 1.485 1.298 0 CA-C-O 120.852 0.358 . . . . 0.0 110.941 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 359' ' ' PHE . . . . . . . . . . . . . 30.4 p90 -111.97 -173.55 2.27 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.834 -179.981 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 360' ' ' THR . . . . . . . . . . . . . 77.2 p -132.3 148.1 68.38 Favored Pre-proline 0 C--N 1.328 -0.333 0 CA-C-N 116.275 -0.421 . . . . 0.0 111.257 -179.969 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 361' ' ' PRO . . . . . . . . . . . . . 65.2 Cg_endo -73.07 -154.48 0.04 OUTLIER 'Trans proline' 0 C--N 1.347 0.457 0 C-N-CA 122.57 2.18 . . . . 0.0 112.047 179.754 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 362' ' ' MET . . . . . 0.646 ' HG3' HD13 ' B' ' 329' ' ' LEU . 24.7 ttt -56.32 -71.25 0.09 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.339 -0.391 . . . . 0.0 110.885 179.849 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 363' ' ' ASP . . . . . . . . . . . . . 19.0 t70 -169.82 -55.02 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.647 179.969 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 364' ' ' SER . . . . . . . . . . . . . 79.6 p -100.4 31.13 3.54 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.672 179.84 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 365' ' ' SER . . . . . 0.469 ' HB3' HG22 ' A' ' 367' ' ' VAL . 50.9 m 62.24 94.19 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.952 -0.567 . . . . 0.0 111.1 -179.799 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 366' ' ' ALA . . . . . . . . . . . . . . . -71.91 -13.35 61.62 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.89 179.85 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 367' ' ' VAL . . . . . 0.469 HG22 ' HB3' ' A' ' 365' ' ' SER . 26.9 m -51.22 -21.42 1.5 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.209 0 CA-C-N 115.974 -0.557 . . . . 0.0 111.732 -179.871 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 368' ' ' TYR . . . . . . . . . . . . . 45.7 m-85 -65.19 -61.08 2.35 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.58 -0.282 . . . . 0.0 110.836 179.758 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 369' ' ' VAL . . . . . 0.671 HG13 HD22 ' A' ' 370' ' ' LEU . 2.9 p -64.25 -43.63 97.27 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.204 0 CA-C-N 116.551 -0.295 . . . . 0.0 111.541 -179.882 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 370' ' ' LEU . . . . . 0.671 HD22 HG13 ' A' ' 369' ' ' VAL . 4.2 mm? -57.9 -59.59 5.01 Favored 'General case' 0 C--O 1.235 0.295 0 CA-C-O 120.936 0.398 . . . . 0.0 111.254 -179.955 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 371' ' ' SER . . . . . . . . . . . . . 55.2 m -59.84 -32.33 70.57 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.041 -179.844 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 372' ' ' SER . . . . . . . . . . . . . 47.8 t -59.51 -50.08 75.3 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.849 0.357 . . . . 0.0 110.972 179.904 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 373' ' ' MET . . . . . . . . . . . . . 83.8 mtp -67.1 -34.64 78.07 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.48 -179.749 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 374' ' ' ALA . . . . . . . . . . . . . . . -83.66 -12.69 55.61 Favored 'General case' 0 C--N 1.33 -0.267 0 N-CA-C 112.161 0.43 . . . . 0.0 112.161 -179.239 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 375' ' ' ARG . . . . . . . . . . . . . 27.4 tpt180 -108.74 -13.05 14.85 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.75 0.309 . . . . 0.0 111.059 -179.757 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 376' ' ' GLN . . . . . 0.541 ' HB3' ' HG3' ' B' ' 381' ' ' PRO . 34.2 tt0 -72.37 3.08 5.1 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 121.002 0.43 . . . . 0.0 110.573 179.764 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 377' ' ' ARG . . . . . 0.568 ' HG2' ' HA ' ' B' ' 381' ' ' PRO . 80.8 mtm180 -55.59 -34.14 64.55 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.903 179.896 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 378' ' ' ARG . . . . . . . . . . . . . 38.9 mmt180 -118.46 -39.22 3.04 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.08 -179.782 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 379' ' ' ALA . . . . . . . . . . . . . . . -79.3 168.75 19.11 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.369 -179.848 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 380' ' ' SER . . . . . . . . . . . . . 73.6 p . . . . . 0 C--O 1.25 1.094 0 CA-C-O 118.132 -0.937 . . . . 0.0 110.941 -179.993 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' B' B ' 295' ' ' SER . . . . . . . . . . . . . 49.3 m . . . . . 0 N--CA 1.485 1.318 0 CA-C-O 120.749 0.309 . . . . 0.0 110.94 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' B' B ' 296' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -87.92 -10.07 51.72 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.126 -179.975 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 297' ' ' GLN . . . . . . . . . . . . . 46.8 mt-30 -83.66 169.27 15.49 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.372 -0.376 . . . . 0.0 110.985 -179.915 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 298' ' ' ASN . . . . . . . . . . . . . 8.3 p30 -144.5 6.81 1.28 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.121 -0.49 . . . . 0.0 111.04 -179.872 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 299' ' ' ASN . . . . . . . . . . . . . 3.6 p30 -141.24 101.49 4.03 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.978 -179.886 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 300' ' ' GLN . . . . . 0.573 ' HB2' ' HD3' ' B' ' 301' ' ' PRO . 73.6 mt-30 -110.77 -51.03 0.06 OUTLIER Pre-proline 0 CA--C 1.534 0.361 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.576 179.978 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 301' ' ' PRO . . . . . 0.573 ' HD3' ' HB2' ' B' ' 300' ' ' GLN . 79.8 Cg_endo -87.81 27.76 0.53 Allowed 'Trans proline' 0 C--N 1.352 0.742 0 C-N-CA 122.301 2.001 . . . . 0.0 112.057 179.764 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 302' ' ' VAL . . . . . . . . . . . . . 12.8 p -55.59 -17.7 3.66 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-N 116.031 -0.531 . . . . 0.0 111.689 -179.47 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 303' ' ' GLU . . . . . . . . . . . . . 44.2 mt-10 -56.8 -87.35 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.404 -0.362 . . . . 0.0 111.638 -179.461 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 304' ' ' PHE . . . . . . . . . . . . . 42.6 p90 -65.61 -21.12 66.55 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.319 -0.401 . . . . 0.0 111.722 -179.176 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 305' ' ' ASN . . . . . . . . . . . . . 6.2 t30 -68.37 -64.68 0.82 Allowed 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.777 0.322 . . . . 0.0 111.032 -179.744 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 306' ' ' HIS . . . . . . . . . . . . . 18.8 t-160 -64.74 -34.44 78.32 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.3 -179.435 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 307' ' ' ALA . . . . . . . . . . . . . . . -64.43 -59.54 4.22 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.497 -0.32 . . . . 0.0 111.456 -179.736 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 308' ' ' ILE . . . . . . . . . . . . . 94.5 mt -56.98 -49.51 79.07 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 CA-C-N 116.53 -0.305 . . . . 0.0 111.406 -179.796 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 309' ' ' ASN . . . . . . . . . . . . . 3.6 m-20 -55.55 -40.93 72.54 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.809 0.338 . . . . 0.0 110.812 179.832 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 310' ' ' TYR . . . . . 0.454 ' O ' HG12 ' B' ' 314' ' ' ILE . 84.1 t80 -62.5 -64.24 0.98 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.902 -179.99 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 311' ' ' VAL . . . . . . . . . . . . . 55.4 t -52.84 -24.03 6.29 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.221 0 CA-C-O 120.873 0.368 . . . . 0.0 110.894 179.986 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 312' ' ' ASN . . . . . . . . . . . . . 44.2 t30 -69.89 -56.82 6.05 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.066 179.855 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 313' ' ' LYS . . . . . 0.435 ' HD3' ' N ' ' B' ' 314' ' ' ILE . 0.0 OUTLIER -66.28 -23.55 66.41 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-O 120.775 0.322 . . . . 0.0 111.152 -179.907 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 314' ' ' ILE . . . . . 0.454 HG12 ' O ' ' B' ' 310' ' ' TYR . 31.2 mm -74.65 -43.55 47.57 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 116.392 -0.367 . . . . 0.0 110.754 179.805 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 315' ' ' LYS . . . . . . . . . . . . . 25.5 ttpp -73.42 -27.64 61.55 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.785 179.84 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 316' ' ' ASN . . . . . . . . . . . . . 30.6 t30 -74.32 -50.48 18.61 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.958 179.885 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 317' ' ' ARG . . . . . . . . . . . . . 27.3 mmm180 -61.64 -53.64 53.49 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.142 179.979 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 318' ' ' PHE . . . . . . . . . . . . . 75.6 m-85 -90.77 31.62 1.05 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.082 -179.847 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 319' ' ' GLN . . . . . . . . . . . . . 35.3 tt0 -61.91 -25.64 67.69 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.851 179.936 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 320' ' ' GLY . . . . . . . . . . . . . . . -94.48 -18.38 35.93 Favored Glycine 0 N--CA 1.451 -0.361 0 C-N-CA 120.858 -0.687 . . . . 0.0 112.455 179.971 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 321' ' ' GLN . . . . . . . . . . . . . 8.7 tp-100 -109.83 91.47 10.8 Favored Pre-proline 0 C--N 1.33 -0.273 0 CA-C-O 120.437 0.16 . . . . 0.0 110.731 179.947 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 322' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_endo -76.26 -12.73 19.07 Favored 'Trans proline' 0 C--N 1.348 0.515 0 C-N-CA 122.552 2.168 . . . . 0.0 112.548 -179.891 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 323' ' ' ASP . . . . . . . . . . . . . 20.2 t70 -70.82 -56.32 6.58 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.19 -179.854 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 324' ' ' ILE . . . . . . . . . . . . . 62.1 mt -62.44 -40.63 88.79 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.222 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.096 -179.868 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 325' ' ' TYR . . . . . 0.422 ' CE2' HD11 ' B' ' 329' ' ' LEU . 35.0 t80 -63.22 -48.64 77.42 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.589 179.767 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 326' ' ' LYS . . . . . . . . . . . . . 41.0 ttmt -60.55 -37.3 80.79 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.706 179.887 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 327' ' ' ALA . . . . . . . . . . . . . . . -62.1 -54.48 40.69 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.133 179.941 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 328' ' ' PHE . . . . . . . . . . . . . 62.7 t80 -53.62 -45.55 70.14 Favored 'General case' 0 C--O 1.234 0.275 0 CA-C-O 121.008 0.432 . . . . 0.0 110.501 179.899 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 329' ' ' LEU . . . . . 0.646 HD13 ' HG3' ' A' ' 362' ' ' MET . 92.1 mt -59.21 -43.34 92.3 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.868 -0.606 . . . . 0.0 110.645 179.56 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 330' ' ' GLU . . . . . . . . . . . . . 40.6 mt-10 -59.64 -37.79 79.65 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.763 179.713 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 331' ' ' ILE . . . . . . . . . . . . . 76.1 mt -63.47 -56.6 16.08 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.806 179.728 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 332' ' ' LEU . . . . . 0.41 HD23 HD22 ' A' ' 370' ' ' LEU . 7.3 mp -66.28 -19.19 65.75 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.257 -179.984 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 333' ' ' HIS . . . . . . . . . . . . . 34.6 t-80 -71.61 -59.52 2.71 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 121.031 0.443 . . . . 0.0 110.09 179.284 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 334' ' ' THR . . . . . . . . . . . . . 88.7 m -62.41 -29.77 70.74 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.049 179.21 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 335' ' ' TYR . . . . . . . . . . . . . 69.8 t80 -69.14 -41.55 77.18 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 115.729 -0.669 . . . . 0.0 110.488 179.461 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 336' ' ' GLN . . . . . 0.433 ' HB2' ' HB ' ' A' ' 369' ' ' VAL . 26.3 tt0 -68.23 -33.38 74.3 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.693 -179.993 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 337' ' ' LYS . . . . . 0.558 ' O ' ' HG2' ' B' ' 340' ' ' ARG . 1.0 OUTLIER -72.96 -47.95 40.99 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.885 -179.976 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 338' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -65.78 -28.27 68.89 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.034 0.445 . . . . 0.0 109.873 179.434 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 339' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -73.83 -49.39 25.4 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 115.716 -0.675 . . . . 0.0 110.497 179.407 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 340' ' ' ARG . . . . . 0.572 ' HG3' ' N ' ' B' ' 341' ' ' ASN . 14.9 ptm180 -56.46 -51.83 66.97 Favored 'General case' 0 C--N 1.333 -0.138 0 CA-C-O 121.078 0.466 . . . . 0.0 110.742 -179.838 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 341' ' ' ASN . . . . . 0.572 ' N ' ' HG3' ' B' ' 340' ' ' ARG . 65.7 t30 -58.72 -47.66 83.82 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.62 -0.718 . . . . 0.0 110.732 179.387 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 342' ' ' ALA . . . . . . . . . . . . . . . -63.79 -23.08 67.22 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.022 179.788 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 343' ' ' LYS . . . . . . . . . . . . . 88.0 tttt -78.77 -39.06 37.04 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.799 179.924 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 344' ' ' GLU . . . . . . . . . . . . . 7.0 mm-40 -75.64 -26.97 58.19 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.831 179.829 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 345' ' ' ALA . . . . . . . . . . . . . . . -64.93 -40.17 94.63 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.042 -0.526 . . . . 0.0 111.029 -179.905 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 346' ' ' GLY . . . . . . . . . . . . . . . 87.53 -36.39 3.35 Favored Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.692 -0.766 . . . . 0.0 112.361 -179.86 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 347' ' ' GLY . . . . . . . . . . . . . . . 176.71 179.17 47.0 Favored Glycine 0 N--CA 1.451 -0.35 0 C-N-CA 120.721 -0.752 . . . . 0.0 112.572 179.959 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 348' ' ' ASN . . . . . . . . . . . . . 14.5 t-20 58.89 20.03 7.66 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.898 0.38 . . . . 0.0 110.952 179.842 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 349' ' ' TYR . . . . . . . . . . . . . 57.7 t80 -120.19 136.82 54.5 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.853 -179.867 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 350' ' ' THR . . . . . . . . . . . . . 27.5 m -105.7 106.26 55.83 Favored Pre-proline 0 C--N 1.33 -0.28 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.819 179.998 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 351' ' ' PRO . . . . . . . . . . . . . 34.9 Cg_exo -58.09 177.36 0.27 Allowed 'Trans proline' 0 C--N 1.348 0.542 0 C-N-CA 122.485 2.124 . . . . 0.0 112.638 -179.813 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 352' ' ' ALA . . . . . . . . . . . . . . . -98.27 -73.57 0.61 Allowed 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.453 -179.751 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 353' ' ' LEU . . . . . 0.514 HD22 ' HG2' ' B' ' 357' ' ' GLU . 40.6 mt -99.25 133.32 43.71 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.934 0.397 . . . . 0.0 111.15 -179.778 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 354' ' ' THR . . . . . . . . . . . . . 57.6 p -104.08 -178.31 3.62 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.791 179.842 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 355' ' ' GLU . . . . . . . . . . . . . 41.4 mt-10 -60.65 -39.53 88.67 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.833 0.349 . . . . 0.0 110.786 179.914 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 356' ' ' GLN . . . . . . . . . . . . . 29.1 mm-40 -70.57 -38.82 74.14 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.0 -179.961 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 357' ' ' GLU . . . . . 0.514 ' HG2' HD22 ' B' ' 353' ' ' LEU . 9.6 tp10 -61.55 -49.37 76.94 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.41 -0.359 . . . . 0.0 110.55 179.999 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 358' ' ' VAL . . . . . 0.49 ' O ' HG23 ' B' ' 362' ' ' VAL . 53.3 t -61.42 -56.67 16.29 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.94 179.688 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 359' ' ' TYR . . . . . . . . . . . . . 2.8 t80 -53.96 -30.36 46.47 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.445 -0.343 . . . . 0.0 110.788 -179.802 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 360' ' ' ALA . . . . . . . . . . . . . . . -66.92 -60.42 2.66 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.165 179.821 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 361' ' ' GLN . . . . . . . . . . . . . 47.0 mt-30 -57.46 -39.01 75.41 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.477 179.865 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 362' ' ' VAL . . . . . 0.49 HG23 ' O ' ' B' ' 358' ' ' VAL . 94.2 t -66.53 -33.72 65.34 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.198 179.298 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 363' ' ' ALA . . . . . 0.554 ' HA ' HD21 ' B' ' 373' ' ' LEU . . . -63.85 -43.1 97.16 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.174 179.264 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 364' ' ' ARG . . . . . . . . . . . . . 9.6 mpt_? -80.06 -17.45 52.66 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.811 -0.631 . . . . 0.0 110.161 178.896 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 365' ' ' LEU . . . . . . . . . . . . . 14.1 tp -68.78 -40.76 79.51 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.787 -0.642 . . . . 0.0 111.226 -179.917 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 366' ' ' PHE . . . . . 0.682 ' HB3' ' HB2' ' B' ' 369' ' ' GLN . 32.8 m-85 -106.4 -29.84 9.49 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.438 -0.346 . . . . 0.0 111.393 -179.522 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 367' ' ' LYS . . . . . . . . . . . . . 92.0 mttt 54.01 -96.62 0.06 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.209 -0.451 . . . . 0.0 112.19 179.892 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 368' ' ' ASN . . . . . . . . . . . . . 18.5 m120 -54.75 -46.4 74.32 Favored 'General case' 0 N--CA 1.462 0.139 0 CA-C-N 116.541 -0.299 . . . . 0.0 111.561 -179.192 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 369' ' ' GLN . . . . . 0.682 ' HB2' ' HB3' ' B' ' 366' ' ' PHE . 2.1 mp0 -66.4 97.92 0.45 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.429 -0.35 . . . . 0.0 111.035 -179.778 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 370' ' ' GLU . . . . . . . . . . . . . 43.9 tt0 -93.69 -17.8 22.82 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.97 179.907 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 371' ' ' ASP . . . . . . . . . . . . . 6.9 m-20 -54.78 -45.35 74.27 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.31 -0.404 . . . . 0.0 110.676 179.81 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 372' ' ' LEU . . . . . 0.561 HD13 ' HB3' ' B' ' 369' ' ' GLN . 6.4 mp -64.85 -41.83 95.39 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.505 179.51 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 373' ' ' LEU . . . . . 0.554 HD21 ' HA ' ' B' ' 363' ' ' ALA . 1.1 mp -61.13 -32.2 71.9 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.808 179.842 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 374' ' ' SER . . . . . . . . . . . . . 56.0 m -71.61 -52.13 19.67 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.036 179.28 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 375' ' ' GLU . . . . . . . . . . . . . 7.7 tp10 -58.05 -33.05 68.59 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 115.732 -0.667 . . . . 0.0 109.898 179.279 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 376' ' ' PHE . . . . . . . . . . . . . 54.0 t80 -79.4 -27.81 41.81 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.736 -0.665 . . . . 0.0 109.906 179.263 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 377' ' ' GLY . . . . . . . . . . . . . . . -64.29 -41.2 98.32 Favored Glycine 0 N--CA 1.448 -0.546 0 C-N-CA 120.673 -0.775 . . . . 0.0 111.317 179.076 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 378' ' ' GLN . . . . . . . . . . . . . 46.1 mt-30 -71.63 -23.44 61.69 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.915 0.388 . . . . 0.0 110.144 179.095 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 379' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -62.33 -31.8 72.48 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-N 115.813 -0.631 . . . . 0.0 110.576 179.407 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 380' ' ' LEU . . . . . . . . . . . . . 39.8 mt -61.92 147.57 89.58 Favored Pre-proline 0 C--N 1.33 -0.28 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.714 -179.964 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 381' ' ' PRO . . . . . 0.568 ' HA ' ' HG2' ' A' ' 377' ' ' ARG . 52.1 Cg_exo -52.83 135.5 57.6 Favored 'Trans proline' 0 C--N 1.347 0.456 0 C-N-CA 122.391 2.061 . . . . 0.0 112.333 179.946 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 382' ' ' ASP . . . . . 0.487 ' H ' ' HG2' ' A' ' 377' ' ' ARG . 7.8 m-20 -93.35 130.01 39.26 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.308 -0.405 . . . . 0.0 110.958 179.972 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 383' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.045 0 CA-C-O 118.231 -0.89 . . . . 0.0 111.116 -179.861 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 358' ' ' ASP . . . . . . . . . . . . . 18.4 t70 . . . . . 0 N--CA 1.486 1.335 0 CA-C-O 120.761 0.315 . . . . 0.0 110.814 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 359' ' ' PHE . . . . . . . . . . . . . 72.3 t80 -140.08 148.3 41.53 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.803 -179.981 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 360' ' ' THR . . . . . 0.637 ' HB ' ' HD3' ' A' ' 361' ' ' PRO . 66.5 m -155.83 -52.58 0.02 OUTLIER Pre-proline 0 CA--C 1.533 0.31 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.667 179.802 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 361' ' ' PRO . . . . . 0.637 ' HD3' ' HB ' ' A' ' 360' ' ' THR . 73.0 Cg_endo -87.09 129.6 2.87 Favored 'Trans proline' 0 C--N 1.352 0.753 0 C-N-CA 122.204 1.936 . . . . 0.0 112.821 -179.783 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 362' ' ' MET . . . . . 0.469 ' SD ' HD23 ' B' ' 329' ' ' LEU . 4.0 tpt -58.32 -68.61 0.24 Allowed 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.553 179.436 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 363' ' ' ASP . . . . . . . . . . . . . 21.7 t70 -175.82 31.93 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.866 -0.606 . . . . 0.0 110.081 179.907 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 364' ' ' SER . . . . . . . . . . . . . 31.5 t 62.38 38.22 13.13 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.577 -179.697 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 365' ' ' SER . . . . . . . . . . . . . 49.0 m -140.28 -63.21 0.49 Allowed 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.226 -179.818 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 366' ' ' ALA . . . . . . . . . . . . . . . -57.53 -43.82 84.63 Favored 'General case' 0 C--O 1.233 0.223 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.618 -179.628 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 367' ' ' VAL . . . . . . . . . . . . . 35.7 m -54.88 -35.14 32.84 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.925 179.904 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 368' ' ' TYR . . . . . . . . . . . . . 68.7 m-85 -71.04 -24.24 62.31 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.487 179.531 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 369' ' ' VAL . . . . . 0.592 HG22 ' HB2' ' B' ' 336' ' ' GLN . 6.7 t -73.03 -57.73 6.37 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.195 179.383 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 370' ' ' LEU . . . . . 0.478 ' H ' HD22 ' A' ' 370' ' ' LEU . 3.2 mm? -58.56 -37.91 76.74 Favored 'General case' 0 C--O 1.233 0.201 0 CA-C-N 115.763 -0.653 . . . . 0.0 110.443 179.793 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 371' ' ' SER . . . . . 0.641 ' HA ' ' HB2' ' B' ' 303' ' ' GLU . 99.0 p -63.53 -55.87 20.5 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.901 179.928 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 372' ' ' SER . . . . . . . . . . . . . 91.4 p -54.48 -34.37 61.44 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.3 -179.806 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 373' ' ' MET . . . . . . . . . . . . . 56.6 mtt -66.69 -52.26 46.78 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.522 -179.971 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 374' ' ' ALA . . . . . 0.43 ' HB3' ' HB3' ' B' ' 303' ' ' GLU . . . -81.6 -6.74 59.29 Favored 'General case' 0 C--N 1.331 -0.236 0 N-CA-C 112.387 0.514 . . . . 0.0 112.387 -178.973 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 375' ' ' ARG . . . . . . . . . . . . . 18.7 mmt180 -94.82 -42.58 8.63 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.81 0.338 . . . . 0.0 111.164 179.88 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 376' ' ' GLN . . . . . . . . . . . . . 44.2 tt0 -83.32 35.35 0.49 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.046 -0.524 . . . . 0.0 111.077 -179.579 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 377' ' ' ARG . . . . . 0.516 ' HG2' ' HA ' ' B' ' 381' ' ' PRO . 73.0 mtp180 -78.78 4.23 14.47 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.344 -0.389 . . . . 0.0 111.094 179.931 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 378' ' ' ARG . . . . . . . . . . . . . 21.3 tpp180 -99.04 -25.61 14.5 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.308 -0.405 . . . . 0.0 110.906 -179.957 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 379' ' ' ALA . . . . . . . . . . . . . . . -65.98 144.97 56.42 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.145 -179.962 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 380' ' ' SER . . . . . . . . . . . . . 46.6 t . . . . . 0 C--O 1.25 1.108 0 CA-C-O 118.285 -0.864 . . . . 0.0 111.052 -179.902 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' B' B ' 295' ' ' SER . . . . . . . . . . . . . 39.1 t . . . . . 0 N--CA 1.487 1.383 0 CA-C-O 120.853 0.358 . . . . 0.0 110.961 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' B' B ' 296' ' ' LEU . . . . . 0.572 ' N ' HD13 ' B' ' 296' ' ' LEU . 0.0 OUTLIER -134.03 9.5 3.83 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.132 -0.486 . . . . 0.0 111.122 -179.878 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' B' B ' 297' ' ' GLN . . . . . 0.447 ' HG2' ' H ' ' B' ' 299' ' ' ASN . 33.2 tt0 -82.56 156.79 23.78 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.869 179.922 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 298' ' ' ASN . . . . . . . . . . . . . 18.8 m120 -138.91 -0.17 1.91 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.212 -179.988 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 299' ' ' ASN . . . . . 0.447 ' H ' ' HG2' ' B' ' 297' ' ' GLN . 19.8 m120 -66.59 -49.03 67.67 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.458 -0.337 . . . . 0.0 110.742 179.918 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 300' ' ' GLN . . . . . . . . . . . . . 48.1 mt-30 -77.76 159.71 75.95 Favored Pre-proline 0 C--N 1.33 -0.265 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.656 179.583 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 301' ' ' PRO . . . . . 0.48 ' HB2' ' HB3' ' B' ' 304' ' ' PHE . 89.0 Cg_exo -46.99 156.31 0.72 Allowed 'Trans proline' 0 C--N 1.351 0.696 0 C-N-CA 122.601 2.201 . . . . 0.0 112.373 179.908 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 302' ' ' VAL . . . . . 0.571 HG13 ' H ' ' B' ' 303' ' ' GLU . 2.7 p -90.76 -58.12 3.78 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-N 116.439 -0.346 . . . . 0.0 111.761 -179.409 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 303' ' ' GLU . . . . . 0.641 ' HB2' ' HA ' ' A' ' 371' ' ' SER . 0.1 OUTLIER -62.13 -29.71 70.52 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.404 -0.362 . . . . 0.0 111.769 -179.058 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' B' B ' 304' ' ' PHE . . . . . 0.48 ' HB3' ' HB2' ' B' ' 301' ' ' PRO . 67.3 t80 -63.0 -71.33 0.17 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.77 0.319 . . . . 0.0 111.188 -179.648 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 305' ' ' ASN . . . . . . . . . . . . . 27.2 t-20 -53.68 -42.86 68.39 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.582 -179.413 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 306' ' ' HIS . . . . . . . . . . . . . 8.5 m-70 -62.53 -67.7 0.4 Allowed 'General case' 0 C--N 1.331 -0.22 0 N-CA-C 112.083 0.401 . . . . 0.0 112.083 -179.225 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 307' ' ' ALA . . . . . . . . . . . . . . . -49.89 -52.74 30.59 Favored 'General case' 0 N--CA 1.465 0.289 0 N-CA-C 112.331 0.493 . . . . 0.0 112.331 -178.905 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 308' ' ' ILE . . . . . 0.443 HD13 ' O ' ' B' ' 304' ' ' PHE . 1.7 mp -54.93 -58.96 2.79 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-O 120.595 0.236 . . . . 0.0 111.439 -179.617 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 309' ' ' ASN . . . . . . . . . . . . . 14.1 m120 -61.52 -19.4 62.07 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.546 -0.297 . . . . 0.0 111.265 -179.646 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 310' ' ' TYR . . . . . . . . . . . . . 24.0 t80 -74.95 -57.28 4.0 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.416 -0.356 . . . . 0.0 111.326 -179.479 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 311' ' ' VAL . . . . . . . . . . . . . 5.8 m -63.19 -33.69 62.42 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.203 0 CA-C-O 120.87 0.367 . . . . 0.0 110.639 -179.818 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 312' ' ' ASN . . . . . . . . . . . . . 6.3 t30 -70.11 -42.88 72.09 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.585 179.751 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 313' ' ' LYS . . . . . . . . . . . . . 4.5 ttmm -60.23 -49.57 77.11 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.035 179.807 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 314' ' ' ILE . . . . . . . . . . . . . 75.8 mt -64.6 -39.59 86.12 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.658 -179.43 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 315' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -65.51 -40.2 92.72 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.744 0.307 . . . . 0.0 111.095 -179.714 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 316' ' ' ASN . . . . . . . . . . . . . 28.2 t-20 -68.77 -51.35 42.06 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.321 -0.399 . . . . 0.0 111.355 -179.479 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 317' ' ' ARG . . . . . 0.569 HH22 HD11 ' B' ' 372' ' ' LEU . 35.7 mtm180 -59.99 -59.08 6.0 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.384 -0.371 . . . . 0.0 111.071 -179.91 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 318' ' ' PHE . . . . . . . . . . . . . 95.1 m-85 -87.65 40.87 0.96 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.917 -179.97 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 319' ' ' GLN . . . . . . . . . . . . . 63.3 tt0 -59.5 -33.64 71.6 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.972 -179.875 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 320' ' ' GLY . . . . . . . . . . . . . . . -80.27 -14.32 80.53 Favored Glycine 0 N--CA 1.452 -0.256 0 C-N-CA 120.853 -0.689 . . . . 0.0 112.261 179.735 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 321' ' ' GLN . . . . . . . . . . . . . 6.1 tp-100 -118.07 83.29 19.18 Favored Pre-proline 0 C--N 1.329 -0.315 0 CA-C-O 120.528 0.204 . . . . 0.0 110.802 -179.998 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 322' ' ' PRO . . . . . . . . . . . . . 76.5 Cg_endo -77.71 -10.17 17.06 Favored 'Trans proline' 0 C--N 1.346 0.404 0 C-N-CA 122.386 2.058 . . . . 0.0 112.338 179.844 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 323' ' ' ASP . . . . . . . . . . . . . 9.5 m-20 -70.08 -52.78 21.07 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.07 -0.514 . . . . 0.0 111.191 -179.742 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 324' ' ' ILE . . . . . . . . . . . . . 71.3 mt -63.89 -46.34 94.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.425 -0.352 . . . . 0.0 111.246 -179.904 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 325' ' ' TYR . . . . . . . . . . . . . 68.8 t80 -58.15 -58.27 9.21 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.155 179.982 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 326' ' ' LYS . . . . . . . . . . . . . 39.4 ttmt -56.95 -41.47 78.35 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.121 -179.728 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 327' ' ' ALA . . . . . . . . . . . . . . . -57.02 -48.29 78.85 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.907 0.384 . . . . 0.0 111.148 -179.997 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 328' ' ' PHE . . . . . . . . . . . . . 45.7 t80 -58.56 -53.87 53.43 Favored 'General case' 0 C--O 1.237 0.435 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.664 179.931 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 329' ' ' LEU . . . . . 0.469 HD23 ' SD ' ' A' ' 362' ' ' MET . 10.4 mp -60.82 -26.71 67.51 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.979 -179.844 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 330' ' ' GLU . . . . . . . . . . . . . 28.4 mt-10 -70.38 -42.32 71.89 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.852 0.358 . . . . 0.0 110.207 179.306 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 331' ' ' ILE . . . . . 0.509 HG22 HG22 ' B' ' 358' ' ' VAL . 93.8 mt -61.03 -48.03 90.92 Favored 'Isoleucine or valine' 0 C--O 1.233 0.224 0 CA-C-N 116.126 -0.488 . . . . 0.0 109.956 179.085 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 332' ' ' LEU . . . . . . . . . . . . . 10.8 mp -64.81 -33.66 76.52 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 115.813 -0.631 . . . . 0.0 110.512 179.427 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 333' ' ' HIS . . . . . . . . . . . . . 43.3 t60 -60.83 -54.15 48.67 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.057 -0.52 . . . . 0.0 109.956 179.297 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 334' ' ' THR . . . . . . . . . . . . . 62.8 m -61.35 -30.48 70.54 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.687 -0.688 . . . . 0.0 110.338 179.238 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 335' ' ' TYR . . . . . . . . . . . . . 67.8 t80 -60.62 -53.79 53.19 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.844 -0.617 . . . . 0.0 111.158 179.696 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 336' ' ' GLN . . . . . 0.592 ' HB2' HG22 ' A' ' 369' ' ' VAL . 6.4 tp-100 -65.89 -36.64 83.97 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.417 -0.356 . . . . 0.0 111.029 -179.928 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 337' ' ' LYS . . . . . . . . . . . . . 39.8 ttpt -57.89 -56.65 19.27 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.951 0.405 . . . . 0.0 110.995 179.9 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 338' ' ' GLU . . . . . 0.462 ' HG3' ' HB3' ' B' ' 352' ' ' ALA . 19.5 mm-40 -64.11 -36.25 83.42 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.037 -0.528 . . . . 0.0 111.289 -179.857 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 339' ' ' GLN . . . . . . . . . . . . . 6.5 tp-100 -61.0 -46.07 92.25 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.312 -0.403 . . . . 0.0 110.847 179.968 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 340' ' ' ARG . . . . . . . . . . . . . 96.6 mtt180 -63.87 -51.71 63.32 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.652 179.836 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 341' ' ' ASN . . . . . . . . . . . . . 74.9 m-20 -56.59 -33.44 66.21 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.8 179.706 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 342' ' ' ALA . . . . . . . . . . . . . . . -72.75 -37.05 67.82 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.011 179.885 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 343' ' ' LYS . . . . . . . . . . . . . 64.6 tttp -71.85 -28.07 63.31 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.978 -0.555 . . . . 0.0 110.497 179.803 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 344' ' ' GLU . . . . . . . . . . . . . 17.3 mm-40 -77.9 -41.32 36.95 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.912 -0.585 . . . . 0.0 110.788 179.681 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 345' ' ' ALA . . . . . . . . . . . . . . . -60.63 -32.94 72.08 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.272 179.898 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 346' ' ' GLY . . . . . . . . . . . . . . . 69.1 33.39 74.04 Favored Glycine 0 N--CA 1.451 -0.362 0 C-N-CA 120.712 -0.756 . . . . 0.0 112.387 -179.832 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 347' ' ' GLY . . . . . . . . . . . . . . . 113.07 176.88 19.58 Favored Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.825 -0.702 . . . . 0.0 112.441 -179.993 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 348' ' ' ASN . . . . . . . . . . . . . 63.9 t30 58.47 15.7 3.71 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.908 0.385 . . . . 0.0 111.045 179.965 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 349' ' ' TYR . . . . . . . . . . . . . 73.9 t80 -117.76 144.53 45.22 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.886 -179.954 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 350' ' ' THR . . . . . . . . . . . . . 38.0 m -120.64 97.66 48.48 Favored Pre-proline 0 C--N 1.329 -0.297 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.038 -179.865 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 351' ' ' PRO . . . . . . . . . . . . . 45.9 Cg_exo -56.5 159.26 13.81 Favored 'Trans proline' 0 C--N 1.348 0.529 0 C-N-CA 122.503 2.136 . . . . 0.0 112.325 179.869 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 352' ' ' ALA . . . . . 0.462 ' HB3' ' HG3' ' B' ' 338' ' ' GLU . . . -70.11 -76.95 0.09 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.133 179.993 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 353' ' ' LEU . . . . . 0.608 ' HB3' ' HG2' ' B' ' 357' ' ' GLU . 0.3 OUTLIER -107.32 154.85 20.66 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 121.095 0.474 . . . . 0.0 111.726 179.965 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' B' B ' 354' ' ' THR . . . . . . . . . . . . . 59.6 p -114.85 -172.91 2.21 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.871 -0.604 . . . . 0.0 110.767 179.586 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 355' ' ' GLU . . . . . . . . . . . . . 7.8 pt-20 -58.92 -42.73 90.4 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 121.309 0.576 . . . . 0.0 110.072 179.577 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 356' ' ' GLN . . . . . . . . . . . . . 28.9 tt0 -64.56 -38.37 90.77 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.394 -0.821 . . . . 0.0 110.97 179.656 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 357' ' ' GLU . . . . . 0.608 ' HG2' ' HB3' ' B' ' 353' ' ' LEU . 4.6 tp10 -61.21 -50.03 74.75 Favored 'General case' 0 C--N 1.333 -0.138 0 CA-C-O 120.807 0.337 . . . . 0.0 110.506 179.948 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 358' ' ' VAL . . . . . 0.59 ' O ' HG23 ' B' ' 362' ' ' VAL . 93.5 t -59.09 -60.55 2.25 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.069 -0.514 . . . . 0.0 111.014 179.991 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 359' ' ' TYR . . . . . . . . . . . . . 2.2 t80 -52.0 -33.44 38.21 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.521 -0.309 . . . . 0.0 111.014 -179.325 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 360' ' ' ALA . . . . . . . . . . . . . . . -65.58 -60.59 2.76 Favored 'General case' 0 C--O 1.234 0.246 0 CA-C-N 116.502 -0.317 . . . . 0.0 111.242 179.896 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 361' ' ' GLN . . . . . . . . . . . . . 92.3 mt-30 -58.15 -36.23 72.7 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.98 0.419 . . . . 0.0 110.414 179.923 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 362' ' ' VAL . . . . . 0.59 HG23 ' O ' ' B' ' 358' ' ' VAL . 66.1 t -70.64 -32.05 48.17 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 115.902 -0.59 . . . . 0.0 109.988 179.246 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 363' ' ' ALA . . . . . 0.576 ' HA ' HD21 ' B' ' 373' ' ' LEU . . . -65.16 -38.87 91.96 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 115.914 -0.585 . . . . 0.0 109.876 179.124 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 364' ' ' ARG . . . . . . . . . . . . . 31.8 ttm180 -80.85 -23.41 39.12 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.574 -0.739 . . . . 0.0 110.109 179.011 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 365' ' ' LEU . . . . . . . . . . . . . 8.3 tp -58.12 -24.84 60.22 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.826 -0.625 . . . . 0.0 110.185 179.523 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 366' ' ' PHE . . . . . 0.474 ' HB3' ' HB2' ' B' ' 369' ' ' GLN . 38.1 m-85 -129.07 179.85 5.52 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.742 -0.663 . . . . 0.0 110.423 179.708 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 367' ' ' LYS . . . . . . . . . . . . . 98.4 mttt -138.49 -80.61 0.33 Allowed 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.584 -0.28 . . . . 0.0 111.246 179.904 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 368' ' ' ASN . . . . . . . . . . . . . 28.0 p30 -79.96 7.67 8.5 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.275 -0.421 . . . . 0.0 110.887 -179.886 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 369' ' ' GLN . . . . . 0.709 ' HB3' HD13 ' B' ' 372' ' ' LEU . 44.5 mt-30 -103.38 91.67 4.16 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.022 -0.536 . . . . 0.0 111.436 -179.788 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 370' ' ' GLU . . . . . . . . . . . . . 42.5 mt-10 -94.54 -20.24 19.81 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.875 179.504 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 371' ' ' ASP . . . . . . . . . . . . . 23.5 t70 -59.09 -45.3 91.2 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.69 179.748 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 372' ' ' LEU . . . . . 0.709 HD13 ' HB3' ' B' ' 369' ' ' GLN . 6.6 mp -62.5 -51.82 65.91 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.731 179.593 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 373' ' ' LEU . . . . . 0.576 HD21 ' HA ' ' B' ' 363' ' ' ALA . 1.1 mp -55.88 -37.47 68.87 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.797 -0.638 . . . . 0.0 111.282 -179.749 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 374' ' ' SER . . . . . . . . . . . . . 70.1 m -69.25 -53.39 20.07 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.676 179.754 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 375' ' ' GLU . . . . . . . . . . . . . 39.4 mm-40 -52.56 -36.76 56.5 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.259 179.485 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 376' ' ' PHE . . . . . . . . . . . . . 91.8 t80 -70.24 -41.09 73.99 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.28 179.429 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 377' ' ' GLY . . . . . . . . . . . . . . . -60.2 -32.59 76.93 Favored Glycine 0 N--CA 1.45 -0.379 0 C-N-CA 120.768 -0.729 . . . . 0.0 112.086 179.536 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 378' ' ' GLN . . . . . . . . . . . . . 75.9 mt-30 -60.31 -29.73 69.04 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.798 0.332 . . . . 0.0 110.614 179.656 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 379' ' ' PHE . . . . . . . . . . . . . 75.1 m-85 -69.9 -34.53 73.64 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.789 179.733 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 380' ' ' LEU . . . . . 0.427 ' HA ' ' HD2' ' B' ' 381' ' ' PRO . 90.8 mt -51.51 113.37 3.93 Favored Pre-proline 0 C--N 1.332 -0.164 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.612 179.861 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 381' ' ' PRO . . . . . 0.516 ' HA ' ' HG2' ' A' ' 377' ' ' ARG . 16.0 Cg_endo -57.35 115.58 2.61 Favored 'Trans proline' 0 C--N 1.349 0.568 0 C-N-CA 122.312 2.008 . . . . 0.0 112.338 -179.726 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 382' ' ' ASP . . . . . . . . . . . . . 4.7 p-10 -136.91 136.7 38.86 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.878 179.85 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 383' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.05 0 CA-C-O 118.21 -0.9 . . . . 0.0 111.211 179.903 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 358' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 . . . . . 0 N--CA 1.486 1.335 0 CA-C-O 120.869 0.366 . . . . 0.0 110.878 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 359' ' ' PHE . . . . . . . . . . . . . 87.9 t80 -124.22 101.63 7.29 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.765 179.898 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 360' ' ' THR . . . . . 0.596 ' HB ' ' HD3' ' A' ' 361' ' ' PRO . 68.6 m -157.93 -49.69 0.01 OUTLIER Pre-proline 0 CA--C 1.534 0.35 0 CA-C-N 116.065 -0.516 . . . . 0.0 111.666 -179.86 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 361' ' ' PRO . . . . . 0.596 ' HD3' ' HB ' ' A' ' 360' ' ' THR . 31.5 Cg_exo -59.32 -50.06 9.35 Favored 'Trans proline' 0 C--N 1.353 0.794 0 C-N-CA 122.105 1.87 . . . . 0.0 112.286 179.837 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 362' ' ' MET . . . . . 0.703 ' HG2' HD13 ' B' ' 329' ' ' LEU . 0.6 OUTLIER -73.47 1.08 10.58 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.35 -179.705 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 363' ' ' ASP . . . . . . . . . . . . . 22.3 t70 -89.05 -5.91 57.53 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.933 0.397 . . . . 0.0 110.521 179.638 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 364' ' ' SER . . . . . . . . . . . . . 78.4 p -145.56 -5.22 0.65 Allowed 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.912 179.94 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 365' ' ' SER . . . . . . . . . . . . . 46.5 t -92.87 -67.7 0.84 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.785 179.958 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 366' ' ' ALA . . . . . . . . . . . . . . . -63.77 -23.26 67.29 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.911 179.866 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 367' ' ' VAL . . . . . . . . . . . . . 18.9 t -67.6 -21.27 27.28 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.788 179.891 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 368' ' ' TYR . . . . . . . . . . . . . 57.9 t80 -73.25 -48.99 30.26 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.977 -179.898 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 369' ' ' VAL . . . . . . . . . . . . . 14.6 m -70.11 -36.48 68.34 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.448 -179.782 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 370' ' ' LEU . . . . . 0.563 HD23 ' HA ' ' B' ' 307' ' ' ALA . 6.5 mp -69.35 -47.43 64.35 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.427 -0.352 . . . . 0.0 111.052 179.721 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 371' ' ' SER . . . . . 0.478 ' HB3' ' HB3' ' B' ' 303' ' ' GLU . 72.1 m -64.27 -38.84 92.48 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.294 -179.962 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 372' ' ' SER . . . . . . . . . . . . . 67.9 m -71.22 -61.33 1.81 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.475 -179.662 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 373' ' ' MET . . . . . 0.456 ' HB3' ' HD3' ' B' ' 381' ' ' PRO . 73.9 mtm -50.38 -41.06 51.3 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.626 -179.459 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 374' ' ' ALA . . . . . . . . . . . . . . . -73.01 -41.8 63.89 Favored 'General case' 0 C--N 1.331 -0.223 0 N-CA-C 112.008 0.373 . . . . 0.0 112.008 -179.426 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 375' ' ' ARG . . . . . 0.417 ' HB2' ' HG2' ' B' ' 303' ' ' GLU . 30.3 tpt180 -70.29 -23.08 62.8 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.692 0.282 . . . . 0.0 111.395 -179.55 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 376' ' ' GLN . . . . . . . . . . . . . 85.4 mm-40 -89.45 13.14 14.48 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.424 -0.353 . . . . 0.0 111.119 -179.768 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 377' ' ' ARG . . . . . . . . . . . . . 73.8 ttt180 -71.02 -65.77 0.7 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.889 -179.971 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 378' ' ' ARG . . . . . . . . . . . . . 40.5 ttm180 -154.06 -78.47 0.1 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.251 -0.432 . . . . 0.0 111.099 -179.738 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 379' ' ' ALA . . . . . . . . . . . . . . . -149.76 -26.88 0.26 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.101 -179.869 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 380' ' ' SER . . . . . . . . . . . . . 49.0 m . . . . . 0 C--O 1.248 1.011 0 CA-C-O 118.31 -0.852 . . . . 0.0 111.08 179.936 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' B' B ' 295' ' ' SER . . . . . . . . . . . . . 47.3 t . . . . . 0 N--CA 1.485 1.306 0 CA-C-O 120.852 0.358 . . . . 0.0 110.964 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' B' B ' 296' ' ' LEU . . . . . . . . . . . . . 85.9 mt -131.54 -21.23 2.54 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.901 -179.985 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 297' ' ' GLN . . . . . . . . . . . . . 81.9 mm-40 -74.09 159.05 33.16 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.898 -179.887 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 298' ' ' ASN . . . . . . . . . . . . . 7.7 p30 -128.81 175.68 8.43 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.93 179.958 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 299' ' ' ASN . . . . . . . . . . . . . 27.3 t-20 -103.83 123.33 46.9 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.101 -179.907 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 300' ' ' GLN . . . . . . . . . . . . . 16.0 mm100 -117.55 109.97 41.23 Favored Pre-proline 0 C--N 1.33 -0.27 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.813 179.973 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 301' ' ' PRO . . . . . . . . . . . . . 50.2 Cg_exo -53.44 159.53 6.12 Favored 'Trans proline' 0 C--N 1.351 0.662 0 C-N-CA 122.295 1.997 . . . . 0.0 112.159 179.789 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 302' ' ' VAL . . . . . . . . . . . . . 15.0 p -92.01 -24.27 5.48 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.178 -179.797 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 303' ' ' GLU . . . . . 0.478 ' HB3' ' HB3' ' A' ' 371' ' ' SER . 44.2 mt-10 -57.88 -78.77 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.974 -0.557 . . . . 0.0 111.647 -179.661 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 304' ' ' PHE . . . . . . . . . . . . . 64.7 m-85 -59.06 -31.55 68.97 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.898 -0.592 . . . . 0.0 111.914 -179.217 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 305' ' ' ASN . . . . . . . . . . . . . 26.9 t-20 -62.95 -71.4 0.16 Allowed 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.672 0.272 . . . . 0.0 111.57 -179.417 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 306' ' ' HIS . . . . . . . . . . . . . 4.3 t-160 -53.99 -41.1 67.55 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.36 -0.382 . . . . 0.0 111.509 -179.116 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 307' ' ' ALA . . . . . 0.563 ' HA ' HD23 ' A' ' 370' ' ' LEU . . . -60.72 -54.99 38.53 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.473 -0.33 . . . . 0.0 111.679 -179.564 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 308' ' ' ILE . . . . . . . . . . . . . 21.2 mm -57.09 -52.34 57.46 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.195 0 CA-C-N 116.662 -0.245 . . . . 0.0 111.407 -179.736 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 309' ' ' ASN . . . . . . . . . . . . . 28.5 m-80 -55.52 -34.65 64.85 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.473 -0.331 . . . . 0.0 111.211 -179.74 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 310' ' ' TYR . . . . . . . . . . . . . 80.6 t80 -66.5 -56.54 10.41 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.424 -0.353 . . . . 0.0 111.109 179.971 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 311' ' ' VAL . . . . . . . . . . . . . 61.5 t -56.14 -49.07 77.98 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.213 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.129 -179.832 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 312' ' ' ASN . . . . . . . . . . . . . 28.0 t-20 -61.99 -39.12 91.12 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.77 179.896 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 313' ' ' LYS . . . . . . . . . . . . . 42.9 tttp -55.12 -61.16 2.5 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.687 179.846 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 314' ' ' ILE . . . . . . . . . . . . . 98.2 mt -62.48 -28.07 44.0 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.077 -0.51 . . . . 0.0 111.177 -179.9 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 315' ' ' LYS . . . . . . . . . . . . . 1.6 tmmt? -67.21 -33.84 76.24 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.356 -0.383 . . . . 0.0 110.973 -179.851 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 316' ' ' ASN . . . . . . . . . . . . . 7.1 t30 -87.56 -50.45 6.51 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.454 -179.76 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 317' ' ' ARG . . . . . . . . . . . . . 29.3 mmm180 -57.75 -57.49 12.53 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.088 -179.728 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 318' ' ' PHE . . . . . . . . . . . . . 44.0 m-85 -88.41 39.54 0.91 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.944 -179.913 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 319' ' ' GLN . . . . . . . . . . . . . 51.7 tt0 -65.74 -18.04 65.05 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.594 179.815 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 320' ' ' GLY . . . . . . . . . . . . . . . -91.82 -9.62 62.39 Favored Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.845 -0.693 . . . . 0.0 112.547 -179.979 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 321' ' ' GLN . . . . . . . . . . . . . 15.5 mp0 -112.42 88.06 10.37 Favored Pre-proline 0 C--N 1.33 -0.25 0 CA-C-O 120.582 0.23 . . . . 0.0 110.877 179.777 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 322' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_endo -77.35 -33.6 2.44 Favored 'Trans proline' 0 C--N 1.347 0.473 0 C-N-CA 122.537 2.158 . . . . 0.0 112.414 -179.976 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 323' ' ' ASP . . . . . . . . . . . . . 5.2 m-20 -65.46 -56.26 13.43 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.13 -0.487 . . . . 0.0 111.167 -179.761 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 324' ' ' ILE . . . . . . . . . . . . . 53.3 mt -59.28 -53.27 50.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.455 -179.713 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 325' ' ' TYR . . . . . 0.458 ' CE2' HD11 ' B' ' 329' ' ' LEU . 16.8 t80 -54.01 -47.07 71.89 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.886 -179.832 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 326' ' ' LYS . . . . . . . . . . . . . 61.7 tttm -60.09 -40.8 90.86 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.879 -179.953 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 327' ' ' ALA . . . . . . . . . . . . . . . -59.02 -53.02 63.14 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.157 -179.88 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 328' ' ' PHE . . . . . . . . . . . . . 84.0 t80 -54.66 -52.36 62.57 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.785 179.962 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 329' ' ' LEU . . . . . 0.703 HD13 ' HG2' ' A' ' 362' ' ' MET . 77.3 mt -55.09 -39.17 69.03 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.986 -179.891 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 330' ' ' GLU . . . . . . . . . . . . . 16.4 mm-40 -63.81 -39.47 94.31 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.782 179.884 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 331' ' ' ILE . . . . . . . . . . . . . 90.4 mt -61.36 -45.71 98.06 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.17 0 CA-C-N 116.31 -0.405 . . . . 0.0 110.402 179.278 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 332' ' ' LEU . . . . . . . . . . . . . 7.7 mp -64.74 -34.7 78.93 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.867 179.533 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 333' ' ' HIS . . . . . . . . . . . . . 59.7 t-80 -62.09 -49.35 76.27 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.994 0.426 . . . . 0.0 110.111 179.502 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 334' ' ' THR . . . . . . . . . . . . . 53.1 m -63.09 -39.37 94.5 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.306 179.404 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 335' ' ' TYR . . . . . . . . . . . . . 55.7 t80 -62.72 -32.74 73.91 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.822 -0.626 . . . . 0.0 110.097 179.356 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 336' ' ' GLN . . . . . . . . . . . . . 60.7 tt0 -70.43 -45.5 65.74 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.593 -0.731 . . . . 0.0 110.64 179.808 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 337' ' ' LYS . . . . . . . . . . . . . 41.4 ttmt -60.88 -40.5 93.24 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.055 179.976 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 338' ' ' GLU . . . . . . . . . . . . . 20.8 mm-40 -67.29 -49.07 65.7 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.447 -179.753 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 339' ' ' GLN . . . . . . . . . . . . . 15.8 mm100 -61.06 -47.36 86.72 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.527 -0.306 . . . . 0.0 111.211 -179.85 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 340' ' ' ARG . . . . . . . . . . . . . 82.7 mtp180 -58.7 -51.98 67.66 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.209 -179.866 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 341' ' ' ASN . . . . . . . . . . . . . 5.6 t30 -59.76 -37.93 80.41 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.063 -179.751 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 342' ' ' ALA . . . . . . . . . . . . . . . -65.39 -35.74 81.87 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.043 179.938 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 343' ' ' LYS . . . . . . . . . . . . . 60.1 tttm -71.83 -38.59 70.13 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.923 179.976 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 344' ' ' GLU . . . . . . . . . . . . . 46.7 mt-10 -73.08 -28.51 62.34 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.145 -179.885 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 345' ' ' ALA . . . . . . . . . . . . . . . -74.34 -22.04 59.42 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.146 -179.88 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 346' ' ' GLY . . . . . . . . . . . . . . . 60.04 61.29 7.32 Favored Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.822 -0.704 . . . . 0.0 112.537 -179.895 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 347' ' ' GLY . . . . . . . . . . . . . . . 74.0 -175.31 48.07 Favored Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.846 -0.692 . . . . 0.0 112.418 -179.828 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 348' ' ' ASN . . . . . . . . . . . . . 63.6 t30 61.25 11.31 3.5 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-O 120.848 0.356 . . . . 0.0 111.155 179.785 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 349' ' ' TYR . . . . . . . . . . . . . 66.6 t80 -124.92 143.63 50.76 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.33 -0.396 . . . . 0.0 110.88 -179.952 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 350' ' ' THR . . . . . . . . . . . . . 22.9 m -116.01 105.32 51.33 Favored Pre-proline 0 CA--C 1.532 0.253 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.25 -179.816 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 351' ' ' PRO . . . . . . . . . . . . . 31.7 Cg_exo -59.7 -179.93 0.23 Allowed 'Trans proline' 0 C--N 1.349 0.581 0 C-N-CA 122.482 2.122 . . . . 0.0 112.425 179.834 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 352' ' ' ALA . . . . . . . . . . . . . . . -105.33 -71.17 0.75 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.38 -179.83 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 353' ' ' LEU . . . . . 0.424 ' HG ' ' HG2' ' B' ' 357' ' ' GLU . 7.3 mp -85.05 126.65 33.74 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 121.048 0.451 . . . . 0.0 111.332 -179.779 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 354' ' ' THR . . . . . 0.513 ' H ' ' HB2' ' B' ' 357' ' ' GLU . 81.4 p -111.61 -175.76 2.78 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.738 -0.664 . . . . 0.0 110.564 179.43 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 355' ' ' GLU . . . . . . . . . . . . . 8.9 pt-20 -53.06 -44.9 67.83 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.894 0.378 . . . . 0.0 110.933 179.861 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 356' ' ' GLN . . . . . . . . . . . . . 35.9 tt0 -69.53 -34.57 74.44 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.045 -0.525 . . . . 0.0 111.212 -179.701 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 357' ' ' GLU . . . . . 0.513 ' HB2' ' H ' ' B' ' 354' ' ' THR . 4.8 tp10 -60.28 -55.66 30.99 Favored 'General case' 0 C--O 1.233 0.203 0 CA-C-O 120.752 0.311 . . . . 0.0 110.655 -179.849 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 358' ' ' VAL . . . . . 0.555 ' O ' HG23 ' B' ' 362' ' ' VAL . 69.9 t -60.92 -54.51 34.34 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.872 179.825 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 359' ' ' TYR . . . . . . . . . . . . . 1.2 t80 -52.05 -34.36 43.09 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.774 0.321 . . . . 0.0 110.911 -179.661 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 360' ' ' ALA . . . . . . . . . . . . . . . -66.94 -60.43 2.65 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.357 -179.913 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 361' ' ' GLN . . . . . . . . . . . . . 54.2 mt-30 -55.52 -41.51 73.24 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.992 -179.949 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 362' ' ' VAL . . . . . 0.555 HG23 ' O ' ' B' ' 358' ' ' VAL . 50.1 t -67.59 -35.37 72.8 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.545 179.703 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 363' ' ' ALA . . . . . . . . . . . . . . . -62.06 -40.92 97.42 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.464 179.562 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 364' ' ' ARG . . . . . . . . . . . . . 67.3 ttt180 -81.34 -22.61 38.33 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.886 -0.597 . . . . 0.0 110.444 179.544 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 365' ' ' LEU . . . . . . . . . . . . . 6.4 tp -64.08 -23.14 67.21 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.75 179.989 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 366' ' ' PHE . . . . . . . . . . . . . 84.2 m-85 -125.72 165.72 18.09 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.643 179.811 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 367' ' ' LYS . . . . . . . . . . . . . 63.3 mttp -128.38 -77.32 0.56 Allowed 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.352 -0.386 . . . . 0.0 111.016 -179.859 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 368' ' ' ASN . . . . . . . . . . . . . 38.5 m-80 -85.17 7.9 20.21 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.847 179.951 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 369' ' ' GLN . . . . . . . . . . . . . 14.7 mm100 -112.22 56.33 0.66 Allowed 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.065 -179.842 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 370' ' ' GLU . . . . . . . . . . . . . 6.3 tm-20 -69.0 -23.23 64.08 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.511 179.753 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 371' ' ' ASP . . . . . . . . . . . . . 13.1 m-20 -52.66 -32.64 43.26 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.866 179.949 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 372' ' ' LEU . . . . . . . . . . . . . 78.1 mt -73.53 -35.74 65.59 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.68 179.717 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 373' ' ' LEU . . . . . . . . . . . . . 48.8 mt -65.5 -38.59 90.15 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.441 179.75 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 374' ' ' SER . . . . . . . . . . . . . 87.7 p -70.48 -54.45 12.21 Favored 'General case' 0 C--O 1.234 0.256 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.608 179.559 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 375' ' ' GLU . . . . . . . . . . . . . 16.4 mm-40 -53.24 -39.65 63.98 Favored 'General case' 0 C--N 1.333 -0.144 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.292 179.451 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 376' ' ' PHE . . . . . . . . . . . . . 88.4 t80 -69.29 -36.44 77.04 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.042 -0.526 . . . . 0.0 109.795 179.087 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 377' ' ' GLY . . . . . . . . . . . . . . . -61.87 -31.0 76.79 Favored Glycine 0 N--CA 1.448 -0.512 0 C-N-CA 120.896 -0.669 . . . . 0.0 111.607 179.234 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 378' ' ' GLN . . . . . . . . . . . . . 92.5 mt-30 -58.51 -32.0 68.42 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.836 0.35 . . . . 0.0 110.287 179.252 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 379' ' ' PHE . . . . . . . . . . . . . 97.6 m-85 -75.62 -31.0 59.71 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.221 179.244 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 380' ' ' LEU . . . . . . . . . . . . . 5.7 tp -59.05 127.67 84.05 Favored Pre-proline 0 C--N 1.328 -0.364 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.654 -179.97 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 381' ' ' PRO . . . . . 0.456 ' HD3' ' HB3' ' A' ' 373' ' ' MET . 51.4 Cg_exo -52.58 162.55 2.28 Favored 'Trans proline' 0 C--N 1.348 0.514 0 C-N-CA 122.348 2.032 . . . . 0.0 112.322 -179.71 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 382' ' ' ASP . . . . . . . . . . . . . 12.2 m-20 -142.3 154.96 45.13 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.345 -0.388 . . . . 0.0 110.951 179.947 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 383' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.047 0 CA-C-O 118.198 -0.906 . . . . 0.0 111.267 179.856 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 358' ' ' ASP . . . . . . . . . . . . . 4.4 p30 . . . . . 0 N--CA 1.484 1.266 0 CA-C-O 120.815 0.34 . . . . 0.0 110.744 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 359' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -158.58 -141.38 0.09 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.592 -179.885 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 360' ' ' THR . . . . . . . . . . . . . 13.7 m 67.05 128.03 0.03 OUTLIER Pre-proline 0 CA--C 1.53 0.197 0 CA-C-N 116.504 -0.316 . . . . 0.0 111.182 -179.927 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 361' ' ' PRO . . . . . 0.428 ' HA ' HG11 ' B' ' 311' ' ' VAL . 60.0 Cg_endo -71.65 -160.69 0.09 OUTLIER 'Trans proline' 0 C--N 1.349 0.604 0 C-N-CA 122.338 2.025 . . . . 0.0 112.181 -179.913 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 362' ' ' MET . . . . . 0.623 ' HB2' HD22 ' B' ' 329' ' ' LEU . 12.2 tpt -57.69 -71.56 0.1 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.548 179.868 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 363' ' ' ASP . . . . . . . . . . . . . 29.5 t70 -180.0 68.69 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.89 -0.596 . . . . 0.0 110.305 179.895 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 364' ' ' SER . . . . . . . . . . . . . 55.8 m 56.34 21.12 5.16 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.678 -179.609 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 365' ' ' SER . . . . . 0.41 ' O ' HG12 ' A' ' 369' ' ' VAL . 41.2 t -111.63 -61.18 1.74 Allowed 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 115.884 -0.598 . . . . 0.0 111.327 -179.657 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 366' ' ' ALA . . . . . . . . . . . . . . . -54.96 -43.29 73.32 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.811 -179.423 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 367' ' ' VAL . . . . . . . . . . . . . 20.8 m -65.35 -37.93 81.3 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 CA-C-N 116.465 -0.334 . . . . 0.0 111.558 -179.515 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 368' ' ' TYR . . . . . . . . . . . . . 80.4 t80 -68.75 -53.02 24.36 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.355 -0.384 . . . . 0.0 111.539 -179.422 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 369' ' ' VAL . . . . . 0.578 HG11 ' HB3' ' B' ' 332' ' ' LEU . 5.1 p -57.62 -50.2 78.12 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.203 0 CA-C-N 116.611 -0.268 . . . . 0.0 111.513 -179.58 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 370' ' ' LEU . . . . . 0.531 ' HB3' ' HB2' ' B' ' 307' ' ' ALA . 8.1 mp -63.55 -35.73 81.46 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.689 0.28 . . . . 0.0 111.22 -179.866 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 371' ' ' SER . . . . . 0.527 ' HA ' ' HB2' ' B' ' 303' ' ' GLU . 34.6 t -62.41 -61.78 2.21 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 120.828 0.347 . . . . 0.0 111.107 179.85 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 372' ' ' SER . . . . . . . . . . . . . 40.4 t -62.43 -25.6 68.05 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.283 -179.515 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 373' ' ' MET . . . . . . . . . . . . . 56.0 ttm -66.38 -52.14 49.91 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.318 -0.401 . . . . 0.0 111.492 -179.628 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 374' ' ' ALA . . . . . . . . . . . . . . . -88.06 -8.86 54.93 Favored 'General case' 0 C--N 1.33 -0.281 0 N-CA-C 112.419 0.526 . . . . 0.0 112.419 -179.051 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 375' ' ' ARG . . . . . . . . . . . . . 10.4 ttp180 -94.09 -30.14 14.82 Favored 'General case' 0 C--N 1.33 -0.268 0 C-N-CA 120.962 -0.295 . . . . 0.0 111.515 -179.855 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 376' ' ' GLN . . . . . . . . . . . . . 24.0 tp60 -62.53 -74.93 0.08 Allowed 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.615 0.245 . . . . 0.0 111.004 -179.837 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 377' ' ' ARG . . . . . . . . . . . . . 70.9 mtm180 61.35 108.87 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.159 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.264 179.873 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 378' ' ' ARG . . . . . . . . . . . . . 81.1 mtm180 57.47 94.56 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.1 179.758 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 379' ' ' ALA . . . . . . . . . . . . . . . -97.54 -174.23 2.86 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.215 179.983 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 380' ' ' SER . . . . . . . . . . . . . 46.4 t . . . . . 0 C--O 1.249 1.036 0 CA-C-O 118.223 -0.894 . . . . 0.0 110.838 179.967 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' B' B ' 295' ' ' SER . . . . . . . . . . . . . 53.0 m . . . . . 0 N--CA 1.486 1.362 0 CA-C-O 120.798 0.333 . . . . 0.0 110.849 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' B' B ' 296' ' ' LEU . . . . . 0.424 HD22 ' N ' ' B' ' 296' ' ' LEU . 3.7 mm? -101.81 117.68 35.36 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.908 179.991 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 297' ' ' GLN . . . . . . . . . . . . . 54.4 tt0 -161.55 86.75 0.67 Allowed 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.852 179.872 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 298' ' ' ASN . . . . . . . . . . . . . 3.1 m-20 -112.43 -42.26 3.71 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.738 179.892 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 299' ' ' ASN . . . . . . . . . . . . . 66.7 t30 -135.64 131.58 35.96 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.725 -179.901 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 300' ' ' GLN . . . . . 0.404 ' CD ' ' H ' ' B' ' 300' ' ' GLN . 0.0 OUTLIER -78.13 148.78 75.4 Favored Pre-proline 0 C--N 1.33 -0.263 0 CA-C-N 116.507 -0.315 . . . . 0.0 110.967 -179.68 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 301' ' ' PRO . . . . . . . . . . . . . 52.4 Cg_exo -55.66 176.9 0.14 Allowed 'Trans proline' 0 C--N 1.348 0.526 0 C-N-CA 122.63 2.22 . . . . 0.0 112.611 179.968 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 302' ' ' VAL . . . . . 0.623 HG23 ' H ' ' B' ' 303' ' ' GLU . 3.3 m -85.78 -60.35 2.27 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.541 -179.848 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 303' ' ' GLU . . . . . 0.623 ' H ' HG23 ' B' ' 302' ' ' VAL . 0.0 OUTLIER -59.67 -16.0 23.34 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.412 -0.358 . . . . 0.0 111.073 -179.791 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 304' ' ' PHE . . . . . . . . . . . . . 82.3 t80 -64.13 -75.64 0.08 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.519 179.786 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 305' ' ' ASN . . . . . . . . . . . . . 25.7 t-20 -61.49 -29.44 69.98 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.995 -179.92 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 306' ' ' HIS . . . . . . . . . . . . . 2.3 m-70 -62.36 -69.33 0.26 Allowed 'General case' 0 C--O 1.233 0.202 0 CA-C-N 116.41 -0.359 . . . . 0.0 111.494 179.875 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 307' ' ' ALA . . . . . 0.531 ' HB2' ' HB3' ' A' ' 370' ' ' LEU . . . -55.56 -42.31 74.5 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.961 -179.217 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 308' ' ' ILE . . . . . . . . . . . . . 97.7 mt -60.34 -63.83 0.7 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.181 0 CA-C-O 120.672 0.272 . . . . 0.0 111.214 -179.853 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 309' ' ' ASN . . . . . . . . . . . . . 2.9 m-20 -54.76 -24.76 23.93 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.321 -0.399 . . . . 0.0 110.704 179.942 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 310' ' ' TYR . . . . . 0.444 ' O ' ' HG3' ' B' ' 313' ' ' LYS . 19.2 t80 -65.7 -57.18 8.67 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.31 179.51 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 311' ' ' VAL . . . . . 0.428 HG11 ' HA ' ' A' ' 361' ' ' PRO . 59.5 t -60.24 -31.05 47.34 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.748 179.557 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 312' ' ' ASN . . . . . . . . . . . . . 51.1 t-20 -66.26 -57.06 8.37 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.97 -0.559 . . . . 0.0 111.58 -179.696 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 313' ' ' LYS . . . . . 0.444 ' HG3' ' O ' ' B' ' 310' ' ' TYR . 0.0 OUTLIER -61.79 -30.56 70.89 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.61 -0.268 . . . . 0.0 111.633 -179.187 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 314' ' ' ILE . . . . . . . . . . . . . 89.3 mt -76.78 -31.69 19.64 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.206 0 CA-C-O 120.878 0.371 . . . . 0.0 110.998 179.542 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 315' ' ' LYS . . . . . . . . . . . . . 23.8 ttmm -78.49 -26.47 46.02 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.298 -179.717 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 316' ' ' ASN . . . . . . . . . . . . . 26.6 t-20 -88.95 -46.08 9.17 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.423 -0.353 . . . . 0.0 111.427 -179.607 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 317' ' ' ARG . . . . . . . . . . . . . 32.0 tpt180 -65.17 -60.41 3.03 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.432 -0.349 . . . . 0.0 111.203 -179.742 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 318' ' ' PHE . . . . . . . . . . . . . 95.4 m-85 -80.94 25.68 0.45 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.242 -0.435 . . . . 0.0 111.27 -179.655 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 319' ' ' GLN . . . . . . . . . . . . . 56.7 tt0 -62.6 -23.88 67.28 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.658 179.775 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 320' ' ' GLY . . . . . . . . . . . . . . . -72.8 -46.08 31.58 Favored Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 120.886 -0.673 . . . . 0.0 112.689 -179.915 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 321' ' ' GLN . . . . . . . . . . . . . 8.4 tt0 -108.0 92.95 9.96 Favored Pre-proline 0 C--N 1.329 -0.301 0 CA-C-O 120.462 0.172 . . . . 0.0 110.828 179.964 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 322' ' ' PRO . . . . . . . . . . . . . 57.9 Cg_endo -71.34 -4.43 14.95 Favored 'Trans proline' 0 C--N 1.348 0.507 0 C-N-CA 122.433 2.089 . . . . 0.0 112.333 179.931 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 323' ' ' ASP . . . . . . . . . . . . . 16.2 t70 -68.97 -56.09 8.87 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.914 179.876 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 324' ' ' ILE . . . . . . . . . . . . . 63.8 mt -60.98 -46.25 96.97 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.938 179.887 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 325' ' ' TYR . . . . . 0.435 ' CE2' HD11 ' B' ' 329' ' ' LEU . 30.0 t80 -57.72 -47.88 81.15 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.989 -0.551 . . . . 0.0 110.887 179.936 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 326' ' ' LYS . . . . . . . . . . . . . 23.6 ttmm -57.3 -52.39 65.52 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.022 -179.977 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 327' ' ' ALA . . . . . . . . . . . . . . . -51.21 -47.13 62.37 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.053 179.964 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 328' ' ' PHE . . . . . . . . . . . . . 59.6 t80 -56.09 -48.71 75.61 Favored 'General case' 0 C--O 1.235 0.296 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.387 179.672 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 329' ' ' LEU . . . . . 0.623 HD22 ' HB2' ' A' ' 362' ' ' MET . 77.9 mt -58.29 -34.67 70.79 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.844 -0.617 . . . . 0.0 110.813 179.584 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 330' ' ' GLU . . . . . . . . . . . . . 48.1 mt-10 -68.71 -37.07 79.22 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.934 -0.575 . . . . 0.0 110.825 -179.903 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 331' ' ' ILE . . . . . . . . . . . . . 75.8 mt -65.71 -45.28 92.35 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.229 0 CA-C-N 116.38 -0.373 . . . . 0.0 110.697 179.769 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 332' ' ' LEU . . . . . 0.578 ' HB3' HG11 ' A' ' 369' ' ' VAL . 25.0 mt -69.0 -32.44 71.99 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.972 -179.972 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 333' ' ' HIS . . . . . . . . . . . . . 49.7 t60 -66.58 -53.79 30.58 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.927 0.394 . . . . 0.0 110.543 179.649 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 334' ' ' THR . . . . . 0.403 HG22 HD13 ' B' ' 353' ' ' LEU . 89.3 m -62.03 -35.86 79.84 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.825 179.751 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 335' ' ' TYR . . . . . . . . . . . . . 71.7 t80 -64.74 -41.77 95.68 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.511 179.727 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 336' ' ' GLN . . . . . . . . . . . . . 51.1 tt0 -65.9 -38.04 87.68 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.881 -0.599 . . . . 0.0 110.798 179.816 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 337' ' ' LYS . . . . . . . . . . . . . 38.1 ttpt -64.88 -50.3 67.11 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.284 -0.416 . . . . 0.0 111.115 179.941 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 338' ' ' GLU . . . . . . . . . . . . . 21.5 mm-40 -63.3 -35.4 80.25 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.978 -179.854 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 339' ' ' GLN . . . . . . . . . . . . . 28.5 tt0 -64.17 -53.03 55.76 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.669 179.873 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 340' ' ' ARG . . . . . . . . . . . . . 99.1 mtt180 -57.94 -47.07 83.98 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.856 179.819 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 341' ' ' ASN . . . . . . . . . . . . . 49.2 t-20 -56.4 -46.04 80.34 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.481 179.513 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 342' ' ' ALA . . . . . . . . . . . . . . . -66.38 -27.2 67.68 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.064 -0.517 . . . . 0.0 110.707 179.757 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 343' ' ' LYS . . . . . . . . . . . . . 22.3 tptm -71.87 -46.52 57.59 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.809 179.781 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 344' ' ' GLU . . . . . . . . . . . . . 10.9 mm-40 -67.31 -34.84 78.2 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.868 -0.605 . . . . 0.0 110.919 -179.935 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 345' ' ' ALA . . . . . . . . . . . . . . . -71.16 -19.51 62.41 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.132 179.872 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 346' ' ' GLY . . . . . . . . . . . . . . . 104.61 -64.39 0.33 Allowed Glycine 0 N--CA 1.45 -0.376 0 C-N-CA 120.875 -0.678 . . . . 0.0 112.501 -179.97 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 347' ' ' GLY . . . . . . . . . . . . . . . 175.09 -13.77 0.04 OUTLIER Glycine 0 N--CA 1.452 -0.238 0 C-N-CA 120.78 -0.724 . . . . 0.0 112.485 179.898 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 348' ' ' ASN . . . . . . . . . . . . . 32.7 m-80 -77.8 3.22 14.79 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.865 0.364 . . . . 0.0 110.774 -179.975 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 349' ' ' TYR . . . . . . . . . . . . . 83.3 t80 -88.28 152.77 21.72 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.92 -179.906 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 350' ' ' THR . . . . . . . . . . . . . 84.9 m -110.2 94.66 18.87 Favored Pre-proline 0 C--N 1.329 -0.299 0 CA-C-N 115.971 -0.558 . . . . 0.0 111.023 179.797 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 351' ' ' PRO . . . . . . . . . . . . . 40.5 Cg_exo -57.26 169.93 1.9 Allowed 'Trans proline' 0 C--N 1.35 0.632 0 C-N-CA 122.44 2.093 . . . . 0.0 112.053 179.745 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 352' ' ' ALA . . . . . . . . . . . . . . . -103.27 -51.5 3.22 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.319 -0.4 . . . . 0.0 111.496 -179.606 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 353' ' ' LEU . . . . . 0.468 ' HG ' ' HG2' ' B' ' 357' ' ' GLU . 7.0 mp -108.87 126.28 52.89 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 121.106 0.479 . . . . 0.0 111.521 -179.529 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 354' ' ' THR . . . . . 0.422 ' H ' ' HB2' ' B' ' 357' ' ' GLU . 40.4 p -111.93 -176.85 3.03 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.703 -0.68 . . . . 0.0 110.382 179.264 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 355' ' ' GLU . . . . . . . . . . . . . 8.4 pt-20 -53.44 -41.71 66.36 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.112 0.482 . . . . 0.0 110.483 179.558 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 356' ' ' GLN . . . . . . . . . . . . . 53.5 tt0 -67.57 -39.36 84.9 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.698 -0.683 . . . . 0.0 110.964 179.904 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 357' ' ' GLU . . . . . 0.468 ' HG2' ' HG ' ' B' ' 353' ' ' LEU . 4.8 tp10 -60.43 -54.07 49.97 Favored 'General case' 0 C--N 1.333 -0.136 0 CA-C-O 120.826 0.346 . . . . 0.0 110.976 -179.895 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 358' ' ' VAL . . . . . 0.553 ' O ' HG23 ' B' ' 362' ' ' VAL . 75.6 t -59.36 -59.63 3.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.104 -179.988 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 359' ' ' TYR . . . . . . . . . . . . . 78.2 t80 -51.04 -31.9 19.94 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.565 -0.289 . . . . 0.0 111.326 -179.466 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 360' ' ' ALA . . . . . . . . . . . . . . . -67.39 -60.37 2.64 Favored 'General case' 0 C--O 1.234 0.285 0 CA-C-O 120.849 0.356 . . . . 0.0 110.987 179.688 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 361' ' ' GLN . . . . . . . . . . . . . 45.1 mt-30 -57.56 -35.25 70.1 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.682 179.948 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 362' ' ' VAL . . . . . 0.553 HG23 ' O ' ' B' ' 358' ' ' VAL . 67.7 t -70.71 -34.7 57.7 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.336 179.456 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 363' ' ' ALA . . . . . 0.589 ' HA ' HD21 ' B' ' 373' ' ' LEU . . . -64.01 -39.42 94.06 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.132 179.212 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 364' ' ' ARG . . . . . . . . . . . . . 80.8 mtp180 -82.37 -22.19 35.58 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.701 -0.682 . . . . 0.0 110.325 179.193 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 365' ' ' LEU . . . . . 0.447 ' HB2' ' HA ' ' B' ' 362' ' ' VAL . 2.4 tp -60.14 -26.98 66.7 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 115.936 -0.574 . . . . 0.0 110.335 179.883 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 366' ' ' PHE . . . . . . . . . . . . . 45.3 m-85 -122.68 -176.29 3.35 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.447 179.659 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 367' ' ' LYS . . . . . 0.459 ' NZ ' ' HB2' ' B' ' 367' ' ' LYS . 0.0 OUTLIER -141.0 -75.95 0.31 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.424 -0.353 . . . . 0.0 110.885 -179.98 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 368' ' ' ASN . . . . . . . . . . . . . 6.6 t30 -81.12 -16.77 52.07 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.528 179.893 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 369' ' ' GLN . . . . . 0.637 ' HB3' HD13 ' B' ' 372' ' ' LEU . 72.5 mm-40 -83.69 84.78 7.42 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.866 -179.939 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 370' ' ' GLU . . . . . . . . . . . . . 38.2 tt0 -93.75 -17.88 22.68 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.874 0.369 . . . . 0.0 110.519 179.81 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 371' ' ' ASP . . . . . . . . . . . . . 25.2 t70 -56.81 -40.28 75.69 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.625 179.722 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 372' ' ' LEU . . . . . 0.637 HD13 ' HB3' ' B' ' 369' ' ' GLN . 6.5 mp -65.86 -44.81 84.32 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.597 179.483 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 373' ' ' LEU . . . . . 0.589 HD21 ' HA ' ' B' ' 363' ' ' ALA . 1.3 mp -57.44 -43.33 83.8 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.76 -0.655 . . . . 0.0 111.417 -179.718 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 374' ' ' SER . . . . . . . . . . . . . 80.9 p -69.2 -53.23 21.04 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.959 0.409 . . . . 0.0 110.518 179.818 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 375' ' ' GLU . . . . . . . . . . . . . 40.0 tt0 -59.54 -24.57 63.81 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.969 -0.559 . . . . 0.0 110.509 179.776 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 376' ' ' PHE . . . . . . . . . . . . . 76.0 t80 -83.34 -34.01 25.75 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.12 179.378 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 377' ' ' GLY . . . . . . . . . . . . . . . -67.72 -32.46 78.15 Favored Glycine 0 N--CA 1.449 -0.436 0 C-N-CA 120.812 -0.708 . . . . 0.0 111.867 179.463 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 378' ' ' GLN . . . . . . . . . . . . . 54.7 mt-30 -61.75 -24.63 66.95 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.819 0.342 . . . . 0.0 110.547 179.442 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 379' ' ' PHE . . . . . . . . . . . . . 22.3 m-85 -72.06 -40.36 68.37 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.541 179.663 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 380' ' ' LEU . . . . . . . . . . . . . 75.8 mt -49.64 144.13 9.95 Favored Pre-proline 0 C--N 1.33 -0.256 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.294 179.72 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 381' ' ' PRO . . . . . . . . . . . . . 72.5 Cg_exo -48.38 147.82 8.42 Favored 'Trans proline' 0 C--N 1.347 0.465 0 C-N-CA 122.418 2.079 . . . . 0.0 112.417 -179.462 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 382' ' ' ASP . . . . . . . . . . . . . 17.2 t70 -57.6 128.67 38.24 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.894 -179.97 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 383' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.103 0 CA-C-O 118.187 -0.911 . . . . 0.0 111.16 179.964 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 358' ' ' ASP . . . . . . . . . . . . . 16.0 m-20 . . . . . 0 N--CA 1.485 1.287 0 CA-C-O 120.864 0.364 . . . . 0.0 110.926 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 359' ' ' PHE . . . . . . . . . . . . . 32.0 p90 -160.56 135.94 7.98 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.921 -179.975 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 360' ' ' THR . . . . . 0.544 ' N ' ' HD3' ' A' ' 361' ' ' PRO . 80.3 p -140.88 50.96 2.21 Favored Pre-proline 0 CA--C 1.532 0.27 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.774 179.631 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 361' ' ' PRO . . . . . 0.544 ' HD3' ' N ' ' A' ' 360' ' ' THR . 73.1 Cg_endo -86.74 -75.8 0.0 OUTLIER 'Trans proline' 0 N--CA 1.457 -0.657 0 C-N-CA 122.306 2.004 . . . . 0.0 112.22 179.594 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 362' ' ' MET . . . . . 0.534 ' HG2' HD22 ' B' ' 329' ' ' LEU . 0.0 OUTLIER -118.66 11.46 12.79 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.641 179.56 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 363' ' ' ASP . . . . . . . . . . . . . 17.8 t70 -67.34 -11.19 57.01 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.659 179.867 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 364' ' ' SER . . . . . . . . . . . . . 80.3 p -135.74 21.17 3.31 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.635 179.816 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 365' ' ' SER . . . . . . . . . . . . . 48.1 t -131.87 -59.95 0.93 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.841 -179.928 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 366' ' ' ALA . . . . . . . . . . . . . . . -69.27 -18.54 63.87 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.973 179.922 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 367' ' ' VAL . . . . . . . . . . . . . 16.5 m -58.74 -35.62 56.54 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 116.03 -0.532 . . . . 0.0 111.115 179.913 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 368' ' ' TYR . . . . . . . . . . . . . 94.1 m-85 -64.65 -40.85 96.16 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.389 -0.368 . . . . 0.0 110.624 179.745 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 369' ' ' VAL . . . . . 0.585 HG22 ' HB2' ' B' ' 336' ' ' GLN . 21.9 t -63.99 -59.6 4.01 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-N 116.002 -0.544 . . . . 0.0 111.075 -179.897 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 370' ' ' LEU . . . . . 0.506 ' HB2' ' HB1' ' B' ' 307' ' ' ALA . 88.0 mt -57.81 -35.95 71.56 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.999 -0.546 . . . . 0.0 111.413 -179.604 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 371' ' ' SER . . . . . . . . . . . . . 47.3 t -61.83 -60.86 3.02 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.295 -0.412 . . . . 0.0 111.32 -179.558 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 372' ' ' SER . . . . . . . . . . . . . 79.4 p -56.93 -42.95 80.92 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.772 -179.368 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 373' ' ' MET . . . . . . . . . . . . . 90.2 mtp -57.29 -47.37 81.65 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.381 -0.372 . . . . 0.0 111.818 -179.355 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 374' ' ' ALA . . . . . 0.541 ' HB3' ' HB3' ' B' ' 303' ' ' GLU . . . -84.22 -17.93 38.21 Favored 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 112.044 0.387 . . . . 0.0 112.044 -179.341 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 375' ' ' ARG . . . . . . . . . . . . . 29.8 tpt180 -80.39 -26.49 38.52 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.769 0.319 . . . . 0.0 110.787 -179.881 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 376' ' ' GLN . . . . . . . . . . . . . 50.6 tt0 -62.62 -83.14 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.132 -179.748 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 377' ' ' ARG . . . . . . . . . . . . . 99.7 mtt180 60.19 -85.06 0.02 OUTLIER 'General case' 0 C--O 1.231 0.131 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.197 -179.732 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 378' ' ' ARG . . . . . . . . . . . . . 23.8 mmm180 -96.15 -167.61 1.61 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.452 -0.34 . . . . 0.0 110.943 -179.924 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 379' ' ' ALA . . . . . . . . . . . . . . . 60.11 25.17 14.46 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.067 179.883 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 380' ' ' SER . . . . . . . . . . . . . 71.1 p . . . . . 0 C--O 1.247 0.971 0 CA-C-O 118.235 -0.888 . . . . 0.0 110.941 179.966 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' B' B ' 295' ' ' SER . . . . . . . . . . . . . 83.5 p . . . . . 0 N--CA 1.486 1.339 0 CA-C-O 120.792 0.33 . . . . 0.0 110.895 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' B' B ' 296' ' ' LEU . . . . . . . . . . . . . 78.9 mt -134.69 114.37 12.63 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.756 179.986 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 297' ' ' GLN . . . . . . . . . . . . . 51.8 tt0 -82.59 -29.35 30.27 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.099 -0.5 . . . . 0.0 111.078 -179.771 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 298' ' ' ASN . . . . . . . . . . . . . 39.2 m-80 -121.45 124.4 44.39 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.341 -0.391 . . . . 0.0 111.064 179.971 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 299' ' ' ASN . . . . . . . . . . . . . 63.0 t30 -123.14 3.96 9.26 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.492 179.719 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 300' ' ' GLN . . . . . . . . . . . . . 6.1 tp-100 60.21 75.96 0.45 Allowed Pre-proline 0 C--N 1.331 -0.232 0 CA-C-N 115.879 -0.6 . . . . 0.0 111.174 179.842 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 301' ' ' PRO . . . . . 0.43 ' HB2' ' HB3' ' B' ' 304' ' ' PHE . 91.8 Cg_endo -86.49 96.65 0.52 Allowed 'Trans proline' 0 N--CA 1.458 -0.583 0 C-N-CA 122.459 2.106 . . . . 0.0 112.185 179.615 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 302' ' ' VAL . . . . . 0.632 HG23 ' H ' ' B' ' 303' ' ' GLU . 3.9 m -92.13 -59.77 2.8 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.353 -179.917 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 303' ' ' GLU . . . . . 0.632 ' H ' HG23 ' B' ' 302' ' ' VAL . 3.3 mm-40 -69.12 -23.73 64.02 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.611 -179.749 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 304' ' ' PHE . . . . . 0.43 ' HB3' ' HB2' ' B' ' 301' ' ' PRO . 68.9 t80 -67.5 -54.48 19.76 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.188 179.433 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 305' ' ' ASN . . . . . . . . . . . . . 24.6 t-20 -60.29 -48.7 80.61 Favored 'General case' 0 C--O 1.233 0.228 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.471 179.408 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 306' ' ' HIS . . . . . . . . . . . . . 18.5 t-80 -54.72 -42.99 72.18 Favored 'General case' 0 C--O 1.234 0.264 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.24 179.494 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 307' ' ' ALA . . . . . 0.506 ' HB1' ' HB2' ' A' ' 370' ' ' LEU . . . -59.4 -44.98 92.72 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.635 179.548 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 308' ' ' ILE . . . . . 0.407 HG13 ' O ' ' B' ' 304' ' ' PHE . 85.3 mt -54.87 -51.96 47.56 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.215 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.593 179.358 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 309' ' ' ASN . . . . . . . . . . . . . 42.8 m-80 -55.48 -38.17 68.78 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.731 179.788 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 310' ' ' TYR . . . . . 0.425 ' O ' ' HG3' ' B' ' 313' ' ' LYS . 15.0 t80 -61.49 -48.49 80.84 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.093 -0.503 . . . . 0.0 111.056 179.785 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 311' ' ' VAL . . . . . . . . . . . . . 40.0 t -62.57 -32.37 55.15 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.224 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.041 179.931 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 312' ' ' ASN . . . . . . . . . . . . . 31.4 t30 -67.68 -55.44 13.21 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.559 -179.652 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 313' ' ' LYS . . . . . 0.425 ' HG3' ' O ' ' B' ' 310' ' ' TYR . 0.0 OUTLIER -59.65 -36.94 77.4 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.382 -0.372 . . . . 0.0 111.784 -179.109 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B ' 314' ' ' ILE . . . . . 0.404 HD11 ' CZ ' ' B' ' 310' ' ' TYR . 68.3 mt -70.27 -40.1 77.53 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.162 0 C-N-CA 120.85 -0.34 . . . . 0.0 110.866 179.601 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 315' ' ' LYS . . . . . . . . . . . . . 12.9 ttpp -61.11 -47.29 86.95 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.324 -179.715 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 316' ' ' ASN . . . . . . . . . . . . . 57.6 t30 -67.51 -50.99 56.33 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.414 -179.329 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 317' ' ' ARG . . . . . . . . . . . . . 6.8 tpm_? -56.18 -61.26 2.52 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.186 -179.571 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 318' ' ' PHE . . . . . . . . . . . . . 66.9 m-85 -88.61 37.58 0.84 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.362 -179.686 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 319' ' ' GLN . . . . . . . . . . . . . 52.0 tt0 -68.66 -28.83 67.22 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.365 -0.38 . . . . 0.0 110.782 179.981 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 320' ' ' GLY . . . . . . . . . . . . . . . -82.84 -14.69 74.78 Favored Glycine 0 N--CA 1.452 -0.289 0 C-N-CA 120.847 -0.692 . . . . 0.0 112.451 179.856 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 321' ' ' GLN . . . . . . . . . . . . . 25.8 mp0 -110.21 88.53 7.29 Favored Pre-proline 0 C--N 1.33 -0.258 0 CA-C-O 120.451 0.167 . . . . 0.0 110.754 179.948 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 322' ' ' PRO . . . . . . . . . . . . . 70.2 Cg_endo -73.89 -30.8 8.84 Favored 'Trans proline' 0 C--N 1.348 0.537 0 C-N-CA 122.374 2.049 . . . . 0.0 112.391 -179.996 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 323' ' ' ASP . . . . . . . . . . . . . 8.7 m-20 -63.7 -50.74 68.0 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.03 -179.884 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 324' ' ' ILE . . . . . . . . . . . . . 58.7 mt -67.03 -49.16 76.11 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.266 -179.798 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 325' ' ' TYR . . . . . 0.403 ' O ' ' HG ' ' B' ' 329' ' ' LEU . 11.3 t80 -52.91 -50.79 63.23 Favored 'General case' 0 C--O 1.234 0.26 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.694 179.956 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 326' ' ' LYS . . . . . 0.463 ' O ' ' HG3' ' B' ' 330' ' ' GLU . 47.5 mttp -57.46 -53.95 52.31 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.774 179.423 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 327' ' ' ALA . . . . . 0.429 ' O ' HG13 ' B' ' 331' ' ' ILE . . . -46.31 -49.16 17.9 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.36 -179.935 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 328' ' ' PHE . . . . . . . . . . . . . 70.8 t80 -57.46 -55.26 37.09 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.747 179.844 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 329' ' ' LEU . . . . . 0.534 HD22 ' HG2' ' A' ' 362' ' ' MET . 62.1 mt -58.65 -26.97 64.31 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.723 179.853 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 330' ' ' GLU . . . . . 0.463 ' HG3' ' O ' ' B' ' 326' ' ' LYS . 45.5 mt-10 -73.91 -36.5 64.72 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.409 179.583 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 331' ' ' ILE . . . . . 0.429 HG13 ' O ' ' B' ' 327' ' ' ALA . 91.7 mt -64.44 -50.5 75.91 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.204 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.135 179.235 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 332' ' ' LEU . . . . . . . . . . . . . 8.9 mp -65.58 -34.33 77.99 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.58 179.411 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 333' ' ' HIS . . . . . . . . . . . . . 50.2 t-80 -59.96 -57.41 13.0 Favored 'General case' 0 C--O 1.233 0.216 0 CA-C-O 120.975 0.417 . . . . 0.0 110.312 179.155 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 334' ' ' THR . . . . . . . . . . . . . 58.0 m -59.18 -33.13 70.58 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.855 -0.611 . . . . 0.0 110.555 179.421 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 335' ' ' TYR . . . . . . . . . . . . . 59.3 t80 -59.84 -51.46 69.62 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.732 179.883 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 336' ' ' GLN . . . . . 0.585 ' HB2' HG22 ' A' ' 369' ' ' VAL . 0.0 OUTLIER -62.33 -40.51 96.58 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.605 179.87 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B ' 337' ' ' LYS . . . . . . . . . . . . . 25.0 ttmm -57.19 -47.82 80.29 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.747 179.712 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 338' ' ' GLU . . . . . 0.442 ' HG3' ' HB3' ' B' ' 352' ' ' ALA . 22.5 mm-40 -64.92 -37.58 88.12 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.795 179.797 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 339' ' ' GLN . . . . . . . . . . . . . 59.1 tp60 -61.7 -41.58 97.78 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.465 179.751 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 340' ' ' ARG . . . . . . . . . . . . . 72.6 mtp180 -64.17 -52.9 56.77 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.335 179.462 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 341' ' ' ASN . . . . . . . . . . . . . 3.2 m-20 -56.93 -31.01 64.51 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.002 -0.544 . . . . 0.0 110.276 179.237 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 342' ' ' ALA . . . . . . . . . . . . . . . -70.19 -40.25 74.75 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.581 179.453 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 343' ' ' LYS . . . . . . . . . . . . . 59.7 tttm -70.78 -28.74 64.89 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.723 179.62 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 344' ' ' GLU . . . . . . . . . . . . . 20.1 mm-40 -79.27 -33.6 43.32 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.105 -179.776 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 345' ' ' ALA . . . . . . . . . . . . . . . -59.28 -28.69 66.99 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.379 -179.825 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 346' ' ' GLY . . . . . . . . . . . . . . . 87.45 -17.33 44.47 Favored Glycine 0 N--CA 1.452 -0.237 0 C-N-CA 120.715 -0.755 . . . . 0.0 112.544 179.991 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 347' ' ' GLY . . . . . . . . . . . . . . . 146.75 177.21 21.17 Favored Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.79 -0.719 . . . . 0.0 112.449 -179.964 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 348' ' ' ASN . . . . . . . . . . . . . 19.7 t-20 60.28 17.88 7.45 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.842 0.353 . . . . 0.0 110.771 179.947 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 349' ' ' TYR . . . . . . . . . . . . . 59.2 t80 -117.06 124.88 50.34 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.908 179.967 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 350' ' ' THR . . . . . . . . . . . . . 88.5 m -100.56 111.73 63.3 Favored Pre-proline 0 C--N 1.329 -0.306 0 CA-C-N 116.059 -0.518 . . . . 0.0 110.923 179.698 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 351' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_exo -52.06 147.88 25.53 Favored 'Trans proline' 0 C--N 1.351 0.669 0 C-N-CA 122.354 2.036 . . . . 0.0 112.258 179.815 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 352' ' ' ALA . . . . . 0.442 ' HB3' ' HG3' ' B' ' 338' ' ' GLU . . . -67.05 -55.03 16.07 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.389 -179.64 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 353' ' ' LEU . . . . . 0.531 HD22 ' HG2' ' B' ' 357' ' ' GLU . 22.0 mt -106.12 130.92 53.92 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.86 0.362 . . . . 0.0 111.192 -179.709 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 354' ' ' THR . . . . . . . . . . . . . 73.8 p -113.79 -170.63 1.74 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.905 179.69 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 355' ' ' GLU . . . . . . . . . . . . . 37.5 mt-10 -60.77 -44.3 96.94 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.97 179.912 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 356' ' ' GLN . . . . . . . . . . . . . 27.7 mm-40 -68.17 -38.18 81.8 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.028 -0.533 . . . . 0.0 111.335 -179.661 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 357' ' ' GLU . . . . . 0.531 ' HG2' HD22 ' B' ' 353' ' ' LEU . 8.8 tp10 -63.05 -54.37 39.17 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.535 -0.302 . . . . 0.0 111.018 -179.714 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 358' ' ' VAL . . . . . 0.48 ' O ' HG23 ' B' ' 362' ' ' VAL . 54.2 t -59.07 -54.05 39.48 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 116.449 -0.341 . . . . 0.0 110.909 179.817 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 359' ' ' TYR . . . . . . . . . . . . . 72.8 t80 -54.66 -32.86 59.87 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.467 -0.333 . . . . 0.0 110.885 -179.819 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 360' ' ' ALA . . . . . . . . . . . . . . . -68.03 -59.58 3.15 Favored 'General case' 0 C--N 1.332 -0.196 0 CA-C-N 116.376 -0.374 . . . . 0.0 111.012 179.701 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 361' ' ' GLN . . . . . . . . . . . . . 96.4 mt-30 -55.63 -35.21 65.64 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.81 179.822 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 362' ' ' VAL . . . . . 0.48 HG23 ' O ' ' B' ' 358' ' ' VAL . 98.3 t -74.65 -34.49 34.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.509 179.541 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 363' ' ' ALA . . . . . . . . . . . . . . . -64.21 -33.9 76.87 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.059 -0.518 . . . . 0.0 110.232 179.484 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 364' ' ' ARG . . . . . . . . . . . . . 71.1 ttt180 -90.54 -22.03 21.5 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.188 179.374 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 365' ' ' LEU . . . . . . . . . . . . . 18.4 tp -55.17 -31.67 61.55 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.708 -0.678 . . . . 0.0 110.716 179.775 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 366' ' ' PHE . . . . . . . . . . . . . 52.3 m-85 -111.81 179.99 3.86 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.954 -0.567 . . . . 0.0 110.496 179.85 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 367' ' ' LYS . . . . . . . . . . . . . 64.9 tttm -123.44 -75.63 0.6 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.701 0.286 . . . . 0.0 111.313 -179.722 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 368' ' ' ASN . . . . . . . . . . . . . 20.1 m120 -98.91 6.31 46.83 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.254 -179.669 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 369' ' ' GLN . . . . . 0.559 ' HB3' HD13 ' B' ' 372' ' ' LEU . 21.8 mp0 -100.26 87.8 3.53 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.38 -0.373 . . . . 0.0 110.754 179.842 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 370' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -93.56 -16.37 24.48 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.749 179.962 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 371' ' ' ASP . . . . . . . . . . . . . 17.4 t70 -55.96 -37.15 68.64 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.766 179.856 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 372' ' ' LEU . . . . . 0.559 HD13 ' HB3' ' B' ' 369' ' ' GLN . 6.4 mp -69.98 -36.7 75.38 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.307 179.945 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 373' ' ' LEU . . . . . . . . . . . . . 24.4 mt -65.1 -38.27 90.16 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.442 -0.344 . . . . 0.0 110.26 179.811 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 374' ' ' SER . . . . . . . . . . . . . 57.9 m -69.15 -53.31 20.82 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.477 179.359 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 375' ' ' GLU . . . . . . . . . . . . . 22.6 mm-40 -54.21 -44.39 71.58 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.305 179.638 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 376' ' ' PHE . . . . . . . . . . . . . 70.5 t80 -68.8 -33.81 74.47 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.063 179.232 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 377' ' ' GLY . . . . . . . . . . . . . . . -61.11 -34.84 89.52 Favored Glycine 0 N--CA 1.451 -0.364 0 C-N-CA 120.78 -0.724 . . . . 0.0 111.663 179.38 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 378' ' ' GLN . . . . . . . . . . . . . 78.3 mt-30 -62.14 -31.22 71.67 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.692 0.282 . . . . 0.0 110.596 179.427 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 379' ' ' PHE . . . . . . . . . . . . . 60.7 m-85 -66.42 -31.1 71.65 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.773 179.74 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 380' ' ' LEU . . . . . . . . . . . . . 97.6 mt -60.48 134.52 91.45 Favored Pre-proline 0 C--N 1.329 -0.322 0 CA-C-N 116.356 -0.384 . . . . 0.0 110.657 179.91 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 381' ' ' PRO . . . . . . . . . . . . . 79.6 Cg_exo -46.46 125.08 8.74 Favored 'Trans proline' 0 C--N 1.351 0.673 0 C-N-CA 122.638 2.226 . . . . 0.0 112.933 -179.641 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 382' ' ' ASP . . . . . . . . . . . . . 7.5 m-20 -78.25 175.32 10.32 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.972 -179.98 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 383' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.056 0 CA-C-O 118.286 -0.864 . . . . 0.0 111.095 179.969 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 358' ' ' ASP . . . . . . . . . . . . . 8.1 m-20 . . . . . 0 N--CA 1.485 1.325 0 CA-C-O 120.673 0.273 . . . . 0.0 110.889 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 359' ' ' PHE . . . . . . . . . . . . . 83.3 t80 -74.1 122.78 23.25 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.613 179.862 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 360' ' ' THR . . . . . . . . . . . . . 4.9 t -113.29 142.03 26.78 Favored Pre-proline 0 C--N 1.331 -0.235 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.249 -179.95 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 361' ' ' PRO . . . . . . . . . . . . . 96.9 Cg_endo -78.03 -156.71 0.07 OUTLIER 'Trans proline' 0 C--N 1.349 0.591 0 C-N-CA 122.479 2.12 . . . . 0.0 112.02 179.892 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 362' ' ' MET . . . . . 0.618 ' HG3' HD13 ' B' ' 329' ' ' LEU . 22.5 ttt -55.66 -71.51 0.09 Allowed 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.806 179.795 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 363' ' ' ASP . . . . . . . . . . . . . 17.7 t70 -174.44 -22.27 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.971 -0.558 . . . . 0.0 110.482 179.952 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 364' ' ' SER . . . . . . . . . . . . . 34.8 p -129.28 -74.53 0.56 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.832 -179.992 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 365' ' ' SER . . . . . . . . . . . . . 69.0 m -161.67 76.66 0.51 Allowed 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.426 -0.352 . . . . 0.0 111.335 -179.956 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 366' ' ' ALA . . . . . . . . . . . . . . . -78.48 -34.96 47.17 Favored 'General case' 0 C--O 1.234 0.259 0 CA-C-O 121.015 0.436 . . . . 0.0 110.7 179.472 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 367' ' ' VAL . . . . . . . . . . . . . 39.4 t -55.97 -34.47 38.05 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.214 0 CA-C-N 115.733 -0.667 . . . . 0.0 110.653 179.495 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 368' ' ' TYR . . . . . . . . . . . . . 62.6 t80 -65.66 -37.14 85.68 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.561 179.735 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 369' ' ' VAL . . . . . 0.495 HG22 ' HB2' ' B' ' 336' ' ' GLN . 11.1 t -65.89 -56.52 14.49 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.201 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.511 179.671 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 370' ' ' LEU . . . . . . . . . . . . . 95.0 mt -61.64 -31.74 71.85 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.817 -0.629 . . . . 0.0 110.939 179.958 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 371' ' ' SER . . . . . 0.447 ' HA ' ' HB2' ' B' ' 303' ' ' GLU . 40.7 t -64.76 -52.76 55.26 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.299 -0.409 . . . . 0.0 110.379 179.517 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 372' ' ' SER . . . . . . . . . . . . . 50.3 m -60.59 -32.01 71.13 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.33 179.517 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 373' ' ' MET . . . . . 0.506 ' HG3' ' HD3' ' B' ' 381' ' ' PRO . 54.9 tpp -61.35 -60.63 3.43 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.804 -0.635 . . . . 0.0 110.837 179.622 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 374' ' ' ALA . . . . . . . . . . . . . . . -60.12 -34.17 73.14 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.596 -179.641 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 375' ' ' ARG . . . . . . . . . . . . . 18.9 tpt180 -75.76 -22.43 56.48 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.47 -0.332 . . . . 0.0 110.882 -179.688 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 376' ' ' GLN . . . . . . . . . . . . . 6.2 tp-100 -70.75 -9.44 57.3 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 121.029 0.442 . . . . 0.0 110.431 179.566 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 377' ' ' ARG . . . . . 0.582 ' HG3' ' H ' ' B' ' 382' ' ' ASP . 61.3 ttp180 -60.47 -29.03 68.79 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.862 -0.608 . . . . 0.0 110.92 179.908 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 378' ' ' ARG . . . . . . . . . . . . . 35.2 mmt180 -72.4 -25.26 61.42 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.016 -179.856 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 379' ' ' ALA . . . . . . . . . . . . . . . 58.95 -171.68 0.11 Allowed 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.284 179.975 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 380' ' ' SER . . . . . . . . . . . . . 47.3 t . . . . . 0 C--O 1.25 1.103 0 CA-C-O 118.164 -0.922 . . . . 0.0 110.843 -179.985 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' B' B ' 295' ' ' SER . . . . . . . . . . . . . 47.0 t . . . . . 0 N--CA 1.484 1.267 0 CA-C-O 120.739 0.304 . . . . 0.0 110.845 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' B' B ' 296' ' ' LEU . . . . . . . . . . . . . 5.1 mp 57.48 96.61 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.201 -179.886 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 297' ' ' GLN . . . . . . . . . . . . . 7.5 tp60 59.65 98.65 0.02 OUTLIER 'General case' 0 C--N 1.333 -0.147 0 CA-C-N 116.027 -0.533 . . . . 0.0 111.015 -179.913 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 298' ' ' ASN . . . . . . . . . . . . . 2.9 p-10 -135.96 157.83 45.89 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.066 -179.884 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 299' ' ' ASN . . . . . . . . . . . . . 17.3 m120 -136.86 179.71 6.21 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.086 -0.507 . . . . 0.0 110.969 -179.915 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 300' ' ' GLN . . . . . 0.541 ' HB3' ' HD3' ' B' ' 301' ' ' PRO . 53.2 tt0 -95.46 -48.31 0.26 Allowed Pre-proline 0 CA--C 1.534 0.347 0 CA-C-N 116.277 -0.42 . . . . 0.0 111.646 -179.907 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 301' ' ' PRO . . . . . 0.541 ' HD3' ' HB3' ' B' ' 300' ' ' GLN . 6.2 Cg_exo -78.69 36.74 0.61 Allowed 'Trans proline' 0 C--N 1.352 0.763 0 C-N-CA 122.493 2.129 . . . . 0.0 112.149 179.913 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 302' ' ' VAL . . . . . . . . . . . . . 27.7 m -64.26 -40.63 89.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.596 -179.885 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 303' ' ' GLU . . . . . 0.447 ' HB2' ' HA ' ' A' ' 371' ' ' SER . 5.1 pt-20 -69.42 -46.98 65.51 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.533 -179.505 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 304' ' ' PHE . . . . . . . . . . . . . 89.4 m-85 -64.36 -49.2 72.59 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.776 0.322 . . . . 0.0 111.309 -179.629 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 305' ' ' ASN . . . . . . . . . . . . . 54.6 t30 -59.89 -53.17 61.05 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.768 -179.322 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 306' ' ' HIS . . . . . 0.41 ' O ' ' HB2' ' B' ' 310' ' ' TYR . 10.5 m-70 -60.7 -56.48 20.79 Favored 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 111.781 0.289 . . . . 0.0 111.781 -179.33 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 307' ' ' ALA . . . . . . . . . . . . . . . -51.9 -61.09 2.48 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 112.16 0.429 . . . . 0.0 112.16 -179.286 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 308' ' ' ILE . . . . . . . . . . . . . 46.9 mm -53.0 -56.68 6.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.504 -0.316 . . . . 0.0 111.841 -179.258 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 309' ' ' ASN . . . . . . . . . . . . . 39.8 t30 -57.55 -29.22 64.22 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.483 -0.326 . . . . 0.0 111.482 -179.573 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 310' ' ' TYR . . . . . 0.451 ' O ' ' HG3' ' B' ' 313' ' ' LYS . 11.8 t80 -69.34 -59.94 2.67 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.359 -0.382 . . . . 0.0 111.266 -179.451 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 311' ' ' VAL . . . . . . . . . . . . . 36.2 t -62.17 -26.79 41.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.289 -179.483 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 312' ' ' ASN . . . . . . . . . . . . . 27.3 t-20 -72.46 -56.68 5.03 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.477 -179.537 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 313' ' ' LYS . . . . . 0.457 ' NZ ' ' HB2' ' B' ' 313' ' ' LYS . 0.0 OUTLIER -61.31 -32.34 72.2 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.38 -0.373 . . . . 0.0 111.551 -179.452 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 314' ' ' ILE . . . . . . . . . . . . . 98.0 mt -76.89 -39.72 30.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.563 -0.29 . . . . 0.0 111.639 -179.74 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 315' ' ' LYS . . . . . 0.408 ' HE3' ' HB3' ' B' ' 315' ' ' LYS . 1.4 tmmt? -65.64 -38.62 89.87 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.522 -0.308 . . . . 0.0 110.937 -179.853 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 316' ' ' ASN . . . . . . . . . . . . . 42.6 t30 -76.31 -51.8 11.24 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.518 -179.466 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 317' ' ' ARG . . . . . . . . . . . . . 19.0 tpp180 -60.27 -62.93 1.5 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.368 -179.6 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 318' ' ' PHE . . . . . . . . . . . . . 66.7 m-85 -86.38 38.43 0.78 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.209 -179.672 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 319' ' ' GLN . . . . . . . . . . . . . 58.1 tt0 -65.54 -29.61 70.26 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.9 179.933 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 320' ' ' GLY . . . . . . . . . . . . . . . -84.82 -2.31 88.62 Favored Glycine 0 N--CA 1.453 -0.23 0 C-N-CA 120.763 -0.732 . . . . 0.0 112.624 -179.732 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 321' ' ' GLN . . . . . . . . . . . . . 24.2 mp0 -109.98 91.73 11.56 Favored Pre-proline 0 C--N 1.33 -0.245 0 CA-C-O 120.502 0.191 . . . . 0.0 110.884 179.944 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 322' ' ' PRO . . . . . . . . . . . . . 97.6 Cg_endo -78.6 -29.03 3.9 Favored 'Trans proline' 0 C--N 1.348 0.511 0 C-N-CA 122.41 2.074 . . . . 0.0 112.59 -179.857 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 323' ' ' ASP . . . . . . . . . . . . . 25.4 t70 -69.15 -46.0 68.66 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.413 -0.358 . . . . 0.0 111.053 -179.829 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 324' ' ' ILE . . . . . . . . . . . . . 75.5 mt -70.87 -42.04 77.26 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.013 179.928 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 325' ' ' TYR . . . . . . . . . . . . . 46.0 t80 -62.96 -50.62 70.06 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.042 -0.527 . . . . 0.0 110.92 179.955 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 326' ' ' LYS . . . . . 0.435 ' NZ ' ' HB3' ' B' ' 326' ' ' LYS . 6.5 ttpm? -61.55 -49.94 74.66 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.101 -179.862 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 327' ' ' ALA . . . . . 0.415 ' HB3' HD11 ' B' ' 365' ' ' LEU . . . -54.33 -47.23 72.73 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.365 -0.379 . . . . 0.0 110.987 179.937 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 328' ' ' PHE . . . . . . . . . . . . . 53.0 t80 -56.5 -51.1 69.79 Favored 'General case' 0 C--O 1.236 0.357 0 CA-C-N 115.969 -0.56 . . . . 0.0 110.633 179.875 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 329' ' ' LEU . . . . . 0.618 HD13 ' HG3' ' A' ' 362' ' ' MET . 92.8 mt -56.45 -34.54 66.95 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.541 179.534 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 330' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -67.65 -37.89 83.04 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.711 179.652 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 331' ' ' ILE . . . . . . . . . . . . . 79.9 mt -62.96 -51.62 69.64 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.161 0 CA-C-N 116.407 -0.36 . . . . 0.0 110.427 179.552 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 332' ' ' LEU . . . . . . . . . . . . . 17.7 mt -66.87 -26.7 67.02 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.73 179.784 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 333' ' ' HIS . . . . . . . . . . . . . 57.0 t-80 -64.12 -60.02 3.73 Favored 'General case' 0 C--O 1.234 0.256 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.199 179.481 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 334' ' ' THR . . . . . . . . . . . . . 80.0 m -58.94 -37.25 76.28 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.253 179.285 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 335' ' ' TYR . . . . . . . . . . . . . 56.4 t80 -60.59 -36.83 79.51 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.091 179.312 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 336' ' ' GLN . . . . . 0.495 ' HB2' HG22 ' A' ' 369' ' ' VAL . 24.7 tt0 -67.9 -51.44 47.99 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.781 179.771 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 337' ' ' LYS . . . . . . . . . . . . . 39.5 ttpt -51.8 -51.67 54.69 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.14 -179.824 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 338' ' ' GLU . . . . . 0.493 ' HG3' ' HB3' ' B' ' 352' ' ' ALA . 27.2 mm-40 -62.75 -39.86 95.45 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.986 -179.886 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 339' ' ' GLN . . . . . 0.467 ' HG3' ' HE2' ' B' ' 343' ' ' LYS . 57.6 tp60 -61.45 -39.39 90.67 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 121.023 0.439 . . . . 0.0 110.652 179.718 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 340' ' ' ARG . . . . . . . . . . . . . 64.9 mtp180 -64.1 -54.16 38.37 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.589 179.757 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 341' ' ' ASN . . . . . . . . . . . . . 43.7 t-20 -56.7 -32.42 65.47 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.356 179.555 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 342' ' ' ALA . . . . . . . . . . . . . . . -66.3 -46.6 76.37 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.801 179.75 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 343' ' ' LYS . . . . . 0.467 ' HE2' ' HG3' ' B' ' 339' ' ' GLN . 68.5 mttm -66.53 -29.2 69.23 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.845 179.763 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 344' ' ' GLU . . . . . . . . . . . . . 23.9 mm-40 -69.99 -62.01 1.55 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.085 179.941 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 345' ' ' ALA . . . . . . . . . . . . . . . -57.87 -41.78 83.18 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.016 179.943 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 346' ' ' GLY . . . . . . . . . . . . . . . 47.62 38.05 14.35 Favored Glycine 0 C--N 1.331 0.271 0 C-N-CA 121.122 -0.561 . . . . 0.0 112.553 -179.965 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 347' ' ' GLY . . . . . . . . . . . . . . . -134.61 -117.97 1.8 Allowed Glycine 0 N--CA 1.451 -0.334 0 C-N-CA 120.594 -0.812 . . . . 0.0 112.955 -179.638 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 348' ' ' ASN . . . . . . . . . . . . . 18.1 m120 -92.91 2.39 56.81 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.677 0.275 . . . . 0.0 111.444 -179.466 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 349' ' ' TYR . . . . . . . . . . . . . 64.6 t80 -60.95 118.1 6.3 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.411 -0.358 . . . . 0.0 110.961 -179.774 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 350' ' ' THR . . . . . . . . . . . . . 49.1 m -101.76 117.15 62.3 Favored Pre-proline 0 C--N 1.329 -0.311 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.966 179.931 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 351' ' ' PRO . . . . . . . . . . . . . 32.3 Cg_exo -57.74 161.22 12.96 Favored 'Trans proline' 0 C--N 1.349 0.586 0 C-N-CA 122.317 2.011 . . . . 0.0 112.074 179.822 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 352' ' ' ALA . . . . . 0.493 ' HB3' ' HG3' ' B' ' 338' ' ' GLU . . . -86.2 -55.89 3.71 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.211 179.994 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 353' ' ' LEU . . . . . 0.451 HD22 ' HG2' ' B' ' 357' ' ' GLU . 13.6 mt -91.34 125.33 36.06 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.957 0.408 . . . . 0.0 111.241 -179.854 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 354' ' ' THR . . . . . . . . . . . . . 75.2 p -113.27 -173.44 2.26 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.855 -0.612 . . . . 0.0 110.593 179.668 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 355' ' ' GLU . . . . . . . . . . . . . 7.1 pt-20 -60.61 -41.42 94.75 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.951 0.405 . . . . 0.0 110.613 179.585 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 356' ' ' GLN . . . . . . . . . . . . . 14.5 mm100 -71.61 -38.87 70.79 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.866 -0.607 . . . . 0.0 111.225 -179.98 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 357' ' ' GLU . . . . . 0.451 ' HG2' HD22 ' B' ' 353' ' ' LEU . 9.2 tp10 -60.65 -53.85 52.4 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.518 -0.31 . . . . 0.0 110.851 -179.859 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 358' ' ' VAL . . . . . 0.434 ' O ' HG23 ' B' ' 362' ' ' VAL . 59.8 t -62.52 -50.57 79.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.112 -179.936 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 359' ' ' TYR . . . . . . . . . . . . . 65.4 t80 -58.2 -31.01 66.91 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.63 0.253 . . . . 0.0 111.178 -179.719 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 360' ' ' ALA . . . . . . . . . . . . . . . -69.57 -59.7 2.8 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.369 -0.378 . . . . 0.0 111.044 -179.976 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 361' ' ' GLN . . . . . . . . . . . . . 91.7 mt-30 -56.78 -40.59 76.16 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.579 179.861 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 362' ' ' VAL . . . . . 0.434 HG23 ' O ' ' B' ' 358' ' ' VAL . 74.0 t -66.82 -35.43 74.74 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 115.892 -0.595 . . . . 0.0 110.602 179.708 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 363' ' ' ALA . . . . . 0.643 ' HA ' HD21 ' B' ' 373' ' ' LEU . . . -62.39 -50.2 72.49 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.766 179.742 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 364' ' ' ARG . . . . . . . . . . . . . 57.5 mtp180 -73.54 -21.91 60.24 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.523 179.655 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 365' ' ' LEU . . . . . 0.415 HD11 ' HB3' ' B' ' 327' ' ' ALA . 13.9 tp -61.12 -60.89 3.06 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.86 179.978 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 366' ' ' PHE . . . . . 0.613 ' HB3' ' HB2' ' B' ' 369' ' ' GLN . 47.8 m-85 -74.34 -44.85 50.65 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.989 -179.927 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 367' ' ' LYS . . . . . 0.488 ' C ' ' H ' ' B' ' 369' ' ' GLN . 58.9 tttm 65.37 120.9 0.02 OUTLIER 'General case' 0 N--CA 1.465 0.277 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.706 179.359 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 368' ' ' ASN . . . . . . . . . . . . . 71.6 m-20 70.3 -34.04 0.28 Allowed 'General case' 0 N--CA 1.463 0.19 0 CA-C-N 116.048 -0.523 . . . . 0.0 111.31 179.707 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 369' ' ' GLN . . . . . 0.613 ' HB2' ' HB3' ' B' ' 366' ' ' PHE . 86.7 mm-40 -66.52 90.57 0.16 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.885 0.374 . . . . 0.0 110.532 179.635 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 370' ' ' GLU . . . . . . . . . . . . . 44.1 mt-10 -90.01 -6.21 55.83 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.996 -0.547 . . . . 0.0 111.012 -179.673 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 371' ' ' ASP . . . . . . . . . . . . . 21.4 t70 -67.09 -47.3 71.63 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.073 0.463 . . . . 0.0 110.258 179.494 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 372' ' ' LEU . . . . . 0.479 HD12 ' N ' ' B' ' 372' ' ' LEU . 5.6 mp -72.82 -40.53 65.71 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.779 -0.646 . . . . 0.0 110.111 179.358 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 373' ' ' LEU . . . . . 0.643 HD21 ' HA ' ' B' ' 363' ' ' ALA . 1.1 mp -62.3 -36.1 81.09 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.605 -0.725 . . . . 0.0 110.61 179.647 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 374' ' ' SER . . . . . . . . . . . . . 92.0 p -71.02 -48.93 50.19 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.086 179.433 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 375' ' ' GLU . . . . . . . . . . . . . 43.3 mt-10 -62.97 -23.15 67.29 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.143 179.011 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 376' ' ' PHE . . . . . . . . . . . . . 76.9 t80 -85.13 -29.05 25.13 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.696 -0.684 . . . . 0.0 110.163 179.529 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 377' ' ' GLY . . . . . . . . . . . . . . . -71.45 -41.89 57.26 Favored Glycine 0 C--N 1.331 0.257 0 C-N-CA 120.836 -0.697 . . . . 0.0 112.006 179.465 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 378' ' ' GLN . . . . . . . . . . . . . 4.3 pt20 -70.69 -28.01 64.44 Favored 'General case' 0 C--N 1.331 -0.196 0 N-CA-C 109.224 -0.658 . . . . 0.0 109.224 179.22 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 379' ' ' PHE . . . . . . . . . . . . . 3.7 t80 -82.34 -22.03 35.74 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 114.926 -1.034 . . . . 0.0 109.744 179.05 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 380' ' ' LEU . . . . . . . . . . . . . 18.8 tp -67.79 141.78 95.16 Favored Pre-proline 0 C--N 1.329 -0.306 0 CA-C-N 115.307 -0.86 . . . . 0.0 110.333 179.483 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 381' ' ' PRO . . . . . 0.506 ' HD3' ' HG3' ' A' ' 373' ' ' MET . 74.0 Cg_exo -48.26 149.34 6.44 Favored 'Trans proline' 0 C--N 1.35 0.637 0 C-N-CA 122.187 1.925 . . . . 0.0 112.115 179.911 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 382' ' ' ASP . . . . . 0.582 ' H ' ' HG3' ' A' ' 377' ' ' ARG . 15.6 t70 -82.84 137.99 34.1 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.893 -179.898 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 383' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 1.001 0 CA-C-O 118.248 -0.882 . . . . 0.0 111.069 179.963 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 358' ' ' ASP . . . . . . . . . . . . . 20.7 t70 . . . . . 0 N--CA 1.486 1.325 0 CA-C-O 120.799 0.333 . . . . 0.0 111.065 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 359' ' ' PHE . . . . . . . . . . . . . 71.9 t80 -110.63 142.2 42.81 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.042 -179.801 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 360' ' ' THR . . . . . 0.62 ' H ' ' HD2' ' A' ' 361' ' ' PRO . 62.6 m -155.53 -53.68 0.02 OUTLIER Pre-proline 0 CA--C 1.534 0.341 0 CA-C-N 116.048 -0.524 . . . . 0.0 111.431 179.716 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 361' ' ' PRO . . . . . 0.62 ' HD2' ' H ' ' A' ' 360' ' ' THR . 90.0 Cg_endo -80.7 126.04 5.77 Favored 'Trans proline' 0 C--N 1.353 0.767 0 C-N-CA 122.06 1.84 . . . . 0.0 112.418 179.878 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 362' ' ' MET . . . . . . . . . . . . . 18.3 ttt -68.11 -71.49 0.21 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.758 179.962 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 363' ' ' ASP . . . . . . . . . . . . . 15.6 t70 -173.97 -39.49 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.304 -179.804 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 364' ' ' SER . . . . . . . . . . . . . 54.3 m -106.8 -73.47 0.69 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.792 -0.64 . . . . 0.0 110.463 179.665 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 365' ' ' SER . . . . . 0.446 ' HB2' ' HB2' ' A' ' 368' ' ' TYR . 80.3 p -173.36 77.26 0.04 OUTLIER 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.141 179.737 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 366' ' ' ALA . . . . . . . . . . . . . . . -78.5 -41.26 32.89 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.81 179.646 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 367' ' ' VAL . . . . . . . . . . . . . 23.5 t -65.58 -20.76 27.98 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.697 179.747 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 368' ' ' TYR . . . . . 0.446 ' HB2' ' HB2' ' A' ' 365' ' ' SER . 25.7 t80 -71.01 -49.64 42.88 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.017 -179.808 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 369' ' ' VAL . . . . . 0.461 ' HB ' ' HB2' ' B' ' 336' ' ' GLN . 6.5 p -68.46 -44.46 83.2 Favored 'Isoleucine or valine' 0 C--O 1.233 0.217 0 CA-C-N 116.433 -0.349 . . . . 0.0 110.881 179.908 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 370' ' ' LEU . . . . . 0.41 ' N ' HG13 ' A' ' 369' ' ' VAL . 90.4 mt -60.43 -42.34 95.88 Favored 'General case' 0 C--O 1.233 0.236 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.887 179.807 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 371' ' ' SER . . . . . . . . . . . . . 87.6 p -72.64 -34.94 67.63 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.772 179.863 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 372' ' ' SER . . . . . . . . . . . . . 45.8 t -61.14 -42.81 99.23 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.341 -0.39 . . . . 0.0 111.185 -179.679 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 373' ' ' MET . . . . . 0.435 ' HB2' ' HD3' ' B' ' 381' ' ' PRO . 22.4 ptp -76.71 -38.4 54.41 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.432 -0.349 . . . . 0.0 111.722 -179.419 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 374' ' ' ALA . . . . . 0.483 ' HB3' ' OE1' ' B' ' 303' ' ' GLU . . . -78.62 -13.15 59.97 Favored 'General case' 0 C--N 1.33 -0.25 0 N-CA-C 112.015 0.376 . . . . 0.0 112.015 -179.421 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 375' ' ' ARG . . . . . . . . . . . . . 22.3 ttp180 -100.5 -32.62 10.7 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.823 0.345 . . . . 0.0 110.768 179.635 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 376' ' ' GLN . . . . . . . . . . . . . 22.8 tp60 -58.69 -24.84 62.1 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.121 -0.491 . . . . 0.0 111.181 -179.94 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 377' ' ' ARG . . . . . 0.645 ' HB3' ' HA ' ' B' ' 381' ' ' PRO . 16.5 ptm180 -62.04 -34.39 76.14 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.885 0.374 . . . . 0.0 110.695 -179.955 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 378' ' ' ARG . . . . . . . . . . . . . 20.5 tpp180 -156.75 107.19 2.33 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.641 179.862 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 379' ' ' ALA . . . . . . . . . . . . . . . -130.5 130.6 44.4 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.082 -0.508 . . . . 0.0 111.129 -179.835 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 380' ' ' SER . . . . . . . . . . . . . 50.9 m . . . . . 0 C--O 1.248 1.023 0 CA-C-O 118.256 -0.878 . . . . 0.0 110.922 179.866 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' B' B ' 295' ' ' SER . . . . . . . . . . . . . 44.8 t . . . . . 0 N--CA 1.486 1.334 0 CA-C-O 120.798 0.332 . . . . 0.0 110.943 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' B' B ' 296' ' ' LEU . . . . . . . . . . . . . 61.7 tp -155.37 -30.41 0.1 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.977 -179.806 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 297' ' ' GLN . . . . . . . . . . . . . 48.2 tt0 -73.41 -36.42 65.99 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.904 179.951 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 298' ' ' ASN . . . . . . . . . . . . . 38.3 m-80 -130.98 101.87 5.8 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.964 -179.976 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 299' ' ' ASN . . . . . . . . . . . . . 53.6 t30 -166.02 -74.33 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.75 179.874 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 300' ' ' GLN . . . . . . . . . . . . . 10.4 pt20 -169.71 69.45 0.63 Allowed Pre-proline 0 C--N 1.331 -0.215 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.363 179.839 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 301' ' ' PRO . . . . . . . . . . . . . 63.5 Cg_endo -73.35 116.86 4.85 Favored 'Trans proline' 0 C--N 1.346 0.409 0 C-N-CA 122.451 2.101 . . . . 0.0 112.07 179.718 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 302' ' ' VAL . . . . . . . . . . . . . 15.0 p -88.07 -39.52 12.85 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.232 0 CA-C-N 116.323 -0.398 . . . . 0.0 111.293 -179.727 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 303' ' ' GLU . . . . . 0.483 ' OE1' ' HB3' ' A' ' 374' ' ' ALA . 55.3 mm-40 -65.04 -51.13 63.27 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.169 -0.468 . . . . 0.0 111.402 -179.465 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 304' ' ' PHE . . . . . . . . . . . . . 85.6 m-85 -59.99 -57.39 13.07 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.329 -179.815 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 305' ' ' ASN . . . . . . . . . . . . . 6.6 t30 -51.07 -55.16 19.0 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.874 -179.279 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 306' ' ' HIS . . . . . . . . . . . . . 12.2 m-70 -61.24 -64.1 1.07 Allowed 'General case' 0 C--N 1.33 -0.267 0 N-CA-C 112.357 0.503 . . . . 0.0 112.357 -178.947 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 307' ' ' ALA . . . . . . . . . . . . . . . -53.08 -57.13 11.47 Favored 'General case' 0 N--CA 1.464 0.245 0 N-CA-C 112.468 0.544 . . . . 0.0 112.468 -178.736 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 308' ' ' ILE . . . . . 0.578 HG23 HG23 ' A' ' 360' ' ' THR . 87.4 mt -53.58 -53.57 24.5 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 N-CA-C 111.985 0.365 . . . . 0.0 111.985 -179.298 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 309' ' ' ASN . . . . . . . . . . . . . 50.2 t30 -59.46 -30.44 68.52 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.811 0.338 . . . . 0.0 110.951 -179.706 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 310' ' ' TYR . . . . . . . . . . . . . 74.8 t80 -66.99 -51.57 53.43 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.021 -179.78 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 311' ' ' VAL . . . . . . . . . . . . . 46.2 t -61.19 -52.14 64.89 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.224 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.065 -179.832 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 312' ' ' ASN . . . . . . . . . . . . . 27.6 t-20 -59.37 -34.3 72.24 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.339 -0.392 . . . . 0.0 110.976 -179.951 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 313' ' ' LYS . . . . . . . . . . . . . 39.8 tttp -62.41 -63.14 1.32 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.978 179.957 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 314' ' ' ILE . . . . . . . . . . . . . 97.9 mt -60.28 -27.79 40.35 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.352 -179.792 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 315' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -66.5 -46.34 76.6 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.413 -0.358 . . . . 0.0 110.741 -179.969 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 316' ' ' ASN . . . . . . . . . . . . . 6.7 t30 -72.48 -47.45 48.58 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.264 -179.732 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 317' ' ' ARG . . . . . . . . . . . . . 1.4 tmt_? -62.8 -63.9 1.08 Allowed 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.031 -179.836 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 318' ' ' PHE . . . . . . . . . . . . . 87.0 m-85 -85.11 40.93 0.85 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.121 -0.49 . . . . 0.0 111.043 -179.991 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 319' ' ' GLN . . . . . . . . . . . . . 35.0 tt0 -70.07 -22.61 63.04 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.885 -179.981 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 320' ' ' GLY . . . . . . . . . . . . . . . -86.59 -13.61 67.23 Favored Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.833 -0.699 . . . . 0.0 112.726 -179.793 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 321' ' ' GLN . . . . . . . . . . . . . 22.3 mp0 -110.28 93.41 15.69 Favored Pre-proline 0 C--N 1.329 -0.324 0 CA-C-O 120.416 0.151 . . . . 0.0 110.921 -179.928 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 322' ' ' PRO . . . . . . . . . . . . . 92.1 Cg_endo -79.73 -22.86 7.41 Favored 'Trans proline' 0 C--N 1.348 0.517 0 C-N-CA 122.548 2.165 . . . . 0.0 112.38 179.833 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 323' ' ' ASP . . . . . . . . . . . . . 6.0 m-20 -71.09 -48.01 54.89 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.29 -179.569 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 324' ' ' ILE . . . . . . . . . . . . . 64.0 mt -70.23 -43.07 78.98 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.415 -0.357 . . . . 0.0 111.251 -179.881 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 325' ' ' TYR . . . . . . . . . . . . . 30.8 t80 -62.1 -48.14 81.47 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 120.902 0.382 . . . . 0.0 110.75 179.984 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 326' ' ' LYS . . . . . 0.403 ' O ' ' HG2' ' B' ' 330' ' ' GLU . 87.3 tttt -62.02 -50.11 73.35 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.824 179.896 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 327' ' ' ALA . . . . . 0.412 ' O ' ' HB2' ' B' ' 330' ' ' GLU . . . -54.45 -43.55 71.74 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.185 179.946 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 328' ' ' PHE . . . . . . . . . . . . . 84.5 t80 -59.39 -57.03 14.79 Favored 'General case' 0 C--O 1.235 0.331 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.569 179.927 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 329' ' ' LEU . . . . . . . . . . . . . 91.3 mt -56.85 -28.52 61.78 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.428 179.658 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 330' ' ' GLU . . . . . 0.412 ' HB2' ' O ' ' B' ' 327' ' ' ALA . 22.5 mm-40 -66.52 -44.47 82.37 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.175 179.217 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 331' ' ' ILE . . . . . . . . . . . . . 71.1 mt -61.33 -39.8 83.94 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.12 0 N-CA-C 109.78 -0.452 . . . . 0.0 109.78 178.828 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 332' ' ' LEU . . . . . . . . . . . . . 1.1 mm? -66.61 -36.22 82.07 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.533 -0.758 . . . . 0.0 110.646 179.5 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 333' ' ' HIS . . . . . . . . . . . . . 47.2 t-80 -67.52 -56.44 9.51 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.671 179.731 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 334' ' ' THR . . . . . . . . . . . . . 35.0 m -59.36 -37.78 78.74 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.805 179.697 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 335' ' ' TYR . . . . . . . . . . . . . 32.2 t80 -60.35 -48.34 82.17 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.473 179.554 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 336' ' ' GLN . . . . . 0.461 ' HB2' ' HB ' ' A' ' 369' ' ' VAL . 54.8 tp60 -60.94 -40.22 92.47 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.477 179.535 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 337' ' ' LYS . . . . . 0.459 ' NZ ' ' HB3' ' B' ' 337' ' ' LYS . 4.7 ttpm? -60.11 -47.7 84.8 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.643 179.683 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 338' ' ' GLU . . . . . 0.428 ' HG3' ' HB3' ' B' ' 352' ' ' ALA . 61.6 mm-40 -58.78 -42.02 88.03 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.627 179.572 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 339' ' ' GLN . . . . . . . . . . . . . 29.1 tt0 -61.94 -44.79 96.03 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.707 179.844 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 340' ' ' ARG . . . . . 0.403 ' HE ' HE21 ' B' ' 336' ' ' GLN . 99.7 mtt180 -57.05 -53.78 54.25 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.673 179.825 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 341' ' ' ASN . . . . . . . . . . . . . 45.5 t-20 -55.52 -39.89 71.1 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.557 179.86 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 342' ' ' ALA . . . . . . . . . . . . . . . -60.23 -41.99 94.3 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.843 179.863 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 343' ' ' LYS . . . . . . . . . . . . . 14.5 mptt -74.7 -27.19 60.29 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.847 179.706 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 344' ' ' GLU . . . . . . . . . . . . . 20.2 mm-40 -67.94 -40.05 83.37 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.69 179.556 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 345' ' ' ALA . . . . . . . . . . . . . . . -72.38 -10.03 59.27 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.008 179.748 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 346' ' ' GLY . . . . . . . . . . . . . . . 69.78 32.7 70.47 Favored Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.878 -0.677 . . . . 0.0 112.547 179.947 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 347' ' ' GLY . . . . . . . . . . . . . . . 101.88 -176.98 26.4 Favored Glycine 0 N--CA 1.452 -0.249 0 C-N-CA 120.751 -0.737 . . . . 0.0 112.499 179.997 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 348' ' ' ASN . . . . . . . . . . . . . 56.2 t30 64.39 3.01 1.7 Allowed 'General case' 0 N--CA 1.464 0.238 0 CA-C-O 120.701 0.286 . . . . 0.0 111.335 179.87 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 349' ' ' TYR . . . . . . . . . . . . . 61.8 t80 -103.1 147.71 26.64 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.769 0.319 . . . . 0.0 110.692 179.896 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 350' ' ' THR . . . . . . . . . . . . . 30.5 m -115.38 101.99 54.41 Favored Pre-proline 0 C--N 1.33 -0.279 0 CA-C-N 116.233 -0.439 . . . . 0.0 111.121 -179.919 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 351' ' ' PRO . . . . . . . . . . . . . 58.7 Cg_exo -52.67 141.6 53.07 Favored 'Trans proline' 0 C--N 1.347 0.486 0 C-N-CA 122.52 2.147 . . . . 0.0 112.297 179.75 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 352' ' ' ALA . . . . . 0.428 ' HB3' ' HG3' ' B' ' 338' ' ' GLU . . . -68.12 -23.17 64.87 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.894 179.848 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 353' ' ' LEU . . . . . 0.522 ' HG ' ' HG2' ' B' ' 357' ' ' GLU . 4.7 mp -131.93 124.11 28.77 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.119 -0.492 . . . . 0.0 111.225 179.848 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 354' ' ' THR . . . . . . . . . . . . . 75.6 p -114.76 -170.73 1.8 Allowed 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.716 -0.675 . . . . 0.0 109.594 178.66 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 355' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 -57.87 -35.98 71.71 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.093 0.473 . . . . 0.0 110.063 179.271 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 356' ' ' GLN . . . . . . . . . . . . . 5.9 tp-100 -73.1 -42.6 62.78 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 115.719 -0.673 . . . . 0.0 111.127 179.97 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 357' ' ' GLU . . . . . 0.522 ' HG2' ' HG ' ' B' ' 353' ' ' LEU . 9.4 tp10 -58.97 -56.14 26.14 Favored 'General case' 0 C--O 1.232 0.176 0 CA-C-N 116.479 -0.328 . . . . 0.0 110.893 -179.779 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 358' ' ' VAL . . . . . 0.509 ' O ' HG23 ' B' ' 362' ' ' VAL . 47.1 t -59.61 -55.1 26.11 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.115 179.912 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 359' ' ' TYR . . . . . . . . . . . . . 67.2 t80 -54.92 -29.71 56.86 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.566 -0.288 . . . . 0.0 111.457 -179.551 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 360' ' ' ALA . . . . . . . . . . . . . . . -70.38 -60.83 2.04 Favored 'General case' 0 C--O 1.234 0.281 0 CA-C-N 116.439 -0.346 . . . . 0.0 111.494 -179.745 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 361' ' ' GLN . . . . . . . . . . . . . 97.6 mt-30 -55.79 -40.48 72.73 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.925 0.393 . . . . 0.0 110.792 -179.892 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 362' ' ' VAL . . . . . 0.509 HG23 ' O ' ' B' ' 358' ' ' VAL . 91.2 t -66.38 -38.25 81.39 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.71 179.616 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 363' ' ' ALA . . . . . . . . . . . . . . . -59.42 -42.73 92.53 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 116.257 -0.428 . . . . 0.0 110.383 179.296 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 364' ' ' ARG . . . . . . . . . . . . . 36.3 ttm180 -77.78 -21.99 50.82 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.834 -0.621 . . . . 0.0 110.367 179.264 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 365' ' ' LEU . . . . . . . . . . . . . 10.4 tp -64.26 -29.81 70.89 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.75 -0.659 . . . . 0.0 110.919 179.909 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 366' ' ' PHE . . . . . 0.653 ' HB3' ' HB2' ' B' ' 369' ' ' GLN . 69.4 m-85 -118.32 -59.41 1.89 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.174 -179.824 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 367' ' ' LYS . . . . . . . . . . . . . 39.7 ttpt 68.55 -80.53 0.04 OUTLIER 'General case' 0 N--CA 1.463 0.184 0 CA-C-N 115.948 -0.569 . . . . 0.0 111.595 179.79 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 368' ' ' ASN . . . . . . . . . . . . . 31.2 p-10 -58.47 -17.63 22.44 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.223 -179.477 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 369' ' ' GLN . . . . . 0.653 ' HB2' ' HB3' ' B' ' 366' ' ' PHE . 15.3 mm100 -109.58 97.54 7.08 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.964 -179.999 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 370' ' ' GLU . . . . . . . . . . . . . 44.9 mt-10 -93.91 -11.53 30.81 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.057 179.714 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 371' ' ' ASP . . . . . . . . . . . . . 13.6 m-20 -57.93 -64.12 1.02 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.935 -179.758 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 372' ' ' LEU . . . . . 0.553 HD12 ' N ' ' B' ' 373' ' ' LEU . 0.4 OUTLIER -61.98 -22.57 65.77 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.965 179.824 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' B' B ' 373' ' ' LEU . . . . . 0.553 ' N ' HD12 ' B' ' 372' ' ' LEU . 4.3 tp -68.76 -43.15 76.42 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.3 179.918 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 374' ' ' SER . . . . . . . . . . . . . 53.1 m -69.12 -48.25 62.97 Favored 'General case' 0 C--O 1.236 0.373 0 N-CA-C 109.676 -0.491 . . . . 0.0 109.676 179.053 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 375' ' ' GLU . . . . . . . . . . . . . 42.0 tt0 -56.47 -32.53 65.07 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 115.747 -0.66 . . . . 0.0 109.701 178.989 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 376' ' ' PHE . . . . . . . . . . . . . 93.3 t80 -78.12 -33.44 50.54 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 115.804 -0.635 . . . . 0.0 110.066 179.014 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 377' ' ' GLY . . . . . . . . . . . . . . . -60.52 -36.49 91.45 Favored Glycine 0 N--CA 1.449 -0.467 0 C-N-CA 120.725 -0.75 . . . . 0.0 111.632 179.506 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 378' ' ' GLN . . . . . . . . . . . . . 54.5 mt-30 -56.55 -30.76 63.48 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.666 0.269 . . . . 0.0 110.823 179.464 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 379' ' ' PHE . . . . . . . . . . . . . 78.6 m-85 -66.87 -45.06 79.3 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.392 -0.367 . . . . 0.0 110.85 179.871 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 380' ' ' LEU . . . . . . . . . . . . . 92.5 mt -53.63 132.57 55.4 Favored Pre-proline 0 C--N 1.33 -0.268 0 CA-C-N 116.373 -0.376 . . . . 0.0 110.193 179.451 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 381' ' ' PRO . . . . . 0.645 ' HA ' ' HB3' ' A' ' 377' ' ' ARG . 53.4 Cg_exo -52.33 171.06 0.21 Allowed 'Trans proline' 0 C--N 1.348 0.528 0 C-N-CA 122.263 1.975 . . . . 0.0 112.55 -179.581 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 382' ' ' ASP . . . . . . . . . . . . . 28.5 m-20 -64.18 169.29 4.62 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.943 -179.998 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 383' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.087 0 CA-C-O 118.284 -0.865 . . . . 0.0 111.341 -179.89 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 358' ' ' ASP . . . . . . . . . . . . . 5.3 p-10 . . . . . 0 N--CA 1.487 1.378 0 CA-C-O 120.817 0.341 . . . . 0.0 110.82 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 359' ' ' PHE . . . . . . . . . . . . . 24.7 m-85 -100.22 104.79 16.31 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.145 -179.975 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 360' ' ' THR . . . . . 0.485 ' N ' ' HB2' ' A' ' 364' ' ' SER . 35.7 p -62.31 161.15 27.14 Favored Pre-proline 0 C--N 1.329 -0.305 0 CA-C-N 115.894 -0.594 . . . . 0.0 110.918 179.848 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 361' ' ' PRO . . . . . 0.451 ' HD2' ' HB ' ' A' ' 360' ' ' THR . 89.6 Cg_exo -42.95 -67.16 0.13 Allowed 'Trans proline' 0 C--N 1.35 0.625 0 C-N-CA 122.965 2.444 . . . . 0.0 113.613 -179.667 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 362' ' ' MET . . . . . . . . . . . . . 22.6 ptt? -118.59 -26.46 6.16 Favored 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 111.724 0.268 . . . . 0.0 111.724 -179.474 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 363' ' ' ASP . . . . . 0.455 ' HB2' ' OG1' ' A' ' 360' ' ' THR . 5.7 m-20 -67.62 0.04 3.52 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.571 -0.286 . . . . 0.0 111.175 -179.699 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 364' ' ' SER . . . . . 0.485 ' HB2' ' N ' ' A' ' 360' ' ' THR . 65.8 m -158.15 -23.48 0.08 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.365 -0.38 . . . . 0.0 111.057 179.685 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 365' ' ' SER . . . . . 0.432 ' HB3' ' O ' ' A' ' 361' ' ' PRO . 32.7 t -120.22 44.68 2.38 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.495 -0.32 . . . . 0.0 111.593 -179.498 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 366' ' ' ALA . . . . . 0.55 ' H ' HG11 ' B' ' 311' ' ' VAL . . . -62.47 -10.96 13.38 Favored 'General case' 0 C--O 1.234 0.268 0 CA-C-O 121.127 0.489 . . . . 0.0 110.551 179.036 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 367' ' ' VAL . . . . . 0.654 HG23 ' HB3' ' B' ' 307' ' ' ALA . 8.5 p -47.58 -22.99 0.56 Allowed 'Isoleucine or valine' 0 C--O 1.226 -0.178 0 CA-C-N 115.519 -0.764 . . . . 0.0 111.464 -179.969 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 368' ' ' TYR . . . . . . . . . . . . . 85.6 t80 -61.34 -66.09 0.59 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.896 0.379 . . . . 0.0 110.568 179.548 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 369' ' ' VAL . . . . . 0.51 HG11 ' HB3' ' B' ' 332' ' ' LEU . 4.3 p -58.42 -39.21 73.91 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.622 179.609 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 370' ' ' LEU . . . . . 0.462 HD23 ' HA ' ' B' ' 307' ' ' ALA . 2.7 mp -64.78 -35.91 82.63 Favored 'General case' 0 C--O 1.233 0.222 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.152 179.918 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 371' ' ' SER . . . . . . . . . . . . . 37.6 m -66.56 -44.99 80.82 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.387 -0.369 . . . . 0.0 110.856 -179.935 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 372' ' ' SER . . . . . . . . . . . . . 43.6 t -65.19 -36.28 83.69 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.389 -0.369 . . . . 0.0 110.869 179.724 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 373' ' ' MET . . . . . 0.417 ' SD ' HD23 ' B' ' 380' ' ' LEU . 51.4 ttm -66.0 -43.78 86.74 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.888 -179.42 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 374' ' ' ALA . . . . . . . . . . . . . . . -79.56 -42.16 25.65 Favored 'General case' 0 C--N 1.33 -0.245 0 N-CA-C 112.591 0.589 . . . . 0.0 112.591 -179.023 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 375' ' ' ARG . . . . . 0.501 ' HG2' ' HG2' ' B' ' 303' ' ' GLU . 18.1 mmm180 -66.96 -35.72 80.61 Favored 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 111.905 0.335 . . . . 0.0 111.905 -179.163 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 376' ' ' GLN . . . . . 0.454 ' HG3' ' H ' ' A' ' 378' ' ' ARG . 24.1 tp60 -51.34 -82.45 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.617 -0.265 . . . . 0.0 111.478 -179.554 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 377' ' ' ARG . . . . . 0.518 ' H ' ' HB3' ' B' ' 381' ' ' PRO . 99.5 mtt180 52.24 44.95 29.25 Favored 'General case' 0 C--O 1.232 0.159 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.928 -179.607 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 378' ' ' ARG . . . . . 0.454 ' H ' ' HG3' ' A' ' 376' ' ' GLN . 31.3 tpt180 63.07 -85.15 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 115.804 -0.635 . . . . 0.0 111.175 179.989 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 379' ' ' ALA . . . . . . . . . . . . . . . -145.59 170.7 15.93 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.821 0.343 . . . . 0.0 111.327 -179.843 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 380' ' ' SER . . . . . . . . . . . . . 39.8 t . . . . . 0 C--O 1.25 1.124 0 CA-C-O 118.258 -0.877 . . . . 0.0 111.076 179.903 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' B' B ' 295' ' ' SER . . . . . . . . . . . . . 50.6 m . . . . . 0 N--CA 1.485 1.28 0 CA-C-O 120.597 0.236 . . . . 0.0 110.882 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' B' B ' 296' ' ' LEU . . . . . . . . . . . . . 60.6 tp 62.28 105.47 0.03 OUTLIER 'General case' 0 C--N 1.332 -0.162 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.09 179.987 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 297' ' ' GLN . . . . . . . . . . . . . 82.0 mm-40 60.35 -174.58 0.11 Allowed 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.979 179.926 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 298' ' ' ASN . . . . . . . . . . . . . 27.4 t-20 -85.34 108.62 17.91 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.878 179.936 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 299' ' ' ASN . . . . . . . . . . . . . 64.1 t30 -163.63 137.61 5.79 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.666 -179.95 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 300' ' ' GLN . . . . . 0.486 ' N ' ' HD2' ' B' ' 301' ' ' PRO . 15.2 mm100 -80.91 -52.21 0.88 Allowed Pre-proline 0 CA--C 1.534 0.329 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.606 -179.822 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 301' ' ' PRO . . . . . 0.488 ' HB2' ' HB2' ' B' ' 304' ' ' PHE . 56.2 Cg_endo -69.78 127.62 14.84 Favored 'Trans proline' 0 C--N 1.352 0.754 0 C-N-CA 122.068 1.845 . . . . 0.0 112.217 179.983 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 302' ' ' VAL . . . . . 0.499 HG13 ' N ' ' B' ' 303' ' ' GLU . 4.0 p -91.41 -53.15 9.23 Favored 'Isoleucine or valine' 0 C--O 1.234 0.286 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.319 -179.776 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 303' ' ' GLU . . . . . 0.501 ' HG2' ' HG2' ' A' ' 375' ' ' ARG . 0.0 OUTLIER -58.78 -21.84 56.82 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.675 -179.499 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' B' B ' 304' ' ' PHE . . . . . 0.488 ' HB2' ' HB2' ' B' ' 301' ' ' PRO . 73.4 t80 -55.96 -82.22 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.518 -0.31 . . . . 0.0 110.839 -179.763 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 305' ' ' ASN . . . . . . . . . . . . . 3.7 p-10 -62.21 -33.58 74.83 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.459 -179.48 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 306' ' ' HIS . . . . . . . . . . . . . 7.8 t-160 -63.31 -71.02 0.18 Allowed 'General case' 0 C--O 1.233 0.221 0 CA-C-O 120.661 0.267 . . . . 0.0 111.651 -179.163 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 307' ' ' ALA . . . . . 0.654 ' HB3' HG23 ' A' ' 367' ' ' VAL . . . -55.51 -47.93 75.45 Favored 'General case' 0 C--N 1.33 -0.266 0 N-CA-C 112.003 0.372 . . . . 0.0 112.003 -179.062 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 308' ' ' ILE . . . . . . . . . . . . . 22.4 mm -53.07 -57.57 4.41 Favored 'Isoleucine or valine' 0 C--O 1.233 0.226 0 CA-C-O 120.669 0.271 . . . . 0.0 111.444 -179.759 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 309' ' ' ASN . . . . . . . . . . . . . 93.5 m-20 -61.27 -26.19 67.6 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.404 -0.362 . . . . 0.0 111.236 -179.623 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 310' ' ' TYR . . . . . 0.476 ' OH ' ' HB2' ' B' ' 375' ' ' GLU . 0.3 OUTLIER -71.4 -50.52 31.18 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.567 -0.288 . . . . 0.0 111.327 -179.838 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' B' B ' 311' ' ' VAL . . . . . 0.55 HG11 ' H ' ' A' ' 366' ' ' ALA . 15.2 t -63.46 -39.0 83.69 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.225 0 CA-C-N 116.506 -0.315 . . . . 0.0 111.071 -179.546 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 312' ' ' ASN . . . . . . . . . . . . . 6.7 t30 -69.39 -41.93 75.82 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.145 -179.95 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 313' ' ' LYS . . . . . 0.46 ' HB3' ' NZ ' ' B' ' 313' ' ' LYS . 0.0 OUTLIER -61.32 -46.42 90.36 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.018 -0.537 . . . . 0.0 111.746 -179.631 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' B' B ' 314' ' ' ILE . . . . . . . . . . . . . 79.9 mt -74.71 -36.45 40.37 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 N-CA-C 111.827 0.306 . . . . 0.0 111.827 -179.248 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 315' ' ' LYS . . . . . . . . . . . . . 1.6 tmmt? -67.24 -30.56 70.5 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.551 -0.295 . . . . 0.0 111.243 -179.656 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 316' ' ' ASN . . . . . . . . . . . . . 46.9 t-20 -88.85 -45.04 10.05 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.52 -0.309 . . . . 0.0 111.086 -179.854 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 317' ' ' ARG . . . . . . . . . . . . . 22.5 tpp180 -68.79 -63.86 0.98 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.423 -0.353 . . . . 0.0 111.124 -179.757 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 318' ' ' PHE . . . . . . . . . . . . . 97.2 m-85 -80.13 27.87 0.31 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.139 -179.827 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 319' ' ' GLN . . . . . . . . . . . . . 56.9 tt0 -61.46 -32.23 72.22 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.914 179.992 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 320' ' ' GLY . . . . . . . . . . . . . . . -74.35 -15.85 80.09 Favored Glycine 0 N--CA 1.45 -0.385 0 C-N-CA 120.873 -0.68 . . . . 0.0 112.637 -179.877 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 321' ' ' GLN . . . . . 0.474 ' HG2' HD12 ' B' ' 324' ' ' ILE . 6.2 tp-100 -109.75 92.68 12.81 Favored Pre-proline 0 C--N 1.33 -0.239 0 CA-C-O 120.401 0.143 . . . . 0.0 110.803 179.914 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 322' ' ' PRO . . . . . . . . . . . . . 90.9 Cg_endo -79.66 -19.01 10.25 Favored 'Trans proline' 0 C--N 1.346 0.426 0 C-N-CA 122.604 2.203 . . . . 0.0 112.723 -179.921 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 323' ' ' ASP . . . . . . . . . . . . . 25.9 m-20 -70.05 -54.51 12.78 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.389 -0.369 . . . . 0.0 111.217 -179.652 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 324' ' ' ILE . . . . . 0.474 HD12 ' HG2' ' B' ' 321' ' ' GLN . 56.0 mt -62.05 -47.82 91.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.253 -0.43 . . . . 0.0 111.338 -179.871 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 325' ' ' TYR . . . . . 0.408 ' O ' ' HG ' ' B' ' 329' ' ' LEU . 18.0 t80 -59.35 -51.6 69.24 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.275 -0.42 . . . . 0.0 111.278 -179.51 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 326' ' ' LYS . . . . . . . . . . . . . 87.8 tttt -55.7 -50.41 70.38 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.37 -0.377 . . . . 0.0 111.28 -179.868 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 327' ' ' ALA . . . . . . . . . . . . . . . -52.75 -50.13 64.08 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.083 -179.998 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 328' ' ' PHE . . . . . . . . . . . . . 51.4 t80 -54.59 -43.72 72.37 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.481 179.893 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 329' ' ' LEU . . . . . 0.408 ' HG ' ' O ' ' B' ' 325' ' ' TYR . 86.4 mt -63.07 -36.32 83.18 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.862 -0.608 . . . . 0.0 110.865 179.635 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 330' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -65.09 -37.7 88.35 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.702 179.74 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 331' ' ' ILE . . . . . 0.41 HG22 HG22 ' B' ' 358' ' ' VAL . 72.9 mt -66.91 -52.24 46.41 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.12 179.818 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 332' ' ' LEU . . . . . 0.51 ' HB3' HG11 ' A' ' 369' ' ' VAL . 8.4 mp -64.45 -32.89 74.71 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.233 -0.439 . . . . 0.0 111.339 -179.86 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 333' ' ' HIS . . . . . . . . . . . . . 56.7 t-80 -66.02 -57.81 6.93 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.059 0.457 . . . . 0.0 110.032 179.38 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 334' ' ' THR . . . . . . . . . . . . . 10.8 m -60.1 -26.23 66.05 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.252 179.402 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 335' ' ' TYR . . . . . . . . . . . . . 77.4 t80 -65.98 -49.6 67.28 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.011 179.205 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 336' ' ' GLN . . . . . . . . . . . . . 7.3 mm100 -62.53 -33.57 75.17 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.203 179.088 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 337' ' ' LYS . . . . . . . . . . . . . 37.2 ttpt -63.35 -58.98 5.33 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.986 -0.552 . . . . 0.0 111.251 179.682 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 338' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -63.97 -28.91 70.14 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.35 -0.386 . . . . 0.0 111.383 -179.535 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 339' ' ' GLN . . . . . . . . . . . . . 65.5 tt0 -68.16 -49.83 58.44 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.938 0.399 . . . . 0.0 110.573 179.885 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 340' ' ' ARG . . . . . . . . . . . . . 83.1 mtp180 -63.94 -51.72 63.09 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.74 179.781 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 341' ' ' ASN . . . . . . . . . . . . . 4.6 m-20 -52.32 -47.45 65.99 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.076 -0.511 . . . . 0.0 111.06 179.757 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 342' ' ' ALA . . . . . . . . . . . . . . . -67.84 -31.22 70.9 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.892 179.857 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 343' ' ' LYS . . . . . . . . . . . . . 87.3 tttt -75.9 -20.51 57.97 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.611 179.896 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 344' ' ' GLU . . . . . . . . . . . . . 18.5 mm-40 -84.25 -44.26 14.06 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.966 -0.561 . . . . 0.0 111.06 179.949 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 345' ' ' ALA . . . . . . . . . . . . . . . -63.38 -41.93 98.81 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.982 179.929 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 346' ' ' GLY . . . . . . . . . . . . . . . 42.8 47.95 6.11 Favored Glycine 0 C--N 1.333 0.385 0 CA-C-N 115.989 -0.55 . . . . 0.0 112.826 179.874 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 347' ' ' GLY . . . . . . . . . . . . . . . -150.1 -123.74 1.2 Allowed Glycine 0 N--CA 1.45 -0.372 0 C-N-CA 120.585 -0.817 . . . . 0.0 112.974 -179.742 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 348' ' ' ASN . . . . . . . . . . . . . 7.8 t30 -82.34 -14.42 55.34 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.621 0.248 . . . . 0.0 111.488 -179.475 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 349' ' ' TYR . . . . . . . . . . . . . 59.6 t80 -54.52 140.25 35.21 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.84 0.353 . . . . 0.0 111.097 -179.812 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 350' ' ' THR . . . . . . . . . . . . . 43.2 m -117.65 128.86 25.73 Favored Pre-proline 0 C--N 1.329 -0.297 0 CA-C-N 116.055 -0.521 . . . . 0.0 110.593 179.563 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 351' ' ' PRO . . . . . . . . . . . . . 36.2 Cg_exo -59.17 176.31 0.53 Allowed 'Trans proline' 0 C--N 1.349 0.589 0 C-N-CA 122.332 2.021 . . . . 0.0 112.228 -179.624 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 352' ' ' ALA . . . . . . . . . . . . . . . -111.97 -55.66 2.48 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.683 -179.612 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 353' ' ' LEU . . . . . . . . . . . . . 5.3 mp -105.99 111.04 23.51 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.902 0.382 . . . . 0.0 111.491 -179.542 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 354' ' ' THR . . . . . . . . . . . . . 60.9 p -95.94 -170.05 2.05 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.259 179.259 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 355' ' ' GLU . . . . . . . . . . . . . 41.2 mt-10 -62.03 -30.05 70.7 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 120.999 0.428 . . . . 0.0 110.38 179.659 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 356' ' ' GLN . . . . . . . . . . . . . 1.6 mp0 -72.9 -43.29 62.64 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.785 -0.643 . . . . 0.0 111.361 -179.889 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 357' ' ' GLU . . . . . . . . . . . . . 8.4 tp10 -55.98 -48.5 75.72 Favored 'General case' 0 C--O 1.233 0.194 0 CA-C-O 120.903 0.382 . . . . 0.0 110.839 -179.636 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 358' ' ' VAL . . . . . 0.492 ' O ' HG23 ' B' ' 362' ' ' VAL . 86.5 t -68.19 -59.0 4.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.019 -0.537 . . . . 0.0 111.559 -179.63 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 359' ' ' TYR . . . . . . . . . . . . . 40.2 t80 -52.43 -29.67 25.62 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.632 -0.258 . . . . 0.0 111.655 -179.01 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 360' ' ' ALA . . . . . . . . . . . . . . . -74.09 -60.68 2.15 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.847 0.356 . . . . 0.0 111.178 -179.943 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 361' ' ' GLN . . . . . . . . . . . . . 56.0 mt-30 -54.25 -36.96 64.15 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.466 179.842 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 362' ' ' VAL . . . . . 0.492 HG23 ' O ' ' B' ' 358' ' ' VAL . 87.9 t -72.06 -37.79 61.38 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-N 115.868 -0.605 . . . . 0.0 110.341 179.332 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 363' ' ' ALA . . . . . 0.741 ' HA ' HD21 ' B' ' 373' ' ' LEU . . . -57.86 -38.36 75.56 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.572 179.694 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 364' ' ' ARG . . . . . . . . . . . . . 63.3 mtm180 -90.73 -19.35 23.64 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.861 -0.609 . . . . 0.0 110.779 179.519 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 365' ' ' LEU . . . . . . . . . . . . . 24.4 tp -58.16 -37.76 75.32 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.049 -0.523 . . . . 0.0 111.511 -179.705 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 366' ' ' PHE . . . . . . . . . . . . . 75.5 m-85 -98.13 164.25 12.41 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.918 0.39 . . . . 0.0 111.425 -179.504 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 367' ' ' LYS . . . . . 0.422 ' C ' ' H ' ' B' ' 369' ' ' GLN . 65.7 mttm -96.06 87.71 4.64 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.951 -179.893 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 368' ' ' ASN . . . . . . . . . . . . . 2.4 m-20 62.05 -0.49 0.46 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.683 179.675 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 369' ' ' GLN . . . . . 0.422 ' H ' ' C ' ' B' ' 367' ' ' LYS . 3.0 tp-100 -63.69 102.84 0.49 Allowed 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.827 0.346 . . . . 0.0 110.158 179.752 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 370' ' ' GLU . . . . . . . . . . . . . 46.3 tt0 -91.82 -25.56 18.94 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.132 -0.485 . . . . 0.0 111.823 -179.048 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 371' ' ' ASP . . . . . . . . . . . . . 19.0 m-20 -49.36 -63.51 1.08 Allowed 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.879 0.371 . . . . 0.0 110.812 -179.989 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 372' ' ' LEU . . . . . 0.446 ' H ' HD12 ' B' ' 372' ' ' LEU . 7.4 mp -55.44 -45.66 76.78 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.695 179.273 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 373' ' ' LEU . . . . . 0.741 HD21 ' HA ' ' B' ' 363' ' ' ALA . 1.2 mp -59.22 -27.13 65.46 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.74 -0.664 . . . . 0.0 111.459 -179.729 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 374' ' ' SER . . . . . . . . . . . . . 67.4 m -77.92 -57.84 3.58 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.84 0.352 . . . . 0.0 110.82 -179.83 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 375' ' ' GLU . . . . . 0.476 ' HB2' ' OH ' ' B' ' 310' ' ' TYR . 10.8 mm-40 -59.87 -28.67 67.74 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.077 -0.511 . . . . 0.0 110.309 179.807 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 376' ' ' PHE . . . . . 0.529 ' HA ' ' HB2' ' B' ' 379' ' ' PHE . 79.2 t80 -83.1 -33.44 26.35 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.144 179.3 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 377' ' ' GLY . . . . . . . . . . . . . . . -60.1 -43.16 98.58 Favored Glycine 0 N--CA 1.45 -0.417 0 C-N-CA 120.747 -0.739 . . . . 0.0 111.384 179.249 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 378' ' ' GLN . . . . . . . . . . . . . 25.2 mm-40 -79.53 -18.04 52.73 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.105 0.479 . . . . 0.0 109.988 179.075 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 379' ' ' PHE . . . . . 0.529 ' HB2' ' HA ' ' B' ' 376' ' ' PHE . 0.6 OUTLIER -63.78 -29.33 70.55 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.642 -0.708 . . . . 0.0 110.287 179.621 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' B' B ' 380' ' ' LEU . . . . . 0.417 HD23 ' SD ' ' A' ' 373' ' ' MET . 42.2 mt -62.93 153.0 81.95 Favored Pre-proline 0 C--N 1.33 -0.242 0 CA-C-N 115.715 -0.675 . . . . 0.0 110.989 -179.87 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 381' ' ' PRO . . . . . 0.518 ' HB3' ' H ' ' A' ' 377' ' ' ARG . 55.0 Cg_endo -70.0 116.27 4.51 Favored 'Trans proline' 0 C--N 1.347 0.474 0 C-N-CA 122.544 2.163 . . . . 0.0 112.301 179.97 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 382' ' ' ASP . . . . . . . . . . . . . 17.5 t70 -87.18 121.61 29.86 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.814 179.983 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 383' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.087 0 CA-C-O 118.219 -0.896 . . . . 0.0 111.054 -179.957 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 358' ' ' ASP . . . . . . . . . . . . . 19.7 t70 . . . . . 0 N--CA 1.486 1.344 0 CA-C-O 120.827 0.346 . . . . 0.0 111.008 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 359' ' ' PHE . . . . . . . . . . . . . 83.6 t80 -135.64 134.62 39.43 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.905 179.909 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 360' ' ' THR . . . . . 0.421 ' HA ' ' HD2' ' A' ' 361' ' ' PRO . 69.2 p -129.75 104.69 17.15 Favored Pre-proline 0 C--N 1.33 -0.27 0 CA-C-N 116.112 -0.495 . . . . 0.0 111.066 -179.991 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 361' ' ' PRO . . . . . 0.421 ' HD2' ' HA ' ' A' ' 360' ' ' THR . 23.4 Cg_endo -61.06 -177.04 0.17 Allowed 'Trans proline' 0 C--N 1.347 0.484 0 C-N-CA 122.558 2.172 . . . . 0.0 112.506 179.971 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 362' ' ' MET . . . . . 0.502 ' SD ' HD13 ' B' ' 329' ' ' LEU . 6.9 tpt -60.67 -71.31 0.14 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.868 179.978 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 363' ' ' ASP . . . . . . . . . . . . . 15.0 t70 -172.45 -55.39 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.606 -179.914 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 364' ' ' SER . . . . . . . . . . . . . 47.2 t -102.08 -76.45 0.57 Allowed 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.978 -0.555 . . . . 0.0 110.709 179.828 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 365' ' ' SER . . . . . . . . . . . . . 70.4 m -160.71 82.64 0.67 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.083 179.852 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 366' ' ' ALA . . . . . . . . . . . . . . . -78.3 -42.65 30.2 Favored 'General case' 0 C--O 1.234 0.269 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.735 179.637 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 367' ' ' VAL . . . . . . . . . . . . . 41.4 t -57.88 -30.2 37.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 115.797 -0.638 . . . . 0.0 110.648 179.688 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 368' ' ' TYR . . . . . . . . . . . . . 84.1 t80 -67.36 -37.11 82.71 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.099 -0.501 . . . . 0.0 110.464 179.578 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 369' ' ' VAL . . . . . . . . . . . . . 10.9 t -68.63 -56.57 11.82 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 115.87 -0.605 . . . . 0.0 110.788 179.704 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 370' ' ' LEU . . . . . 0.534 ' HB2' ' HB1' ' B' ' 307' ' ' ALA . 94.5 mt -58.21 -40.42 81.55 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.925 -0.58 . . . . 0.0 111.092 -179.854 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 371' ' ' SER . . . . . 0.534 ' HA ' ' HB3' ' B' ' 303' ' ' GLU . 84.1 p -60.97 -59.12 5.88 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.092 -179.913 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 372' ' ' SER . . . . . . . . . . . . . 47.1 t -54.54 -33.87 60.82 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.789 0.328 . . . . 0.0 111.201 -179.835 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 373' ' ' MET . . . . . . . . . . . . . 53.9 ttm -64.14 -48.31 76.54 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.515 -179.811 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 374' ' ' ALA . . . . . 0.574 ' HB3' ' HG3' ' B' ' 303' ' ' GLU . . . -87.05 -6.14 58.82 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.488 -0.324 . . . . 0.0 111.852 -179.519 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 375' ' ' ARG . . . . . 0.539 ' HB2' ' HG2' ' B' ' 303' ' ' GLU . 29.6 ttt180 -91.94 -31.17 15.74 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.874 0.369 . . . . 0.0 110.932 -179.861 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 376' ' ' GLN . . . . . . . . . . . . . 52.4 tt0 -67.82 -21.41 65.21 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.004 -0.544 . . . . 0.0 111.779 -179.31 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 377' ' ' ARG . . . . . 0.531 ' HB3' ' HA ' ' B' ' 381' ' ' PRO . 16.1 ptm180 -57.73 -22.45 46.63 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.868 0.366 . . . . 0.0 110.849 -179.95 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 378' ' ' ARG . . . . . . . . . . . . . 41.5 ttm180 -124.82 -66.79 0.95 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.61 179.797 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 379' ' ' ALA . . . . . . . . . . . . . . . 54.82 92.55 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.011 -0.54 . . . . 0.0 111.315 179.926 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 380' ' ' SER . . . . . . . . . . . . . 46.9 t . . . . . 0 C--O 1.25 1.113 0 CA-C-O 118.239 -0.886 . . . . 0.0 110.899 -179.951 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' B' B ' 295' ' ' SER . . . . . . . . . . . . . 44.9 t . . . . . 0 N--CA 1.486 1.369 0 CA-C-O 120.83 0.348 . . . . 0.0 110.911 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' B' B ' 296' ' ' LEU . . . . . 0.418 HD22 ' N ' ' B' ' 296' ' ' LEU . 3.7 mm? -89.89 -40.09 12.63 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.809 179.95 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 297' ' ' GLN . . . . . . . . . . . . . 49.3 mt-30 -115.0 151.33 34.37 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.95 179.974 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 298' ' ' ASN . . . . . . . . . . . . . 6.2 t30 -133.36 99.96 4.68 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.906 -179.893 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 299' ' ' ASN . . . . . . . . . . . . . 6.4 t30 58.64 92.83 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.752 -179.762 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 300' ' ' GLN . . . . . . . . . . . . . 79.1 mt-30 -63.22 139.3 97.53 Favored Pre-proline 0 C--N 1.33 -0.261 0 CA-C-N 116.13 -0.487 . . . . 0.0 111.2 -179.717 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 301' ' ' PRO . . . . . 0.617 ' HB2' ' HB2' ' B' ' 304' ' ' PHE . 73.7 Cg_endo -75.83 138.81 21.52 Favored 'Trans proline' 0 C--N 1.348 0.534 0 C-N-CA 122.381 2.054 . . . . 0.0 112.244 179.786 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 302' ' ' VAL . . . . . 0.434 HG13 ' N ' ' B' ' 303' ' ' GLU . 2.5 p -92.13 -51.72 11.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.108 -0.497 . . . . 0.0 111.4 -179.865 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 303' ' ' GLU . . . . . 0.574 ' HG3' ' HB3' ' A' ' 374' ' ' ALA . 2.4 mp0 -73.7 -43.75 58.41 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.259 -0.428 . . . . 0.0 112.134 -179.244 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 304' ' ' PHE . . . . . 0.617 ' HB2' ' HB2' ' B' ' 301' ' ' PRO . 54.6 m-85 -62.18 -39.92 94.29 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.712 0.292 . . . . 0.0 111.365 -179.589 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 305' ' ' ASN . . . . . . . . . . . . . 6.8 t30 -71.54 -47.31 55.91 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.48 -179.626 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 306' ' ' HIS . . . . . . . . . . . . . 18.5 t-160 -65.51 -40.76 93.38 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.792 0.33 . . . . 0.0 111.214 -179.559 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 307' ' ' ALA . . . . . 0.534 ' HB1' ' HB2' ' A' ' 370' ' ' LEU . . . -65.95 -51.8 55.36 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.685 -179.406 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 308' ' ' ILE . . . . . 0.426 HD13 ' O ' ' B' ' 308' ' ' ILE . 0.0 OUTLIER -58.93 -43.08 87.81 Favored 'Isoleucine or valine' 0 C--O 1.233 0.23 0 CA-C-O 120.724 0.297 . . . . 0.0 110.685 -179.827 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' B' B ' 309' ' ' ASN . . . . . . . . . . . . . 27.0 t-20 -67.32 -30.04 69.77 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.619 179.622 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 310' ' ' TYR . . . . . . . . . . . . . 56.8 t80 -66.11 -52.01 52.65 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.806 179.872 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 311' ' ' VAL . . . . . . . . . . . . . 47.3 t -61.53 -44.0 97.86 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.2 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.83 179.798 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 312' ' ' ASN . . . . . . . . . . . . . 23.5 t-20 -63.74 -33.8 76.47 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.817 179.777 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 313' ' ' LYS . . . . . . . . . . . . . 1.1 tmmt? -64.96 -50.7 65.37 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.895 -179.975 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 314' ' ' ILE . . . . . . . . . . . . . 66.4 mt -71.76 -25.2 23.94 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.264 -179.881 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 315' ' ' LYS . . . . . . . . . . . . . 1.5 tmmt? -71.73 -39.74 69.89 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.875 -179.884 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 316' ' ' ASN . . . . . . . . . . . . . 27.2 t-20 -80.67 -41.68 23.34 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.293 -179.882 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 317' ' ' ARG . . . . . . . . . . . . . 29.1 tpt180 -68.68 -61.89 1.62 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.04 -179.806 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 318' ' ' PHE . . . . . . . . . . . . . 76.4 m-85 -83.67 31.56 0.47 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.089 -179.938 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 319' ' ' GLN . . . . . . . . . . . . . 24.4 tp60 -62.1 -20.63 64.25 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.264 -0.426 . . . . 0.0 110.646 179.779 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 320' ' ' GLY . . . . . . . . . . . . . . . -92.52 -13.33 57.2 Favored Glycine 0 C--N 1.33 0.204 0 C-N-CA 120.928 -0.653 . . . . 0.0 112.502 179.968 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 321' ' ' GLN . . . . . . . . . . . . . 87.0 mm-40 -108.79 92.75 10.96 Favored Pre-proline 0 C--N 1.329 -0.292 0 CA-C-O 120.548 0.213 . . . . 0.0 110.637 179.819 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 322' ' ' PRO . . . . . . . . . . . . . 98.3 Cg_endo -78.97 -26.57 5.24 Favored 'Trans proline' 0 C--N 1.347 0.48 0 C-N-CA 122.537 2.158 . . . . 0.0 112.603 -179.792 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 323' ' ' ASP . . . . . . . . . . . . . 15.7 t70 -68.9 -54.9 12.96 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.123 -179.715 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 324' ' ' ILE . . . . . . . . . . . . . 80.2 mt -64.18 -43.74 97.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.37 -179.949 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 325' ' ' TYR . . . . . . . . . . . . . 16.3 t80 -60.4 -44.67 95.45 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.718 -179.975 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 326' ' ' LYS . . . . . 0.4 ' O ' ' HG2' ' B' ' 330' ' ' GLU . 63.8 tttp -63.29 -50.89 68.33 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.969 179.977 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 327' ' ' ALA . . . . . . . . . . . . . . . -51.86 -49.77 62.25 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.134 -179.951 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 328' ' ' PHE . . . . . . . . . . . . . 69.8 t80 -56.02 -52.92 62.51 Favored 'General case' 0 C--O 1.237 0.401 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.519 179.826 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 329' ' ' LEU . . . . . 0.502 HD13 ' SD ' ' A' ' 362' ' ' MET . 89.9 mt -61.12 -24.19 66.07 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.815 -0.629 . . . . 0.0 110.754 179.8 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 330' ' ' GLU . . . . . 0.4 ' HG2' ' O ' ' B' ' 326' ' ' LYS . 16.3 mm-40 -75.92 -34.27 59.89 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.562 179.49 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 331' ' ' ILE . . . . . . . . . . . . . 80.9 mt -68.89 -44.2 81.84 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.207 0 CA-C-N 116.204 -0.453 . . . . 0.0 109.995 179.183 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 332' ' ' LEU . . . . . . . . . . . . . 45.7 mt -69.31 -39.32 78.33 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.802 -0.636 . . . . 0.0 111.007 179.684 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 333' ' ' HIS . . . . . . . . . . . . . 68.9 t60 -63.69 -51.61 64.29 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.762 179.96 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 334' ' ' THR . . . . . 0.454 ' HA ' ' HZ2' ' B' ' 337' ' ' LYS . 42.1 m -62.28 -35.58 79.46 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.732 179.793 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 335' ' ' TYR . . . . . . . . . . . . . 61.0 t80 -59.31 -62.36 1.94 Allowed 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.075 -0.512 . . . . 0.0 110.825 179.731 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 336' ' ' GLN . . . . . . . . . . . . . 26.0 tp60 -54.15 -42.93 70.14 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.121 -0.49 . . . . 0.0 111.391 -179.683 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 337' ' ' LYS . . . . . 0.454 ' HZ2' ' HA ' ' B' ' 334' ' ' THR . 6.4 ttpm? -53.83 -54.62 35.86 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.892 0.377 . . . . 0.0 111.005 -179.816 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 338' ' ' GLU . . . . . . . . . . . . . 41.6 mt-10 -62.76 -31.58 72.56 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.032 -179.8 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 339' ' ' GLN . . . . . . . . . . . . . 15.8 mm100 -64.99 -47.67 76.7 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.846 0.355 . . . . 0.0 110.546 179.55 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 340' ' ' ARG . . . . . . . . . . . . . 96.0 mtt180 -59.59 -51.39 70.03 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.269 179.38 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 341' ' ' ASN . . . . . . . . . . . . . 2.3 m-20 -59.51 -31.94 69.84 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.366 179.568 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 342' ' ' ALA . . . . . . . . . . . . . . . -70.68 -33.32 70.79 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.938 179.896 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 343' ' ' LYS . . . . . . . . . . . . . 61.3 mttp -79.03 -27.81 43.24 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.882 179.843 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 344' ' ' GLU . . . . . . . . . . . . . 19.9 mm-40 -74.99 -45.31 42.84 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.048 -179.924 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 345' ' ' ALA . . . . . . . . . . . . . . . -66.61 -42.11 87.34 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.991 179.989 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 346' ' ' GLY . . . . . . . . . . . . . . . 46.53 32.68 5.65 Favored Glycine 0 C--N 1.333 0.374 0 C-N-CA 121.135 -0.555 . . . . 0.0 112.81 179.883 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 347' ' ' GLY . . . . . . . . . . . . . . . -127.65 -107.36 1.42 Allowed Glycine 0 N--CA 1.45 -0.368 0 C-N-CA 120.692 -0.766 . . . . 0.0 112.949 -179.701 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 348' ' ' ASN . . . . . . . . . . . . . 62.0 t30 -106.29 -0.75 24.14 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.673 0.273 . . . . 0.0 111.208 -179.459 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 349' ' ' TYR . . . . . . . . . . . . . 41.5 t80 -55.9 116.99 3.28 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.817 -179.887 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 350' ' ' THR . . . . . . . . . . . . . 89.6 m -115.43 114.38 42.76 Favored Pre-proline 0 C--N 1.329 -0.312 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.137 -179.815 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 351' ' ' PRO . . . . . . . . . . . . . 51.6 Cg_exo -53.7 157.8 9.33 Favored 'Trans proline' 0 C--N 1.35 0.657 0 C-N-CA 122.364 2.042 . . . . 0.0 112.218 179.76 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 352' ' ' ALA . . . . . 0.482 ' HB3' HD23 ' B' ' 353' ' ' LEU . . . -81.1 -61.4 1.97 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.564 -179.539 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 353' ' ' LEU . . . . . 0.5 ' HB3' ' HG2' ' B' ' 357' ' ' GLU . 0.2 OUTLIER -106.68 131.6 53.63 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 121.012 0.434 . . . . 0.0 111.414 -179.588 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' B' B ' 354' ' ' THR . . . . . . . . . . . . . 65.2 p -113.84 -160.84 0.74 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.827 -0.624 . . . . 0.0 110.662 179.868 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 355' ' ' GLU . . . . . . . . . . . . . 41.5 mt-10 -57.17 -28.02 62.43 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.412 -0.358 . . . . 0.0 110.876 179.755 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 356' ' ' GLN . . . . . . . . . . . . . 23.6 tm0? -69.86 -50.01 46.82 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.044 -0.525 . . . . 0.0 111.008 -179.77 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 357' ' ' GLU . . . . . 0.5 ' HG2' ' HB3' ' B' ' 353' ' ' LEU . 7.1 tp10 -64.43 -36.97 85.91 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.484 -0.325 . . . . 0.0 110.979 -179.673 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 358' ' ' VAL . . . . . 0.508 ' O ' HG23 ' B' ' 362' ' ' VAL . 48.7 t -64.12 -59.85 3.63 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.981 179.973 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 359' ' ' TYR . . . . . . . . . . . . . 37.3 t80 -59.59 -30.1 68.43 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.474 -0.33 . . . . 0.0 111.331 -179.534 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 360' ' ' ALA . . . . . . . . . . . . . . . -69.75 -60.49 2.28 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.69 0.281 . . . . 0.0 111.324 -179.646 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 361' ' ' GLN . . . . . . . . . . . . . 76.8 mt-30 -56.19 -44.88 79.86 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.235 -0.438 . . . . 0.0 110.903 179.99 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 362' ' ' VAL . . . . . 0.508 HG23 ' O ' ' B' ' 358' ' ' VAL . 64.2 t -64.63 -35.39 74.62 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.716 179.759 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 363' ' ' ALA . . . . . 0.61 ' HA ' HD11 ' B' ' 373' ' ' LEU . . . -61.69 -42.83 99.46 Favored 'General case' 0 CA--C 1.521 -0.171 0 CA-C-O 120.955 0.407 . . . . 0.0 110.263 179.327 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 364' ' ' ARG . . . . . . . . . . . . . 68.2 ttt180 -81.55 -18.23 45.65 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.877 -0.601 . . . . 0.0 110.201 179.42 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 365' ' ' LEU . . . . . 0.402 ' HB2' ' HA ' ' B' ' 362' ' ' VAL . 8.1 tp -60.96 -25.52 66.88 Favored 'General case' 0 C--O 1.232 0.164 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.381 179.659 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 366' ' ' PHE . . . . . . . . . . . . . 60.4 m-85 -125.97 162.21 25.75 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.142 179.546 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 367' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -115.61 -87.8 0.59 Allowed 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 120.753 0.311 . . . . 0.0 111.596 -179.408 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 368' ' ' ASN . . . . . . . . . . . . . 3.7 m-20 -79.74 -0.95 36.42 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.443 -0.344 . . . . 0.0 111.276 -179.513 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 369' ' ' GLN . . . . . . . . . . . . . 46.9 mt-30 -98.44 84.24 3.17 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.393 -0.367 . . . . 0.0 111.218 -179.896 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 370' ' ' GLU . . . . . . . . . . . . . 44.7 mt-10 -93.9 -6.01 46.6 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.759 179.671 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 371' ' ' ASP . . . . . . . . . . . . . 19.9 t70 -57.71 -62.03 2.09 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.004 -179.812 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 372' ' ' LEU . . . . . 0.564 HD12 ' N ' ' B' ' 373' ' ' LEU . 0.3 OUTLIER -64.32 -22.51 66.97 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.257 -0.428 . . . . 0.0 111.114 179.87 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' B' B ' 373' ' ' LEU . . . . . 0.61 HD11 ' HA ' ' B' ' 363' ' ' ALA . 5.3 tp -71.53 -38.12 71.11 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.535 -179.793 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 374' ' ' SER . . . . . . . . . . . . . 48.9 m -73.66 -48.27 33.59 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.08 -0.509 . . . . 0.0 109.767 179.074 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 375' ' ' GLU . . . . . . . . . . . . . 8.5 tp10 -55.58 -38.52 69.48 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.677 -0.692 . . . . 0.0 109.813 179.133 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 376' ' ' PHE . . . . . 0.444 ' O ' ' HB2' ' B' ' 379' ' ' PHE . 76.0 t80 -75.2 -32.73 61.29 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 115.861 -0.609 . . . . 0.0 109.903 179.15 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 377' ' ' GLY . . . . . . . . . . . . . . . -60.11 -33.11 78.18 Favored Glycine 0 N--CA 1.449 -0.486 0 C-N-CA 120.606 -0.807 . . . . 0.0 111.259 179.054 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 378' ' ' GLN . . . . . . . . . . . . . 26.8 mm-40 -67.98 -31.92 71.96 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.751 0.31 . . . . 0.0 110.881 179.318 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 379' ' ' PHE . . . . . 0.444 ' HB2' ' O ' ' B' ' 376' ' ' PHE . 15.1 m-85 -56.57 -41.13 76.39 Favored 'General case' 0 C--N 1.334 -0.105 0 CA-C-N 116.319 -0.4 . . . . 0.0 110.943 179.71 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 380' ' ' LEU . . . . . . . . . . . . . 96.0 mt -56.38 131.1 76.16 Favored Pre-proline 0 C--N 1.329 -0.302 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.633 179.824 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 381' ' ' PRO . . . . . 0.531 ' HA ' ' HB3' ' A' ' 377' ' ' ARG . 54.3 Cg_exo -51.3 144.51 30.32 Favored 'Trans proline' 0 C--N 1.347 0.473 0 C-N-CA 122.355 2.037 . . . . 0.0 112.337 -179.955 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 382' ' ' ASP . . . . . . . . . . . . . 15.4 t70 -96.56 122.19 39.21 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.742 179.977 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 383' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.031 0 CA-C-O 118.263 -0.875 . . . . 0.0 111.098 -179.932 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 358' ' ' ASP . . . . . . . . . . . . . 17.0 t70 . . . . . 0 N--CA 1.487 1.383 0 CA-C-O 120.804 0.335 . . . . 0.0 110.923 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 359' ' ' PHE . . . . . . . . . . . . . 69.4 m-85 -82.28 117.99 22.8 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.04 179.982 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 360' ' ' THR . . . . . 0.515 ' HB ' ' HD3' ' A' ' 361' ' ' PRO . 91.1 m -91.67 -47.17 0.34 Allowed Pre-proline 0 C--N 1.328 -0.328 0 CA-C-N 115.972 -0.558 . . . . 0.0 111.698 179.932 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 361' ' ' PRO . . . . . 0.515 ' HD3' ' HB ' ' A' ' 360' ' ' THR . 73.4 Cg_exo -50.28 -50.22 14.13 Favored 'Trans proline' 0 C--N 1.354 0.865 0 C-N-CA 122.204 1.936 . . . . 0.0 112.663 -179.988 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 362' ' ' MET . . . . . 0.582 ' SD ' HD23 ' B' ' 329' ' ' LEU . 4.4 tpt -57.45 -71.92 0.09 Allowed 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 120.937 0.399 . . . . 0.0 110.517 179.764 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 363' ' ' ASP . . . . . . . . . . . . . 16.9 t70 175.08 -60.34 0.01 OUTLIER 'General case' 0 C--N 1.333 -0.135 0 CA-C-N 115.667 -0.697 . . . . 0.0 109.949 -179.809 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 364' ' ' SER . . . . . . . . . . . . . 79.7 p -134.75 -60.26 0.79 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.603 -0.726 . . . . 0.0 110.296 179.445 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 365' ' ' SER . . . . . . . . . . . . . 48.2 t -175.24 100.9 0.08 Allowed 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.026 -0.534 . . . . 0.0 111.045 179.674 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 366' ' ' ALA . . . . . 0.53 ' HB2' ' HG2' ' A' ' 362' ' ' MET . . . -74.09 -13.55 60.85 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 121.013 0.435 . . . . 0.0 110.686 179.59 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 367' ' ' VAL . . . . . . . . . . . . . 61.8 t -53.7 -31.23 19.71 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 115.706 -0.679 . . . . 0.0 111.452 -179.885 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 368' ' ' TYR . . . . . . . . . . . . . 65.8 m-85 -60.39 -50.4 73.75 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.758 0.313 . . . . 0.0 111.32 -179.929 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 369' ' ' VAL . . . . . 0.643 HG13 ' HG2' ' B' ' 336' ' ' GLN . 24.0 t -67.93 -52.35 40.27 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.568 -179.534 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 370' ' ' LEU . . . . . 0.547 HD13 ' HA ' ' B' ' 307' ' ' ALA . 86.9 mt -55.93 -46.51 78.45 Favored 'General case' 0 C--O 1.235 0.341 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.215 -179.808 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 371' ' ' SER . . . . . . . . . . . . . 45.8 t -60.04 -59.42 5.45 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.089 -179.949 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 372' ' ' SER . . . . . . . . . . . . . 50.6 m -51.06 -35.02 32.48 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.459 -0.337 . . . . 0.0 111.468 -179.616 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 373' ' ' MET . . . . . . . . . . . . . 54.1 tpp -65.0 -56.18 14.63 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.419 -0.355 . . . . 0.0 111.599 -179.441 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 374' ' ' ALA . . . . . 0.52 ' HB3' ' OE1' ' B' ' 303' ' ' GLU . . . -80.96 -6.15 58.38 Favored 'General case' 0 C--N 1.33 -0.267 0 N-CA-C 112.256 0.465 . . . . 0.0 112.256 -178.885 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 375' ' ' ARG . . . . . . . . . . . . . 32.7 tpt180 -96.65 -27.31 14.85 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 120.611 0.243 . . . . 0.0 111.263 -179.688 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 376' ' ' GLN . . . . . . . . . . . . . 45.4 mm-40 -65.02 -9.55 22.78 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.466 -0.334 . . . . 0.0 111.435 -179.961 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 377' ' ' ARG . . . . . . . . . . . . . 14.9 ptp180 -59.14 -38.26 79.23 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.463 -0.335 . . . . 0.0 110.854 179.905 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 378' ' ' ARG . . . . . . . . . . . . . 99.3 mtt180 -144.25 143.89 31.25 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.74 179.791 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 379' ' ' ALA . . . . . . . . . . . . . . . -89.5 -47.97 7.63 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.105 179.98 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 380' ' ' SER . . . . . . . . . . . . . 59.3 p . . . . . 0 C--O 1.249 1.067 0 CA-C-O 118.201 -0.904 . . . . 0.0 110.941 -179.965 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' B' B ' 295' ' ' SER . . . . . . . . . . . . . 78.8 p . . . . . 0 N--CA 1.486 1.375 0 CA-C-O 120.822 0.344 . . . . 0.0 110.834 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' B' B ' 296' ' ' LEU . . . . . 0.443 HD22 ' N ' ' B' ' 296' ' ' LEU . 3.4 mm? -80.35 -33.4 37.39 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.77 -179.979 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 297' ' ' GLN . . . . . . . . . . . . . 98.1 mt-30 57.28 -169.03 0.11 Allowed 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.075 -179.969 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 298' ' ' ASN . . . . . . . . . . . . . 16.1 m120 -119.87 -52.07 2.23 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.144 -179.891 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 299' ' ' ASN . . . . . . . . . . . . . 17.1 m120 -87.39 169.38 12.31 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.27 -179.915 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 300' ' ' GLN . . . . . . . . . . . . . 83.9 mm-40 -137.23 149.91 67.4 Favored Pre-proline 0 C--N 1.33 -0.269 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.905 179.96 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 301' ' ' PRO . . . . . 0.467 ' HB2' ' HB2' ' B' ' 304' ' ' PHE . 31.2 Cg_exo -61.01 130.93 34.57 Favored 'Trans proline' 0 C--N 1.348 0.528 0 C-N-CA 122.439 2.093 . . . . 0.0 111.898 179.788 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 302' ' ' VAL . . . . . . . . . . . . . 7.3 p -89.76 -41.0 13.46 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.296 -179.728 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 303' ' ' GLU . . . . . 0.52 ' OE1' ' HB3' ' A' ' 374' ' ' ALA . 55.8 mm-40 -70.33 -45.58 65.9 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.178 -0.464 . . . . 0.0 111.41 -179.44 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 304' ' ' PHE . . . . . 0.467 ' HB2' ' HB2' ' B' ' 301' ' ' PRO . 89.7 m-85 -64.35 -50.24 68.52 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.098 -179.7 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 305' ' ' ASN . . . . . . . . . . . . . 27.7 t-20 -58.18 -54.47 46.58 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.436 -179.613 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 306' ' ' HIS . . . . . . . . . . . . . 9.8 m-70 -59.48 -61.26 2.76 Favored 'General case' 0 C--N 1.331 -0.234 0 N-CA-C 112.012 0.375 . . . . 0.0 112.012 -179.327 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 307' ' ' ALA . . . . . 0.547 ' HA ' HD13 ' A' ' 370' ' ' LEU . . . -52.7 -60.52 3.15 Favored 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 112.492 0.553 . . . . 0.0 112.492 -178.798 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 308' ' ' ILE . . . . . . . . . . . . . 90.9 mt -51.55 -54.28 12.9 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.218 0 N-CA-C 111.647 0.24 . . . . 0.0 111.647 -179.26 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 309' ' ' ASN . . . . . . . . . . . . . 3.6 m-20 -62.52 -24.07 67.3 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.456 -0.338 . . . . 0.0 111.09 -179.744 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 310' ' ' TYR . . . . . . . . . . . . . 34.3 t80 -69.3 -58.92 3.4 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.424 -0.353 . . . . 0.0 111.093 -179.693 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 311' ' ' VAL . . . . . 0.431 ' O ' ' HG3' ' B' ' 315' ' ' LYS . 27.1 t -58.94 -44.83 91.84 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.117 0 CA-C-O 120.816 0.341 . . . . 0.0 110.514 179.9 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 312' ' ' ASN . . . . . . . . . . . . . 57.6 t30 -57.96 -41.59 83.19 Favored 'General case' 0 C--O 1.232 0.179 0 CA-C-O 121.005 0.431 . . . . 0.0 110.631 179.641 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 313' ' ' LYS . . . . . . . . . . . . . 37.4 tttt -59.06 -60.01 4.55 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.771 -0.649 . . . . 0.0 111.123 179.703 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 314' ' ' ILE . . . . . . . . . . . . . 19.9 mt -59.61 -27.47 37.68 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 115.778 -0.646 . . . . 0.0 111.708 -179.04 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 315' ' ' LYS . . . . . 0.45 ' HZ2' ' HB2' ' B' ' 315' ' ' LYS . 8.7 mtmp? -71.59 -40.4 69.9 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.805 0.335 . . . . 0.0 110.805 179.681 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 316' ' ' ASN . . . . . . . . . . . . . 58.8 t30 -84.75 -12.88 52.81 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.772 179.912 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 317' ' ' ARG . . . . . 0.452 HH21 HE22 ' B' ' 369' ' ' GLN . 29.8 tpt180 -90.3 -66.63 0.91 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.798 179.814 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 318' ' ' PHE . . . . . . . . . . . . . 96.7 m-85 -88.28 39.68 0.92 Allowed 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.788 179.862 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 319' ' ' GLN . . . . . . . . . . . . . 4.9 pp0? -61.13 -9.17 4.23 Favored 'General case' 0 N--CA 1.45 -0.467 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.532 -179.785 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 320' ' ' GLY . . . . . . . . . . . . . . . -96.23 -40.25 4.04 Favored Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.83 -0.7 . . . . 0.0 112.901 179.968 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 321' ' ' GLN . . . . . . . . . . . . . 6.2 tp-100 -105.88 98.08 17.19 Favored Pre-proline 0 C--N 1.33 -0.242 0 CA-C-O 120.418 0.151 . . . . 0.0 110.925 -179.82 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 322' ' ' PRO . . . . . . . . . . . . . 93.2 Cg_endo -80.43 -13.36 12.27 Favored 'Trans proline' 0 C--N 1.348 0.552 0 C-N-CA 122.472 2.115 . . . . 0.0 112.533 179.913 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 323' ' ' ASP . . . . . . . . . . . . . 14.7 t70 -65.87 -55.11 18.73 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.007 179.992 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 324' ' ' ILE . . . . . . . . . . . . . 61.1 mt -63.32 -37.93 80.81 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.936 179.899 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 325' ' ' TYR . . . . . 0.415 ' O ' HD13 ' B' ' 329' ' ' LEU . 55.7 t80 -60.21 -58.39 8.71 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.657 179.766 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 326' ' ' LYS . . . . . 0.407 ' HG2' ' OE1' ' B' ' 330' ' ' GLU . 38.2 ttmt -58.89 -40.76 85.39 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.835 -0.62 . . . . 0.0 110.993 179.994 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 327' ' ' ALA . . . . . . . . . . . . . . . -55.47 -50.48 69.76 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-O 120.891 0.376 . . . . 0.0 110.991 -179.917 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 328' ' ' PHE . . . . . . . . . . . . . 24.4 t80 -57.42 -57.46 12.56 Favored 'General case' 0 C--O 1.239 0.504 0 CA-C-O 121.334 0.587 . . . . 0.0 110.189 179.637 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 329' ' ' LEU . . . . . 0.582 HD23 ' SD ' ' A' ' 362' ' ' MET . 10.5 mp -59.13 -20.31 52.55 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.523 -0.762 . . . . 0.0 110.904 -179.989 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 330' ' ' GLU . . . . . 0.407 ' OE1' ' HG2' ' B' ' 326' ' ' LYS . 21.8 mt-10 -77.84 -35.68 50.85 Favored 'General case' 0 C--N 1.332 -0.158 0 N-CA-C 109.829 -0.434 . . . . 0.0 109.829 178.825 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 331' ' ' ILE . . . . . . . . . . . . . 96.8 mt -64.93 -44.25 96.16 Favored 'Isoleucine or valine' 0 C--O 1.233 0.189 0 N-CA-C 109.312 -0.625 . . . . 0.0 109.312 178.524 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 332' ' ' LEU . . . . . 0.526 ' HB3' HG11 ' A' ' 369' ' ' VAL . 8.9 mp -68.62 -41.03 80.06 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.621 -0.718 . . . . 0.0 110.783 179.225 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 333' ' ' HIS . . . . . . . . . . . . . 42.5 t-80 -59.68 -53.93 52.3 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.309 179.752 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 334' ' ' THR . . . . . . . . . . . . . 93.1 m -60.92 -33.16 72.72 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.277 179.143 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 335' ' ' TYR . . . . . 0.441 ' HB3' ' O ' ' B' ' 332' ' ' LEU . 74.2 t80 -55.65 -65.35 0.61 Allowed 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.646 179.463 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 336' ' ' GLN . . . . . 0.643 ' HG2' HG13 ' A' ' 369' ' ' VAL . 63.9 mm-40 -65.18 -22.3 66.88 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.36 -0.382 . . . . 0.0 111.018 179.846 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 337' ' ' LYS . . . . . . . . . . . . . 61.0 tttp -61.32 -65.67 0.66 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.382 -0.372 . . . . 0.0 110.424 179.695 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 338' ' ' GLU . . . . . . . . . . . . . 42.9 mt-10 -63.51 -33.88 76.55 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.53 179.53 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 339' ' ' GLN . . . . . . . . . . . . . 7.7 tp60 -57.38 -53.91 52.75 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.532 179.609 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 340' ' ' ARG . . . . . . . . . . . . . 99.7 mtt180 -59.28 -50.87 72.33 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.372 179.484 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 341' ' ' ASN . . . . . . . . . . . . . 82.3 m-20 -56.09 -26.82 51.15 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.861 179.637 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 342' ' ' ALA . . . . . . . . . . . . . . . -74.44 -46.7 38.23 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.056 179.948 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 343' ' ' LYS . . . . . . . . . . . . . 14.2 mptt -76.37 -12.63 60.09 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.068 179.738 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 344' ' ' GLU . . . . . . . . . . . . . 23.2 mm-40 -89.08 -40.92 12.61 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.925 179.742 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 345' ' ' ALA . . . . . . . . . . . . . . . -71.96 -41.54 67.62 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.936 179.937 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 346' ' ' GLY . . . . . . . . . . . . . . . 53.33 31.4 42.5 Favored Glycine 0 C--N 1.331 0.288 0 C-N-CA 121.003 -0.618 . . . . 0.0 112.591 179.906 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 347' ' ' GLY . . . . . . . . . . . . . . . -129.89 -119.82 2.18 Favored Glycine 0 N--CA 1.45 -0.407 0 C-N-CA 120.737 -0.744 . . . . 0.0 112.805 -179.927 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 348' ' ' ASN . . . . . . . . . . . . . 86.0 m-20 -90.65 -8.25 50.51 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.555 0.217 . . . . 0.0 111.423 -179.532 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 349' ' ' TYR . . . . . . . . . . . . . 31.2 t80 -58.73 128.32 36.62 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 120.828 0.347 . . . . 0.0 110.912 -179.719 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 350' ' ' THR . . . . . 0.409 ' HA ' ' HD3' ' B' ' 351' ' ' PRO . 30.6 m -132.42 130.19 21.76 Favored Pre-proline 0 C--N 1.329 -0.307 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.773 179.83 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 351' ' ' PRO . . . . . 0.409 ' HD3' ' HA ' ' B' ' 350' ' ' THR . 26.3 Cg_exo -62.33 174.98 2.3 Favored 'Trans proline' 0 C--N 1.35 0.622 0 C-N-CA 122.433 2.089 . . . . 0.0 112.334 -179.733 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 352' ' ' ALA . . . . . . . . . . . . . . . -104.38 -71.11 0.75 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.486 -179.911 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 353' ' ' LEU . . . . . 0.571 ' HB3' ' HG2' ' B' ' 357' ' ' GLU . 0.3 OUTLIER -92.6 145.7 24.23 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 121.464 0.649 . . . . 0.0 112.398 -179.392 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' B' B ' 354' ' ' THR . . . . . . . . . . . . . 81.4 p -115.14 -166.65 1.14 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.447 -0.797 . . . . 0.0 110.333 179.34 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 355' ' ' GLU . . . . . . . . . . . . . 37.5 mt-10 -59.89 -33.09 71.38 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 121.155 0.503 . . . . 0.0 110.271 179.418 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 356' ' ' GLN . . . . . . . . . . . . . 26.2 mp0 -70.17 -44.81 67.99 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.695 -0.684 . . . . 0.0 111.176 -179.78 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 357' ' ' GLU . . . . . 0.571 ' HG2' ' HB3' ' B' ' 353' ' ' LEU . 6.5 tp10 -61.68 -44.0 97.78 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-O 120.706 0.289 . . . . 0.0 110.534 -179.984 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 358' ' ' VAL . . . . . . . . . . . . . 87.0 t -59.76 -54.57 32.79 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.633 179.499 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 359' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -60.99 -28.03 68.73 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.864 -179.869 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 360' ' ' ALA . . . . . . . . . . . . . . . -72.4 -60.98 1.96 Allowed 'General case' 0 C--O 1.233 0.22 0 CA-C-N 116.41 -0.359 . . . . 0.0 111.273 -179.767 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 361' ' ' GLN . . . . . 0.41 ' O ' ' HB2' ' B' ' 365' ' ' LEU . 47.3 mt-30 -58.96 -34.0 71.28 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.438 179.855 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 362' ' ' VAL . . . . . . . . . . . . . 11.5 t -69.99 -40.16 78.26 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 115.826 -0.625 . . . . 0.0 110.785 179.577 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 363' ' ' ALA . . . . . 0.587 ' HA ' HD21 ' B' ' 373' ' ' LEU . . . -62.14 -38.73 90.09 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.39 179.488 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 364' ' ' ARG . . . . . . . . . . . . . 64.9 ttt180 -83.63 -19.35 35.59 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.252 179.141 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 365' ' ' LEU . . . . . 0.41 ' HB2' ' O ' ' B' ' 361' ' ' GLN . 13.2 tp -58.89 -34.62 71.87 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.853 -179.959 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 366' ' ' PHE . . . . . 0.49 ' HB3' ' HB2' ' B' ' 369' ' ' GLN . 59.7 m-85 -117.25 164.66 14.48 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.732 179.983 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 367' ' ' LYS . . . . . . . . . . . . . 60.9 mttp -116.54 -75.15 0.58 Allowed 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.931 179.915 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 368' ' ' ASN . . . . . . . . . . . . . 15.9 m120 -87.48 -3.98 59.0 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.78 -179.956 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 369' ' ' GLN . . . . . 0.49 ' HB2' ' HB3' ' B' ' 366' ' ' PHE . 17.7 mm-40 -97.3 83.01 3.22 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.025 -179.867 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 370' ' ' GLU . . . . . . . . . . . . . 40.2 tt0 -93.41 -15.61 25.47 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.629 179.648 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 371' ' ' ASP . . . . . . . . . . . . . 7.3 m-20 -55.36 -39.13 69.71 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.94 -0.573 . . . . 0.0 111.122 -179.9 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 372' ' ' LEU . . . . . 0.405 HD12 ' N ' ' B' ' 372' ' ' LEU . 6.1 mp -71.3 -38.88 71.73 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.772 179.844 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 373' ' ' LEU . . . . . 0.587 HD21 ' HA ' ' B' ' 363' ' ' ALA . 3.0 mp -56.74 -50.52 71.99 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.997 -0.547 . . . . 0.0 111.028 179.885 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 374' ' ' SER . . . . . . . . . . . . . 41.7 t -69.6 -48.0 61.58 Favored 'General case' 0 C--O 1.235 0.329 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.616 179.651 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 375' ' ' GLU . . . . . 0.427 ' O ' ' HG2' ' B' ' 378' ' ' GLN . 40.9 tt0 -54.67 -29.63 53.29 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 115.857 -0.611 . . . . 0.0 110.108 179.642 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 376' ' ' PHE . . . . . 0.446 ' O ' ' HB2' ' B' ' 379' ' ' PHE . 90.4 t80 -87.18 -27.68 22.88 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.934 -0.576 . . . . 0.0 110.004 178.71 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 377' ' ' GLY . . . . . . . . . . . . . . . -61.41 -38.67 96.12 Favored Glycine 0 N--CA 1.45 -0.376 0 C-N-CA 120.884 -0.674 . . . . 0.0 112.342 179.749 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 378' ' ' GLN . . . . . 0.427 ' HG2' ' O ' ' B' ' 375' ' ' GLU . 13.4 pt20 -63.31 -26.6 68.84 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.524 0.202 . . . . 0.0 111.053 179.731 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 379' ' ' PHE . . . . . 0.446 ' HB2' ' O ' ' B' ' 376' ' ' PHE . 29.3 m-85 -62.02 -33.96 75.32 Favored 'General case' 0 C--N 1.333 -0.122 0 CA-C-N 116.607 -0.269 . . . . 0.0 110.855 179.681 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 380' ' ' LEU . . . . . . . . . . . . . 79.3 mt -53.95 133.77 58.04 Favored Pre-proline 0 C--N 1.33 -0.26 0 CA-C-N 116.334 -0.393 . . . . 0.0 110.328 179.938 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 381' ' ' PRO . . . . . . . . . . . . . 64.1 Cg_exo -51.13 127.13 20.87 Favored 'Trans proline' 0 C--N 1.347 0.483 0 C-N-CA 122.434 2.089 . . . . 0.0 112.353 -179.596 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 382' ' ' ASP . . . . . . . . . . . . . 5.7 m-20 -96.83 128.78 44.12 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.875 -179.945 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 383' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.115 0 CA-C-O 118.34 -0.838 . . . . 0.0 111.258 179.947 . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 358' ' ' ASP . . . . . . . . . . . . . 22.6 t70 . . . . . 0 N--CA 1.486 1.347 0 CA-C-O 120.714 0.292 . . . . 0.0 111.026 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 359' ' ' PHE . . . . . . . . . . . . . 11.0 p90 -86.26 -171.03 3.36 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.811 -179.897 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 360' ' ' THR . . . . . . . . . . . . . 80.7 p -120.35 117.69 31.59 Favored Pre-proline 0 C--N 1.33 -0.246 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.152 179.97 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 361' ' ' PRO . . . . . . . . . . . . . 28.5 Cg_exo -62.07 169.43 7.61 Favored 'Trans proline' 0 C--N 1.348 0.54 0 C-N-CA 122.326 2.018 . . . . 0.0 112.026 179.746 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 362' ' ' MET . . . . . 0.573 ' HG3' ' HB3' ' B' ' 329' ' ' LEU . 1.6 tmt? -74.85 -71.94 0.32 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.306 -0.406 . . . . 0.0 111.053 -179.947 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 363' ' ' ASP . . . . . . . . . . . . . 21.8 t70 177.25 142.02 0.08 Allowed 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 115.664 -0.698 . . . . 0.0 109.886 -179.899 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 364' ' ' SER . . . . . . . . . . . . . 49.8 m 56.8 23.23 7.79 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.966 0.412 . . . . 0.0 110.209 -179.495 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 365' ' ' SER . . . . . . . . . . . . . 39.7 t 63.73 93.35 0.06 Allowed 'General case' 0 C--O 1.232 0.172 0 CA-C-N 115.646 -0.706 . . . . 0.0 111.309 -179.996 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 366' ' ' ALA . . . . . 0.439 ' HB2' ' HB3' ' A' ' 362' ' ' MET . . . -74.47 -26.27 59.92 Favored 'General case' 0 C--O 1.234 0.289 0 CA-C-O 121.095 0.474 . . . . 0.0 110.538 179.434 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 367' ' ' VAL . . . . . 0.403 HG13 ' HB3' ' B' ' 307' ' ' ALA . 18.4 t -57.97 -28.38 33.5 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 115.707 -0.679 . . . . 0.0 110.541 179.521 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 368' ' ' TYR . . . . . . . . . . . . . 46.1 t80 -70.16 -33.95 72.41 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.452 179.747 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 369' ' ' VAL . . . . . 0.558 HG22 ' HB2' ' B' ' 336' ' ' GLN . 20.7 t -71.48 -52.8 23.75 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.784 179.795 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 370' ' ' LEU . . . . . 0.43 HD13 ' HA ' ' B' ' 307' ' ' ALA . 87.7 mt -62.74 -41.2 99.07 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.831 -0.622 . . . . 0.0 111.183 -179.848 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 371' ' ' SER . . . . . . . . . . . . . 84.3 p -62.81 -55.78 23.29 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.768 179.901 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 372' ' ' SER . . . . . . . . . . . . . 69.1 m -53.03 -39.65 63.34 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.921 179.998 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 373' ' ' MET . . . . . . . . . . . . . 55.3 ttm -62.42 -43.07 99.7 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.768 179.779 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 374' ' ' ALA . . . . . . . . . . . . . . . -83.18 -8.44 59.49 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.557 -179.972 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 375' ' ' ARG . . . . . 0.567 ' HE ' ' HA ' ' A' ' 375' ' ' ARG . 4.1 mmp_? -102.62 -13.73 17.01 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.491 -0.322 . . . . 0.0 111.174 -179.854 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 376' ' ' GLN . . . . . 0.451 ' HB3' ' HG3' ' B' ' 381' ' ' PRO . 44.4 tt0 -82.34 18.45 1.44 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.321 -0.4 . . . . 0.0 110.727 -179.956 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 377' ' ' ARG . . . . . . . . . . . . . 78.5 mtp180 -54.62 134.46 46.9 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.088 179.886 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 378' ' ' ARG . . . . . . . . . . . . . 65.1 mtm180 63.79 156.78 0.07 Allowed 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 115.958 -0.564 . . . . 0.0 111.375 -179.993 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 379' ' ' ALA . . . . . . . . . . . . . . . -154.13 -168.01 2.82 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.895 -179.958 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 380' ' ' SER . . . . . . . . . . . . . 50.7 p . . . . . 0 C--O 1.249 1.063 0 CA-C-O 118.281 -0.866 . . . . 0.0 110.864 -179.993 . . . . . . . . 0 0 . 1 . 020 nuclear build full ' B' B ' 295' ' ' SER . . . . . . . . . . . . . 49.3 m . . . . . 0 N--CA 1.487 1.395 0 CA-C-O 120.853 0.358 . . . . 0.0 110.858 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' B' B ' 296' ' ' LEU . . . . . . . . . . . . . 57.3 tp -69.97 144.74 52.25 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.859 -179.991 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 297' ' ' GLN . . . . . . . . . . . . . 35.4 tt0 -154.14 -40.23 0.09 Allowed 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.879 179.903 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 298' ' ' ASN . . . . . . . . . . . . . 7.5 p30 -144.18 171.11 14.74 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.795 -179.969 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 299' ' ' ASN . . . . . . . . . . . . . 66.4 m-20 -111.04 -7.6 14.51 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.037 -179.957 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 300' ' ' GLN . . . . . . . . . . . . . 7.6 tp60 -138.69 85.4 17.07 Favored Pre-proline 0 C--N 1.33 -0.27 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.878 179.904 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 301' ' ' PRO . . . . . . . . . . . . . 51.4 Cg_exo -54.43 150.9 32.23 Favored 'Trans proline' 0 C--N 1.347 0.468 0 C-N-CA 122.5 2.133 . . . . 0.0 112.363 179.833 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 302' ' ' VAL . . . . . . . . . . . . . 28.5 m -81.29 -20.25 11.08 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.95 179.935 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 303' ' ' GLU . . . . . . . . . . . . . 40.5 mt-10 -55.6 -82.88 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.75 -0.659 . . . . 0.0 111.877 -179.212 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 304' ' ' PHE . . . . . . . . . . . . . 79.6 m-85 -57.56 -39.71 77.33 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.788 -179.067 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 305' ' ' ASN . . . . . . . . . . . . . 6.7 t30 -53.68 -69.34 0.12 Allowed 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 111.86 0.318 . . . . 0.0 111.86 -179.1 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 306' ' ' HIS . . . . . . . . . . . . . 5.7 m80 -61.94 -53.97 48.32 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.185 -0.461 . . . . 0.0 112.243 -178.697 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 307' ' ' ALA . . . . . 0.43 ' HA ' HD13 ' A' ' 370' ' ' LEU . . . -52.3 -61.96 1.94 Allowed 'General case' 0 C--N 1.33 -0.242 0 N-CA-C 112.372 0.508 . . . . 0.0 112.372 -178.904 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 308' ' ' ILE . . . . . . . . . . . . . 86.1 mt -55.4 -54.54 24.1 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.231 0 N-CA-C 111.809 0.3 . . . . 0.0 111.809 -179.346 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 309' ' ' ASN . . . . . . . . . . . . . 39.2 t-20 -54.05 -29.91 45.92 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-O 120.899 0.38 . . . . 0.0 111.042 -179.554 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 310' ' ' TYR . . . . . 0.456 ' O ' ' HG3' ' B' ' 313' ' ' LYS . 8.6 t80 -70.86 -61.77 1.64 Allowed 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.073 -179.729 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 311' ' ' VAL . . . . . . . . . . . . . 38.4 t -59.09 -22.09 21.17 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-O 120.922 0.392 . . . . 0.0 110.656 179.875 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 312' ' ' ASN . . . . . . . . . . . . . 41.1 t30 -73.53 -57.38 4.04 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.534 -179.893 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 313' ' ' LYS . . . . . 0.456 ' HG3' ' O ' ' B' ' 310' ' ' TYR . 0.0 OUTLIER -62.46 -27.98 69.49 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 116.323 -0.399 . . . . 0.0 111.327 -179.55 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' B' B ' 314' ' ' ILE . . . . . . . . . . . . . 92.8 mt -77.43 -44.98 29.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.497 -0.32 . . . . 0.0 111.177 179.737 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 315' ' ' LYS . . . . . . . . . . . . . 27.4 ttpp -69.25 -24.74 64.03 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.223 -179.65 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 316' ' ' ASN . . . . . . . . . . . . . 6.7 t30 -85.8 -57.59 2.99 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.321 -0.399 . . . . 0.0 111.247 -179.694 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 317' ' ' ARG . . . . . . . . . . . . . 21.4 tpp180 -65.33 -59.56 3.91 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.058 -179.801 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 318' ' ' PHE . . . . . . . . . . . . . 90.3 m-85 -83.49 40.26 0.71 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.213 -0.448 . . . . 0.0 110.853 -179.89 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 319' ' ' GLN . . . . . . . . . . . . . 17.7 tt0 -71.76 -7.38 47.82 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.042 -0.527 . . . . 0.0 110.884 -179.864 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 320' ' ' GLY . . . . . . . . . . . . . . . -107.23 1.14 35.1 Favored Glycine 0 N--CA 1.452 -0.26 0 C-N-CA 120.658 -0.782 . . . . 0.0 112.83 -179.758 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 321' ' ' GLN . . . . . . . . . . . . . 27.7 mm-40 -112.5 88.49 11.13 Favored Pre-proline 0 C--N 1.33 -0.261 0 CA-C-O 120.491 0.186 . . . . 0.0 110.89 179.969 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 322' ' ' PRO . . . . . . . . . . . . . 73.9 Cg_endo -74.15 -29.46 9.78 Favored 'Trans proline' 0 C--N 1.347 0.475 0 C-N-CA 122.625 2.217 . . . . 0.0 112.654 -179.815 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 323' ' ' ASP . . . . . . . . . . . . . 13.8 t70 -68.87 -51.02 44.78 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.332 -0.395 . . . . 0.0 111.084 -179.647 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 324' ' ' ILE . . . . . . . . . . . . . 73.3 mt -68.23 -44.16 84.22 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.16 179.943 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 325' ' ' TYR . . . . . . . . . . . . . 35.3 t80 -58.04 -53.44 58.23 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.855 -179.826 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 326' ' ' LYS . . . . . 0.416 ' O ' ' HG3' ' B' ' 330' ' ' GLU . 86.1 tttt -60.09 -58.44 8.54 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.372 -179.865 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 327' ' ' ALA . . . . . 0.425 ' HB3' HD11 ' B' ' 365' ' ' LEU . . . -45.69 -53.07 9.9 Favored 'General case' 0 C--O 1.234 0.248 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.592 -179.654 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 328' ' ' PHE . . . . . . . . . . . . . 52.2 t80 -54.01 -53.52 51.84 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.146 0.498 . . . . 0.0 110.649 179.947 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 329' ' ' LEU . . . . . 0.573 ' HB3' ' HG3' ' A' ' 362' ' ' MET . 84.6 mt -60.5 -24.38 65.26 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.712 -0.676 . . . . 0.0 110.984 179.891 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 330' ' ' GLU . . . . . 0.416 ' HG3' ' O ' ' B' ' 326' ' ' LYS . 48.0 mt-10 -76.17 -33.38 59.35 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.569 179.587 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 331' ' ' ILE . . . . . 0.432 HG22 HG22 ' B' ' 358' ' ' VAL . 76.8 mt -70.77 -44.53 76.2 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.222 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.275 179.378 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 332' ' ' LEU . . . . . . . . . . . . . 30.1 mt -69.34 -39.91 77.85 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.987 179.569 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 333' ' ' HIS . . . . . . . . . . . . . 53.5 t-80 -62.84 -54.04 44.87 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.977 0.418 . . . . 0.0 110.378 179.641 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 334' ' ' THR . . . . . . . . . . . . . 70.7 m -60.0 -33.69 72.32 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.361 179.545 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 335' ' ' TYR . . . . . 0.408 ' O ' ' HG2' ' B' ' 339' ' ' GLN . 74.7 t80 -61.35 -48.18 82.49 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.664 179.518 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 336' ' ' GLN . . . . . 0.558 ' HB2' HG22 ' A' ' 369' ' ' VAL . 20.6 tt0 -60.75 -46.5 90.21 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.742 179.727 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 337' ' ' LYS . . . . . . . . . . . . . 41.0 ttmt -57.34 -43.08 83.12 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.031 -0.531 . . . . 0.0 111.008 179.985 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 338' ' ' GLU . . . . . . . . . . . . . 29.8 mm-40 -68.04 -36.84 80.57 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.378 -179.664 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 339' ' ' GLN . . . . . 0.408 ' HG2' ' O ' ' B' ' 335' ' ' TYR . 27.0 mm-40 -66.41 -44.33 83.26 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.744 0.307 . . . . 0.0 110.837 179.949 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 340' ' ' ARG . . . . . . . . . . . . . 99.7 mtt180 -62.76 -54.11 44.02 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.738 179.895 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 341' ' ' ASN . . . . . . . . . . . . . 2.7 m-20 -57.52 -44.95 85.49 Favored 'General case' 0 C--O 1.234 0.249 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.947 179.865 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 342' ' ' ALA . . . . . . . . . . . . . . . -63.8 -30.22 71.33 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.846 179.881 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 343' ' ' LYS . . . . . . . . . . . . . 26.8 ttpp -76.1 -31.29 58.63 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.64 179.756 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 344' ' ' GLU . . . . . . . . . . . . . 22.7 mm-40 -69.63 -55.24 10.59 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.03 -0.532 . . . . 0.0 111.076 179.939 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 345' ' ' ALA . . . . . . . . . . . . . . . -74.0 -42.32 60.55 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.814 179.997 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 346' ' ' GLY . . . . . . . . . . . . . . . 43.59 56.34 4.95 Favored Glycine 0 C--N 1.331 0.291 0 CA-C-N 115.915 -0.584 . . . . 0.0 113.066 179.728 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 347' ' ' GLY . . . . . . . . . . . . . . . -174.54 -112.49 0.29 Allowed Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.559 -0.829 . . . . 0.0 112.938 -179.881 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 348' ' ' ASN . . . . . . . . . . . . . 27.5 t-20 -56.78 -30.6 63.8 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.709 0.29 . . . . 0.0 111.4 -179.616 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 349' ' ' TYR . . . . . . . . . . . . . 40.5 t80 -62.67 138.16 58.43 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.806 0.336 . . . . 0.0 110.883 -179.822 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 350' ' ' THR . . . . . . . . . . . . . 90.3 m -128.05 125.11 23.4 Favored Pre-proline 0 C--N 1.329 -0.305 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.849 179.778 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 351' ' ' PRO . . . . . . . . . . . . . 52.7 Cg_exo -55.1 163.31 4.51 Favored 'Trans proline' 0 C--N 1.349 0.564 0 C-N-CA 122.402 2.068 . . . . 0.0 112.262 179.948 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 352' ' ' ALA . . . . . . . . . . . . . . . -93.48 -23.05 18.51 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.163 -179.82 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 353' ' ' LEU . . . . . 0.546 ' HB3' ' HG2' ' B' ' 357' ' ' GLU . 0.2 OUTLIER -159.15 140.31 12.9 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 121.229 0.538 . . . . 0.0 111.743 179.91 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' B' B ' 354' ' ' THR . . . . . . . . . . . . . 60.4 p -114.63 -167.09 1.17 Allowed 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.754 -0.657 . . . . 0.0 110.744 179.733 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 355' ' ' GLU . . . . . 0.4 ' OE1' ' HD2' ' B' ' 381' ' ' PRO . 42.7 mt-10 -56.8 -27.62 60.15 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.957 0.408 . . . . 0.0 110.521 179.547 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 356' ' ' GLN . . . . . . . . . . . . . 87.8 mt-30 -70.55 -49.53 47.08 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.814 -0.63 . . . . 0.0 111.115 -179.828 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 357' ' ' GLU . . . . . 0.546 ' HG2' ' HB3' ' B' ' 353' ' ' LEU . 7.0 tp10 -62.7 -44.06 97.21 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.103 -179.634 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 358' ' ' VAL . . . . . 0.432 HG22 HG22 ' B' ' 331' ' ' ILE . 95.1 t -62.32 -58.08 9.17 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.351 -0.386 . . . . 0.0 111.29 -179.911 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 359' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -58.81 -31.55 68.56 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.523 -179.246 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 360' ' ' ALA . . . . . . . . . . . . . . . -72.16 -60.9 2.0 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.729 0.299 . . . . 0.0 111.252 -179.811 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 361' ' ' GLN . . . . . . . . . . . . . 97.6 mt-30 -55.37 -35.7 65.55 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 121.045 0.45 . . . . 0.0 110.348 179.555 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 362' ' ' VAL . . . . . . . . . . . . . 14.4 t -70.82 -36.85 66.24 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 CA-C-N 115.734 -0.666 . . . . 0.0 110.485 179.316 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 363' ' ' ALA . . . . . 0.698 ' HA ' HD21 ' B' ' 373' ' ' LEU . . . -63.13 -38.33 90.75 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.735 179.903 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 364' ' ' ARG . . . . . . . . . . . . . 36.1 ttt180 -88.71 -18.14 28.48 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.793 179.73 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 365' ' ' LEU . . . . . 0.425 HD11 ' HB3' ' B' ' 327' ' ' ALA . 20.7 tp -56.22 -64.86 0.72 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.019 -0.537 . . . . 0.0 111.011 -179.861 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 366' ' ' PHE . . . . . . . . . . . . . 74.0 m-85 -71.56 167.83 18.89 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.024 -0.535 . . . . 0.0 111.096 -179.675 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 367' ' ' LYS . . . . . . . . . . . . . 35.1 mmtp -82.18 75.32 9.11 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.955 -179.796 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 368' ' ' ASN . . . . . . . . . . . . . 85.3 m-20 58.92 10.42 1.54 Allowed 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.11 -0.496 . . . . 0.0 111.356 179.967 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 369' ' ' GLN . . . . . . . . . . . . . 83.0 mm-40 -61.02 113.25 2.44 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.785 0.326 . . . . 0.0 110.852 179.979 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 370' ' ' GLU . . . . . . . . . . . . . 9.7 tp10 -91.25 -26.77 18.84 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.218 -0.447 . . . . 0.0 110.862 179.916 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 371' ' ' ASP . . . . . . . . . . . . . 18.0 t70 -56.6 -54.6 44.12 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.69 179.91 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 372' ' ' LEU . . . . . 0.461 ' H ' HD12 ' B' ' 372' ' ' LEU . 6.4 mp -65.17 -43.26 92.29 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.777 179.81 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 373' ' ' LEU . . . . . 0.698 HD21 ' HA ' ' B' ' 363' ' ' ALA . 2.1 mp -56.69 -34.53 67.49 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.926 179.789 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 374' ' ' SER . . . . . . . . . . . . . 59.7 m -75.97 -56.25 4.84 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.627 -179.948 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 375' ' ' GLU . . . . . . . . . . . . . 10.1 mm-40 -50.9 -33.53 24.58 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.599 179.647 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 376' ' ' PHE . . . . . 0.418 ' HB2' ' OH ' ' B' ' 310' ' ' TYR . 79.4 t80 -80.76 -38.77 28.02 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.426 179.55 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 377' ' ' GLY . . . . . . . . . . . . . . . -58.61 -28.61 62.84 Favored Glycine 0 N--CA 1.448 -0.519 0 C-N-CA 120.653 -0.784 . . . . 0.0 111.928 179.583 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 378' ' ' GLN . . . . . . . . . . . . . 50.3 mt-30 -61.31 -35.62 77.88 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.729 0.299 . . . . 0.0 110.807 179.603 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 379' ' ' PHE . . . . . . . . . . . . . 68.2 m-85 -58.96 -40.38 84.56 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.772 179.766 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 380' ' ' LEU . . . . . . . . . . . . . 48.7 mt -51.32 131.92 33.24 Favored Pre-proline 0 C--N 1.331 -0.221 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.441 179.907 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 381' ' ' PRO . . . . . 0.451 ' HG3' ' HB3' ' A' ' 376' ' ' GLN . 76.3 Cg_exo -49.59 108.04 0.18 Allowed 'Trans proline' 0 C--N 1.348 0.529 0 C-N-CA 122.235 1.956 . . . . 0.0 112.234 -179.806 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 382' ' ' ASP . . . . . . . . . . . . . 7.8 m-20 -72.86 151.77 41.81 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.961 -179.777 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 383' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.251 1.138 0 CA-C-O 118.159 -0.924 . . . . 0.0 111.09 -179.924 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 366' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.46 0.045 0 CA-C-O 120.793 0.33 . . . . 0.0 111.307 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 367' ' ' VAL . . . . . . . . . . . . . 16.4 m -62.63 -26.39 40.52 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.152 179.831 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 368' ' ' TYR . . . . . . . . . . . . . 42.6 t80 -73.36 -54.92 7.15 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.251 -0.432 . . . . 0.0 111.169 -179.825 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 369' ' ' VAL . . . . . 0.515 HG13 HD22 ' A' ' 370' ' ' LEU . 7.7 p -57.99 -42.22 82.13 Favored 'Isoleucine or valine' 0 C--O 1.232 0.169 0 CA-C-O 120.782 0.325 . . . . 0.0 110.799 -179.992 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 370' ' ' LEU . . . . . 0.515 HD22 HG13 ' A' ' 369' ' ' VAL . 2.7 mm? -63.16 -46.38 87.45 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 121.011 0.434 . . . . 0.0 110.124 179.093 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 371' ' ' SER . . . . . . . . . . . . . 30.6 t -64.78 -24.21 67.48 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 115.843 -0.617 . . . . 0.0 110.641 179.36 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 372' ' ' SER . . . . . . . . . . . . . 46.6 t -72.59 -50.37 25.87 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.678 -179.972 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 373' ' ' MET . . . . . . . . . . . . . 66.4 mtt -62.02 -41.08 97.7 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.75 179.652 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 374' ' ' ALA . . . . . . . . . . . . . . . -65.71 -55.77 15.59 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.089 -0.505 . . . . 0.0 112.021 -179.329 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 375' ' ' ARG . . . . . . . . . . . . . 25.3 mmm180 -60.08 -44.6 94.65 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.506 -0.315 . . . . 0.0 111.668 -179.509 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 376' ' ' GLN . . . . . . . . . . . . . 24.2 mm-40 . . . . . 0 C--N 1.328 -0.332 0 CA-C-N 116.431 -0.35 . . . . 0.0 111.812 -179.407 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' B' B ' 302' ' ' VAL . . . . . 0.59 HG23 ' H ' ' B' ' 303' ' ' GLU . 5.1 m . . . . . 0 CA--C 1.529 0.153 0 N-CA-C 111.819 0.303 . . . . 0.0 111.819 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 303' ' ' GLU . . . . . 0.59 ' H ' HG23 ' B' ' 302' ' ' VAL . 10.6 pt-20 -57.33 -39.63 76.29 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 111.761 0.282 . . . . 0.0 111.761 -179.152 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 304' ' ' PHE . . . . . . . . . . . . . 81.5 m-85 -60.22 -77.08 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 112.048 0.388 . . . . 0.0 112.048 -179.217 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 305' ' ' ASN . . . . . . . . . . . . . 37.5 t30 -50.47 -45.36 56.12 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 112.779 0.659 . . . . 0.0 112.779 -178.596 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 306' ' ' HIS . . . . . 0.426 ' HB2' ' O ' ' B' ' 302' ' ' VAL . 0.4 OUTLIER -64.39 -64.87 0.77 Allowed 'General case' 0 C--N 1.33 -0.27 0 N-CA-C 112.315 0.487 . . . . 0.0 112.315 -178.418 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' B' B ' 307' ' ' ALA . . . . . . . . . . . . . . . -54.88 -48.69 72.67 Favored 'General case' 0 N--CA 1.464 0.27 0 N-CA-C 112.183 0.438 . . . . 0.0 112.183 -178.929 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 308' ' ' ILE . . . . . . . . . . . . . 97.6 mt -55.66 -54.19 28.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-O 120.707 0.289 . . . . 0.0 111.097 -179.889 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 309' ' ' ASN . . . . . 0.526 ' N ' HD22 ' B' ' 309' ' ' ASN . 0.9 OUTLIER -63.45 -22.34 66.83 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.436 -0.347 . . . . 0.0 110.99 179.985 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' B' B ' 310' ' ' TYR . . . . . 0.445 ' HA ' ' HE2' ' B' ' 313' ' ' LYS . 64.0 t80 -70.4 -61.11 1.9 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.218 -0.447 . . . . 0.0 110.826 179.887 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 311' ' ' VAL . . . . . . . . . . . . . 50.6 t -62.37 -28.39 44.55 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.771 179.823 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 312' ' ' ASN . . . . . . . . . . . . . 26.8 t-20 -69.18 -55.32 10.98 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.379 -179.873 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 313' ' ' LYS . . . . . 0.564 ' HG3' ' N ' ' B' ' 314' ' ' ILE . 40.5 pttt -58.18 -43.61 87.61 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.377 -0.374 . . . . 0.0 111.345 -179.542 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 314' ' ' ILE . . . . . 0.564 ' N ' ' HG3' ' B' ' 313' ' ' LYS . 96.0 mt -68.66 -34.97 67.86 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.437 -0.347 . . . . 0.0 111.368 -179.473 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 315' ' ' LYS . . . . . . . . . . . . . 22.4 ttmm -66.65 -37.17 84.24 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.822 0.344 . . . . 0.0 110.711 179.648 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 316' ' ' ASN . . . . . . . . . . . . . 25.4 t-20 -83.61 -21.45 32.54 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.978 -179.836 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 317' ' ' ARG . . . . . . . . . . . . . 21.9 tpt180 -75.92 -65.84 0.86 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.994 -179.998 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 318' ' ' PHE . . . . . . . . . . . . . 99.1 m-85 -91.24 35.66 0.93 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.933 179.991 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 319' ' ' GLN . . . . . . . . . . . . . 19.1 pt20 -58.34 -18.27 26.2 Favored 'General case' 0 N--CA 1.449 -0.519 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.17 179.905 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 320' ' ' GLY . . . . . . . . . . . . . . . -96.03 -22.66 19.61 Favored Glycine 0 N--CA 1.451 -0.347 0 C-N-CA 120.805 -0.712 . . . . 0.0 112.58 179.937 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 321' ' ' GLN . . . . . 0.662 HE21 ' HB2' ' B' ' 323' ' ' ASP . 48.8 tp60 -109.0 96.2 19.85 Favored Pre-proline 0 C--N 1.33 -0.26 0 CA-C-O 120.465 0.174 . . . . 0.0 110.825 -179.946 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 322' ' ' PRO . . . . . . . . . . . . . 87.8 Cg_endo -81.76 -12.25 11.11 Favored 'Trans proline' 0 C--N 1.348 0.511 0 C-N-CA 122.625 2.217 . . . . 0.0 112.847 -179.735 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 323' ' ' ASP . . . . . 0.662 ' HB2' HE21 ' B' ' 321' ' ' GLN . 9.6 m-20 -70.29 -55.69 8.59 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.517 -0.311 . . . . 0.0 111.168 -179.788 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 324' ' ' ILE . . . . . . . . . . . . . 58.8 mt -65.46 -37.37 79.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.277 -0.42 . . . . 0.0 111.065 -179.774 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 325' ' ' TYR . . . . . . . . . . . . . 28.1 t80 -64.05 -50.09 69.78 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.592 179.971 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 326' ' ' LYS . . . . . . . . . . . . . 38.9 ttmt -61.04 -38.66 86.94 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.035 -0.529 . . . . 0.0 110.692 179.613 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 327' ' ' ALA . . . . . 0.405 ' HB3' HD21 ' B' ' 365' ' ' LEU . . . -58.87 -54.96 41.24 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.916 179.905 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 328' ' ' PHE . . . . . . . . . . . . . 90.0 t80 -53.59 -49.96 66.65 Favored 'General case' 0 C--O 1.235 0.29 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.613 179.726 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 329' ' ' LEU . . . . . . . . . . . . . 96.4 mt -58.0 -35.53 71.36 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.96 179.892 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 330' ' ' GLU . . . . . . . . . . . . . 41.7 mt-10 -67.83 -34.84 77.52 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.617 179.652 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 331' ' ' ILE . . . . . . . . . . . . . 74.2 mt -65.65 -49.77 75.62 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.197 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.751 179.565 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 332' ' ' LEU . . . . . 0.467 ' HB3' HG11 ' A' ' 369' ' ' VAL . 5.2 mp -67.22 -30.56 70.51 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.359 -0.382 . . . . 0.0 111.104 179.939 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 333' ' ' HIS . . . . . . . . . . . . . 49.7 t-80 -65.26 -55.7 16.94 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.872 0.368 . . . . 0.0 110.279 179.565 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 334' ' ' THR . . . . . . . . . . . . . 77.6 m -63.18 -36.52 83.9 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.337 179.486 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 335' ' ' TYR . . . . . . . . . . . . . 87.9 t80 -66.92 -33.21 75.1 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.311 179.435 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 336' ' ' GLN . . . . . . . . . . . . . 8.1 tt0 -68.58 -49.7 57.38 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.84 -0.618 . . . . 0.0 110.66 179.815 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 337' ' ' LYS . . . . . 0.524 ' O ' ' HG2' ' B' ' 340' ' ' ARG . 39.1 ttpt -62.83 -36.89 84.69 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.068 179.955 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 338' ' ' GLU . . . . . . . . . . . . . 18.9 mm-40 -71.15 -32.53 69.07 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.974 0.416 . . . . 0.0 110.238 179.345 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 339' ' ' GLN . . . . . . . . . . . . . 58.4 tt0 -72.24 -43.3 64.59 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.798 -0.637 . . . . 0.0 110.736 179.512 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 340' ' ' ARG . . . . . 0.569 ' HG3' ' N ' ' B' ' 341' ' ' ASN . 36.3 ptt180 -63.74 -53.64 47.84 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 121.015 0.436 . . . . 0.0 110.772 179.933 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 341' ' ' ASN . . . . . 0.569 ' N ' ' HG3' ' B' ' 340' ' ' ARG . 51.1 t-20 -55.8 -51.98 65.58 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.677 -0.692 . . . . 0.0 110.837 179.502 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 342' ' ' ALA . . . . . . . . . . . . . . . -58.73 -32.76 69.51 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.015 179.897 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 343' ' ' LYS . . . . . . . . . . . . . 62.5 tttm -70.53 -38.28 74.19 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.948 179.882 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 344' ' ' GLU . . . . . . . . . . . . . 20.8 mm-40 -78.29 -22.75 47.76 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.056 -179.899 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 345' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.33 -0.274 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.095 -179.967 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' B' B ' 351' ' ' PRO . . . . . . . . . . . . . 50.1 Cg_exo . . . . . 0 C--O 1.231 0.142 0 CA-C-O 120.744 0.227 . . . . 0.0 112.529 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' B' B ' 352' ' ' ALA . . . . . . . . . . . . . . . -68.83 -54.34 16.31 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.838 179.838 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 353' ' ' LEU . . . . . 0.446 ' HG ' ' HG2' ' B' ' 357' ' ' GLU . 7.7 mp -107.42 131.23 54.5 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.989 -0.55 . . . . 0.0 111.068 179.972 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 354' ' ' THR . . . . . 0.401 ' H ' ' HB2' ' B' ' 357' ' ' GLU . 71.2 p -113.64 -177.39 3.12 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.64 179.601 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 355' ' ' GLU . . . . . . . . . . . . . 48.0 mt-10 -56.53 -35.79 68.48 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.953 0.406 . . . . 0.0 110.669 179.823 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 356' ' ' GLN . . . . . . . . . . . . . 15.4 mm100 -74.28 -34.2 63.47 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.824 -0.625 . . . . 0.0 111.217 -179.907 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 357' ' ' GLU . . . . . 0.446 ' HG2' ' HG ' ' B' ' 353' ' ' LEU . 5.2 tp10 -63.71 -47.81 79.62 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.865 0.365 . . . . 0.0 110.513 -179.966 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 358' ' ' VAL . . . . . 0.485 ' O ' HG23 ' B' ' 362' ' ' VAL . 93.7 t -67.52 -55.31 17.66 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.334 -179.933 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 359' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER -53.34 -37.81 62.68 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.575 0.226 . . . . 0.0 111.29 -179.332 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 360' ' ' ALA . . . . . . . . . . . . . . . -67.12 -60.8 2.31 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.589 -0.278 . . . . 0.0 111.396 -179.784 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 361' ' ' GLN . . . . . . . . . . . . . 97.2 mt-30 -52.96 -45.44 67.76 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.341 -0.39 . . . . 0.0 110.81 179.918 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 362' ' ' VAL . . . . . 0.485 HG23 ' O ' ' B' ' 358' ' ' VAL . 99.1 t -62.02 -38.75 81.55 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.224 -0.443 . . . . 0.0 110.386 179.371 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 363' ' ' ALA . . . . . . . . . . . . . . . -65.97 -28.05 68.61 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.503 179.484 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 364' ' ' ARG . . . . . . . . . . . . . 61.1 ttp180 -84.63 -26.98 27.47 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.905 -0.588 . . . . 0.0 110.544 179.5 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 365' ' ' LEU . . . . . 0.405 HD21 ' HB3' ' B' ' 327' ' ' ALA . 1.2 mp -61.99 -37.43 84.78 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.022 -0.536 . . . . 0.0 110.675 179.758 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 366' ' ' PHE . . . . . . . . . . . . . 20.2 m-85 -117.09 156.91 26.77 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.922 -179.622 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 367' ' ' LYS . . . . . . . . . . . . . 63.4 tttp -123.36 -73.83 0.63 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.736 179.885 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 368' ' ' ASN . . . . . . . . . . . . . 27.7 t-20 -72.69 -18.05 61.58 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.554 179.789 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 369' ' ' GLN . . . . . . . . . . . . . 23.7 mp0 -94.71 86.99 4.9 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.846 179.937 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 370' ' ' GLU . . . . . . . . . . . . . 42.8 tt0 -93.69 -14.75 26.0 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.609 179.89 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 371' ' ' ASP . . . . . . . . . . . . . 18.5 t70 -55.69 -37.73 68.73 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.914 -0.585 . . . . 0.0 110.864 179.899 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 372' ' ' LEU . . . . . 0.4 ' H ' HD12 ' B' ' 372' ' ' LEU . 6.4 mp -67.06 -38.63 86.13 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.117 179.891 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 373' ' ' LEU . . . . . . . . . . . . . 27.3 mt -64.31 -44.27 92.1 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.404 -0.362 . . . . 0.0 110.926 -179.777 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 374' ' ' SER . . . . . . . . . . . . . 59.2 m -65.79 -55.0 19.5 Favored 'General case' 0 C--O 1.236 0.352 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.507 179.649 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 375' ' ' GLU . . . . . 0.447 ' HG3' ' NZ ' ' B' ' 313' ' ' LYS . 20.6 mm-40 -52.78 -38.55 61.25 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.993 -0.548 . . . . 0.0 110.075 179.409 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 376' ' ' PHE . . . . . . . . . . . . . 91.0 t80 -66.42 -41.67 88.89 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.026 179.268 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 377' ' ' GLY . . . . . . . . . . . . . . . -55.62 -35.84 63.25 Favored Glycine 0 N--CA 1.448 -0.503 0 C-N-CA 120.621 -0.8 . . . . 0.0 111.269 179.103 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 378' ' ' GLN . . . . . . . . . . . . . 18.8 mm-40 -56.99 -34.84 68.52 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.928 0.394 . . . . 0.0 110.421 179.01 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 379' ' ' PHE . . . . . . . . . . . . . 89.6 m-85 -74.31 -38.49 63.31 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.031 -0.532 . . . . 0.0 110.712 179.566 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 380' ' ' LEU . . . . . . . . . . . . . 10.9 tp -45.31 115.0 2.45 Favored Pre-proline 0 C--N 1.331 -0.231 0 CA-C-N 115.861 -0.609 . . . . 0.0 111.037 -179.475 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 381' ' ' PRO . . . . . . . . . . . . . 99.1 Cg_exo . . . . . 0 C--N 1.35 0.645 0 C-N-CA 122.704 2.269 . . . . 0.0 112.628 -179.777 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 366' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.231 0.107 0 CA-C-O 120.915 0.388 . . . . 0.0 110.993 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 367' ' ' VAL . . . . . . . . . . . . . 14.8 t -65.49 -22.09 30.34 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.868 -179.89 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 368' ' ' TYR . . . . . . . . . . . . . 61.5 t80 -65.14 -53.55 43.39 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.025 179.993 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 369' ' ' VAL . . . . . 0.4 HG23 ' N ' ' A' ' 370' ' ' LEU . 17.4 m -70.96 -45.23 74.03 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-N 116.457 -0.338 . . . . 0.0 111.093 179.881 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 370' ' ' LEU . . . . . 0.4 ' N ' HG23 ' A' ' 369' ' ' VAL . 98.9 mt -56.43 -37.97 70.94 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.386 -0.37 . . . . 0.0 110.739 179.762 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 371' ' ' SER . . . . . . . . . . . . . 83.1 p -70.51 -60.66 2.13 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.148 -179.994 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 372' ' ' SER . . . . . . . . . . . . . 79.3 p -52.56 -33.22 44.85 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.508 -0.315 . . . . 0.0 111.814 -179.28 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 373' ' ' MET . . . . . . . . . . . . . 95.8 mtp -74.4 -45.89 43.82 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 111.701 0.26 . . . . 0.0 111.701 -179.318 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 374' ' ' ALA . . . . . . . . . . . . . . . -84.48 -6.58 59.39 Favored 'General case' 0 C--N 1.331 -0.234 0 N-CA-C 112.339 0.496 . . . . 0.0 112.339 -179.217 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 375' ' ' ARG . . . . . 0.471 ' HA ' ' HE ' ' A' ' 375' ' ' ARG . 2.6 mmp_? -106.32 -27.51 10.95 Favored 'General case' 0 C--N 1.33 -0.276 0 N-CA-C 111.64 0.237 . . . . 0.0 111.64 -179.296 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 376' ' ' GLN . . . . . . . . . . . . . 27.6 tt0 . . . . . 0 C--N 1.333 -0.14 0 CA-C-O 120.702 0.287 . . . . 0.0 111.065 -179.8 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' B' B ' 302' ' ' VAL . . . . . . . . . . . . . 22.1 m . . . . . 0 C--O 1.23 0.077 0 CA-C-O 121.06 0.457 . . . . 0.0 111.29 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' B' B ' 303' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -56.7 -68.76 0.19 Allowed 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.665 -0.698 . . . . 0.0 111.805 -178.859 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 304' ' ' PHE . . . . . 0.57 ' HA ' HD13 ' B' ' 308' ' ' ILE . 77.5 t80 -50.0 -63.58 1.07 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.867 -179.257 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 305' ' ' ASN . . . . . . . . . . . . . 53.9 t30 -46.57 -63.58 0.98 Allowed 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 112.355 0.502 . . . . 0.0 112.355 -178.803 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 306' ' ' HIS . . . . . . . . . . . . . 12.7 m-70 -55.23 -68.71 0.17 Allowed 'General case' 0 C--N 1.33 -0.266 0 N-CA-C 112.765 0.654 . . . . 0.0 112.765 -178.661 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 307' ' ' ALA . . . . . . . . . . . . . . . -48.68 -61.97 1.75 Allowed 'General case' 0 CA--C 1.532 0.254 0 N-CA-C 112.903 0.705 . . . . 0.0 112.903 -178.304 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 308' ' ' ILE . . . . . 0.57 HD13 ' HA ' ' B' ' 304' ' ' PHE . 1.8 mp -52.48 -61.22 0.82 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 N-CA-C 112.221 0.452 . . . . 0.0 112.221 -179.04 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 309' ' ' ASN . . . . . . . . . . . . . 3.2 t-20 -55.4 -27.24 46.47 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.725 0.298 . . . . 0.0 111.518 -179.256 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 310' ' ' TYR . . . . . . . . . . . . . 82.3 t80 -68.02 -57.25 6.46 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.369 -0.378 . . . . 0.0 111.225 -179.726 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 311' ' ' VAL . . . . . . . . . . . . . 27.8 t -58.17 -44.77 88.38 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.163 0 CA-C-N 116.367 -0.379 . . . . 0.0 110.705 -179.969 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 312' ' ' ASN . . . . . . . . . . . . . 2.7 t-20 -61.65 -37.15 82.96 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.13 -0.487 . . . . 0.0 110.628 179.722 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 313' ' ' LYS . . . . . . . . . . . . . 28.0 tttp -60.11 -57.11 14.25 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.963 179.827 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 314' ' ' ILE . . . . . . . . . . . . . 58.7 mt -67.51 -23.37 29.81 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.412 -179.619 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 315' ' ' LYS . . . . . . . . . . . . . 1.3 tmmt? -73.24 -36.58 66.45 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.318 -0.401 . . . . 0.0 111.142 -179.727 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 316' ' ' ASN . . . . . . . . . . . . . 24.0 t-20 -86.59 -43.19 12.87 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.412 -0.358 . . . . 0.0 111.469 -179.547 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 317' ' ' ARG . . . . . 0.43 ' HE ' ' HA ' ' B' ' 317' ' ' ARG . 5.7 tpm_? -64.02 -65.82 0.63 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.383 -0.371 . . . . 0.0 111.188 -179.779 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 318' ' ' PHE . . . . . . . . . . . . . 68.1 m-85 -81.62 31.59 0.35 Allowed 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.433 -179.639 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 319' ' ' GLN . . . . . . . . . . . . . 50.1 tt0 -68.69 -15.6 63.57 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.7 179.886 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 320' ' ' GLY . . . . . . . . . . . . . . . -74.53 -48.25 13.98 Favored Glycine 0 N--CA 1.452 -0.297 0 C-N-CA 120.888 -0.672 . . . . 0.0 112.604 179.964 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 321' ' ' GLN . . . . . . . . . . . . . 20.3 tp60 -100.92 100.94 14.06 Favored Pre-proline 0 C--N 1.33 -0.242 0 CA-C-N 116.579 0.19 . . . . 0.0 110.754 179.878 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 322' ' ' PRO . . . . . . . . . . . . . 33.6 Cg_endo -64.58 -24.71 62.83 Favored 'Trans proline' 0 C--N 1.349 0.6 0 C-N-CA 122.495 2.13 . . . . 0.0 112.525 -179.914 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 323' ' ' ASP . . . . . . . . . . . . . 8.0 m-20 -62.79 -37.07 85.23 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.059 -179.741 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 324' ' ' ILE . . . . . . . . . . . . . 48.8 mm -68.85 -61.0 1.87 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.374 -0.376 . . . . 0.0 111.039 -179.882 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 325' ' ' TYR . . . . . . . . . . . . . 23.2 t80 -51.75 -51.86 53.08 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.911 -0.586 . . . . 0.0 111.013 -179.938 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 326' ' ' LYS . . . . . . . . . . . . . 63.0 tttm -58.3 -46.02 86.89 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.145 -179.844 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 327' ' ' ALA . . . . . . . . . . . . . . . -52.23 -55.28 22.26 Favored 'General case' 0 C--O 1.233 0.237 0 CA-C-O 120.875 0.369 . . . . 0.0 111.078 -179.986 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 328' ' ' PHE . . . . . . . . . . . . . 60.6 t80 -54.05 -45.17 71.59 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.473 179.77 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 329' ' ' LEU . . . . . . . . . . . . . 73.4 mt -59.44 -35.16 73.51 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.737 179.569 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 330' ' ' GLU . . . . . . . . . . . . . 47.1 mt-10 -67.69 -37.1 81.82 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.446 179.653 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 331' ' ' ILE . . . . . . . . . . . . . 70.8 mt -63.69 -53.5 43.97 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.596 179.376 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 332' ' ' LEU . . . . . . . . . . . . . 8.4 mp -63.02 -35.42 80.17 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.838 179.732 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 333' ' ' HIS . . . . . . . . . . . . . 45.6 t60 -62.27 -52.9 61.89 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.905 0.384 . . . . 0.0 110.005 179.442 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 334' ' ' THR . . . . . 0.43 HG22 HD13 ' B' ' 353' ' ' LEU . 58.8 m -60.1 -32.07 70.64 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.984 -0.553 . . . . 0.0 109.886 179.004 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 335' ' ' TYR . . . . . . . . . . . . . 57.3 t80 -63.88 -38.66 91.9 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.641 -0.709 . . . . 0.0 109.879 179.273 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 336' ' ' GLN . . . . . . . . . . . . . 3.4 tt0 -66.35 -48.99 68.44 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.689 -0.687 . . . . 0.0 110.42 179.529 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 337' ' ' LYS . . . . . . . . . . . . . 38.6 ttpt -56.09 -50.62 70.52 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.807 -0.633 . . . . 0.0 111.018 179.987 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 338' ' ' GLU . . . . . . . . . . . . . 38.3 mm-40 -63.36 -35.67 81.16 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.139 -179.819 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 339' ' ' GLN . . . . . . . . . . . . . 23.3 tp60 -65.38 -45.65 83.22 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.719 179.936 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 340' ' ' ARG . . . . . . . . . . . . . 80.3 mtp180 -60.84 -50.53 73.07 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.604 179.705 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 341' ' ' ASN . . . . . . . . . . . . . 81.8 m-20 -54.9 -44.13 73.86 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.7 179.685 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 342' ' ' ALA . . . . . . . . . . . . . . . -64.76 -33.04 75.04 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.815 179.704 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 343' ' ' LYS . . . . . . . . . . . . . 39.5 ttpt -71.52 -40.07 70.33 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.862 179.799 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 344' ' ' GLU . . . . . . . . . . . . . 13.3 mm-40 -69.29 -33.56 73.38 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.906 179.993 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 345' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.286 0 CA-C-N 116.165 -0.471 . . . . 0.0 111.021 179.922 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' B' B ' 351' ' ' PRO . . . . . . . . . . . . . 57.7 Cg_exo . . . . . 0 CA--C 1.526 0.084 0 CA-C-O 120.814 0.256 . . . . 0.0 112.258 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' B' B ' 352' ' ' ALA . . . . . . . . . . . . . . . -59.78 -44.05 94.09 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.256 -179.796 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 353' ' ' LEU . . . . . 0.434 ' HG ' ' HG2' ' B' ' 357' ' ' GLU . 6.3 mp -112.02 120.16 40.92 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 120.998 0.428 . . . . 0.0 111.28 179.879 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 354' ' ' THR . . . . . . . . . . . . . 56.2 p -113.06 -164.18 0.9 Allowed 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.802 -0.635 . . . . 0.0 110.369 179.422 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 355' ' ' GLU . . . . . 0.402 ' H ' ' CD ' ' B' ' 355' ' ' GLU . 2.0 mp0 -61.29 -38.09 85.53 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 121.025 0.441 . . . . 0.0 110.368 179.681 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 356' ' ' GLN . . . . . . . . . . . . . 24.5 mt-30 -72.75 -40.91 65.65 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 115.868 -0.605 . . . . 0.0 111.317 -179.852 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 357' ' ' GLU . . . . . 0.434 ' HG2' ' HG ' ' B' ' 353' ' ' LEU . 4.8 tp10 -59.49 -53.1 62.02 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-O 120.785 0.326 . . . . 0.0 110.702 -179.793 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 358' ' ' VAL . . . . . 0.514 ' O ' HG23 ' B' ' 362' ' ' VAL . 49.9 t -61.82 -54.87 28.81 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.205 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.973 179.928 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 359' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER -52.28 -37.25 55.06 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.566 -0.288 . . . . 0.0 110.938 -179.524 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 360' ' ' ALA . . . . . . . . . . . . . . . -65.08 -58.64 5.53 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.43 -0.35 . . . . 0.0 111.411 -179.826 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 361' ' ' GLN . . . . . . . . . . . . . 47.8 mt-30 -55.83 -38.71 70.38 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.897 -179.889 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 362' ' ' VAL . . . . . 0.514 HG23 ' O ' ' B' ' 358' ' ' VAL . 60.4 t -71.01 -34.01 53.82 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.291 179.581 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 363' ' ' ALA . . . . . 0.547 ' HA ' HD21 ' B' ' 373' ' ' LEU . . . -64.2 -36.23 83.38 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.266 179.356 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 364' ' ' ARG . . . . . . . . . . . . . 58.9 mtp180 -87.18 -20.32 27.16 Favored 'General case' 0 N--CA 1.453 -0.286 0 CA-C-N 115.806 -0.634 . . . . 0.0 110.2 179.251 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 365' ' ' LEU . . . . . . . . . . . . . 23.6 tp -60.3 -21.11 61.58 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 115.824 -0.626 . . . . 0.0 109.916 179.239 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 366' ' ' PHE . . . . . . . . . . . . . 44.8 m-85 -131.13 -174.54 3.42 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.527 -0.76 . . . . 0.0 109.925 179.391 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 367' ' ' LYS . . . . . . . . . . . . . 66.5 mttm -133.89 -80.37 0.46 Allowed 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.745 0.307 . . . . 0.0 111.214 -179.943 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 368' ' ' ASN . . . . . . . . . . . . . 3.0 p-10 -90.18 8.83 30.98 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.955 -179.854 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 369' ' ' GLN . . . . . 0.439 ' HB3' HD13 ' B' ' 372' ' ' LEU . 13.4 mm100 -91.49 84.51 5.55 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.869 179.832 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 370' ' ' GLU . . . . . . . . . . . . . 2.2 mp0 -89.92 -11.43 41.82 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.535 -0.302 . . . . 0.0 110.653 179.749 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 371' ' ' ASP . . . . . . . . . . . . . 5.3 m-20 -63.67 -46.89 83.49 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.468 179.629 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 372' ' ' LEU . . . . . 0.439 HD13 ' HB3' ' B' ' 369' ' ' GLN . 6.3 mp -68.17 -45.81 72.44 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.553 179.477 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 373' ' ' LEU . . . . . 0.547 HD21 ' HA ' ' B' ' 363' ' ' ALA . 1.1 mp -59.08 -33.58 70.98 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.739 -0.664 . . . . 0.0 111.046 -179.898 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 374' ' ' SER . . . . . . . . . . . . . 47.7 t -74.16 -57.51 3.91 Favored 'General case' 0 C--O 1.236 0.344 0 CA-C-O 120.949 0.404 . . . . 0.0 110.673 179.794 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 375' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -54.35 -32.81 57.71 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.133 179.505 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 376' ' ' PHE . . . . . 0.465 ' O ' ' HB2' ' B' ' 379' ' ' PHE . 66.9 t80 -79.6 -31.36 41.71 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.02 179.196 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 377' ' ' GLY . . . . . . . . . . . . . . . -61.71 -33.17 84.2 Favored Glycine 0 N--CA 1.448 -0.532 0 C-N-CA 120.593 -0.813 . . . . 0.0 111.236 179.12 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 378' ' ' GLN . . . . . . . . . . . . . 23.8 mt-30 -69.53 -26.73 64.66 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.753 0.311 . . . . 0.0 110.884 179.303 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 379' ' ' PHE . . . . . 0.465 ' HB2' ' O ' ' B' ' 376' ' ' PHE . 12.9 m-85 -61.67 -38.22 86.95 Favored 'General case' 0 C--N 1.333 -0.14 0 CA-C-N 116.277 -0.419 . . . . 0.0 111.298 -179.9 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 380' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -53.22 141.43 41.09 Favored Pre-proline 0 C--N 1.331 -0.213 0 CA-C-N 116.523 -0.308 . . . . 0.0 110.62 -179.966 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 381' ' ' PRO . . . . . . . . . . . . . 39.6 Cg_endo . . . . . 0 C--N 1.346 0.405 0 C-N-CA 122.404 2.069 . . . . 0.0 112.164 -179.817 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 366' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.235 0.305 0 CA-C-O 121.326 0.584 . . . . 0.0 110.355 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 367' ' ' VAL . . . . . . . . . . . . . 35.2 m -62.16 -16.59 16.32 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 115.608 -0.724 . . . . 0.0 110.414 179.376 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 368' ' ' TYR . . . . . . . . . . . . . 66.9 t80 -71.39 -56.84 5.17 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.54 179.743 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 369' ' ' VAL . . . . . 0.586 HG11 ' HB3' ' B' ' 332' ' ' LEU . 3.4 p -61.21 -44.53 98.54 Favored 'Isoleucine or valine' 0 C--O 1.232 0.147 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.455 179.533 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 370' ' ' LEU . . . . . . . . . . . . . 91.9 mt -64.0 -36.49 84.16 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.71 179.821 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 371' ' ' SER . . . . . 0.545 ' HA ' ' HB3' ' B' ' 303' ' ' GLU . 29.9 t -60.85 -61.44 2.58 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.896 179.772 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 372' ' ' SER . . . . . 0.407 ' O ' ' HG3' ' A' ' 376' ' ' GLN . 79.3 p -57.43 -33.07 67.53 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.991 -179.783 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 373' ' ' MET . . . . . . . . . . . . . 52.3 ttm -58.93 -56.96 15.5 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.365 -179.804 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 374' ' ' ALA . . . . . 0.506 ' HB3' ' OE1' ' B' ' 303' ' ' GLU . . . -84.23 -6.92 59.46 Favored 'General case' 0 C--N 1.33 -0.246 0 N-CA-C 112.016 0.376 . . . . 0.0 112.016 -179.379 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 375' ' ' ARG . . . . . . . . . . . . . 21.2 tpp180 -80.97 -40.86 23.72 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.734 0.302 . . . . 0.0 110.753 179.94 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 376' ' ' GLN . . . . . 0.407 ' HG3' ' O ' ' A' ' 372' ' ' SER . 56.6 mt-30 . . . . . 0 C--N 1.331 -0.196 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.882 179.843 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 302' ' ' VAL . . . . . 0.457 HG13 ' N ' ' B' ' 303' ' ' GLU . 4.2 p . . . . . 0 C--O 1.231 0.122 0 CA-C-O 120.84 0.352 . . . . 0.0 111.278 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 303' ' ' GLU . . . . . 0.545 ' HB3' ' HA ' ' A' ' 371' ' ' SER . 72.7 mm-40 -67.32 -40.17 85.94 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.092 -0.504 . . . . 0.0 111.815 -179.314 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 304' ' ' PHE . . . . . . . . . . . . . 83.8 m-85 -58.85 -62.06 2.16 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.416 -179.482 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 305' ' ' ASN . . . . . . . . . . . . . 47.4 t-20 -59.59 -43.14 93.78 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.845 -179.228 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 306' ' ' HIS . . . . . . . . . . . . . 7.0 t-160 -61.29 -65.4 0.7 Allowed 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 111.881 0.326 . . . . 0.0 111.881 -179.063 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 307' ' ' ALA . . . . . . . . . . . . . . . -54.23 -43.86 71.23 Favored 'General case' 0 C--N 1.33 -0.242 0 N-CA-C 112.147 0.425 . . . . 0.0 112.147 -179.036 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 308' ' ' ILE . . . . . . . . . . . . . 62.7 mt -58.87 -54.75 29.48 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-O 120.676 0.274 . . . . 0.0 111.393 -179.735 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 309' ' ' ASN . . . . . 0.535 ' N ' HD22 ' B' ' 309' ' ' ASN . 0.9 OUTLIER -58.47 -30.88 67.32 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.835 0.35 . . . . 0.0 111.041 -179.962 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 310' ' ' TYR . . . . . 0.421 ' O ' ' HG3' ' B' ' 313' ' ' LYS . 24.0 t80 -65.38 -62.3 1.61 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.83 179.967 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 311' ' ' VAL . . . . . . . . . . . . . 56.4 t -61.3 -23.37 30.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.975 179.94 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 312' ' ' ASN . . . . . . . . . . . . . 27.2 t-20 -69.45 -56.72 6.6 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.486 -179.6 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 313' ' ' LYS . . . . . 0.421 ' HG3' ' O ' ' B' ' 310' ' ' TYR . 0.0 OUTLIER -64.69 -33.45 75.97 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.362 -0.381 . . . . 0.0 111.372 -179.381 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 314' ' ' ILE . . . . . . . . . . . . . 79.3 mt -72.22 -36.92 57.49 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-O 120.755 0.312 . . . . 0.0 111.278 179.774 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 315' ' ' LYS . . . . . . . . . . . . . 25.8 ttpp -67.93 -45.76 73.38 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.37 -0.377 . . . . 0.0 111.095 -179.761 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 316' ' ' ASN . . . . . . . . . . . . . 52.1 t-20 -68.58 -48.74 63.43 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.187 -0.461 . . . . 0.0 111.317 -179.625 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 317' ' ' ARG . . . . . . . . . . . . . 49.5 ttt180 -59.48 -64.2 1.03 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.481 -179.474 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 318' ' ' PHE . . . . . . . . . . . . . 96.8 m-85 -84.38 33.08 0.5 Allowed 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.323 -179.59 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 319' ' ' GLN . . . . . . . . . . . . . 7.1 tp60 -64.87 -20.16 66.28 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.416 -0.356 . . . . 0.0 110.702 179.795 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 320' ' ' GLY . . . . . . . . . . . . . . . -85.72 -21.15 54.45 Favored Glycine 0 C--N 1.33 0.213 0 C-N-CA 120.858 -0.687 . . . . 0.0 112.626 179.936 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 321' ' ' GLN . . . . . . . . . . . . . 29.6 mm-40 -106.87 96.45 14.71 Favored Pre-proline 0 C--N 1.33 -0.261 0 CA-C-O 120.539 0.209 . . . . 0.0 110.809 179.91 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 322' ' ' PRO . . . . . . . . . . . . . 86.7 Cg_endo -78.4 -28.46 4.51 Favored 'Trans proline' 0 C--N 1.348 0.537 0 C-N-CA 122.417 2.078 . . . . 0.0 112.72 -179.817 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 323' ' ' ASP . . . . . . . . . . . . . 31.3 m-20 -65.29 -48.01 74.64 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.354 -0.384 . . . . 0.0 111.103 -179.725 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 324' ' ' ILE . . . . . . . . . . . . . 71.6 mt -66.2 -47.25 85.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.236 -179.962 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 325' ' ' TYR . . . . . 0.404 ' CE2' HD11 ' B' ' 329' ' ' LEU . 41.1 t80 -55.82 -57.73 10.8 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.982 -179.989 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 326' ' ' LYS . . . . . 0.476 ' O ' ' HG3' ' B' ' 330' ' ' GLU . 98.5 mttt -55.53 -48.85 74.04 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.046 -0.524 . . . . 0.0 111.259 -179.898 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 327' ' ' ALA . . . . . . . . . . . . . . . -49.08 -51.67 30.22 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.372 -0.377 . . . . 0.0 111.231 -179.922 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 328' ' ' PHE . . . . . . . . . . . . . 84.1 t80 -56.33 -46.03 80.07 Favored 'General case' 0 C--O 1.235 0.324 0 CA-C-N 116.191 -0.459 . . . . 0.0 109.975 179.316 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 329' ' ' LEU . . . . . 0.404 HD11 ' CE2' ' B' ' 325' ' ' TYR . 83.5 mt -58.71 -31.22 68.06 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 115.711 -0.677 . . . . 0.0 110.186 179.042 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 330' ' ' GLU . . . . . 0.476 ' HG3' ' O ' ' B' ' 326' ' ' LYS . 38.8 mt-10 -71.73 -36.05 70.36 Favored 'General case' 0 C--N 1.333 -0.13 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.679 179.65 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 331' ' ' ILE . . . . . . . . . . . . . 61.5 mt -65.48 -47.8 85.32 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.152 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.872 179.881 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 332' ' ' LEU . . . . . 0.586 ' HB3' HG11 ' A' ' 369' ' ' VAL . 14.0 mt -67.36 -37.82 83.8 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.412 -0.358 . . . . 0.0 110.899 179.97 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 333' ' ' HIS . . . . . . . . . . . . . 48.4 t-80 -61.29 -57.89 10.52 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.649 179.635 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 334' ' ' THR . . . . . 0.448 HG22 HD13 ' B' ' 353' ' ' LEU . 86.3 m -59.56 -35.17 73.73 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.915 -0.584 . . . . 0.0 111.005 179.842 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 335' ' ' TYR . . . . . . . . . . . . . 83.4 t80 -61.1 -60.35 3.9 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.902 -179.935 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 336' ' ' GLN . . . . . 0.64 ' HA ' HE21 ' B' ' 336' ' ' GLN . 0.0 OUTLIER -56.98 -33.62 67.28 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.715 -179.856 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 337' ' ' LYS . . . . . . . . . . . . . 23.9 ttmm -59.02 -54.27 48.97 Favored 'General case' 0 C--O 1.234 0.251 0 CA-C-O 120.971 0.415 . . . . 0.0 110.528 179.296 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 338' ' ' GLU . . . . . . . . . . . . . 26.2 mm-40 -60.05 -33.69 72.39 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.296 179.468 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 339' ' ' GLN . . . . . . . . . . . . . 57.7 tp60 -64.1 -43.5 95.17 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.464 179.549 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 340' ' ' ARG . . . . . . . . . . . . . 94.7 mtt180 -61.83 -53.89 49.67 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.597 179.68 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 341' ' ' ASN . . . . . . . . . . . . . 47.9 t-20 -57.6 -33.05 67.8 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.507 179.696 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 342' ' ' ALA . . . . . . . . . . . . . . . -65.91 -43.28 88.62 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.937 -0.574 . . . . 0.0 111.023 179.917 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 343' ' ' LYS . . . . . . . . . . . . . 88.2 tttt -66.93 -39.79 87.42 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.839 179.965 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 344' ' ' GLU . . . . . . . . . . . . . 12.6 mm-40 -69.54 -31.79 70.21 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.898 -179.978 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 345' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.285 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.243 -179.878 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' B' B ' 351' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_exo . . . . . 0 C--O 1.231 0.161 0 CA-C-O 120.902 0.293 . . . . 0.0 112.057 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' B' B ' 352' ' ' ALA . . . . . . . . . . . . . . . -64.32 -58.99 4.92 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.11 -0.495 . . . . 0.0 111.562 -179.485 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 353' ' ' LEU . . . . . 0.448 HD13 HG22 ' B' ' 334' ' ' THR . 6.7 mp -101.12 128.93 46.97 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.923 0.392 . . . . 0.0 111.535 -179.536 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 354' ' ' THR . . . . . . . . . . . . . 61.6 p -113.1 -173.9 2.35 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.528 179.429 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 355' ' ' GLU . . . . . . . . . . . . . 31.2 mt-10 -58.59 -35.2 72.04 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.992 0.425 . . . . 0.0 110.578 179.783 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 356' ' ' GLN . . . . . . . . . . . . . 8.6 tt0 -73.86 -37.91 64.63 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.887 -0.597 . . . . 0.0 111.01 -179.881 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 357' ' ' GLU . . . . . 0.436 ' HG2' ' HG ' ' B' ' 353' ' ' LEU . 6.9 tp10 -62.5 -45.83 91.23 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-O 120.925 0.393 . . . . 0.0 110.575 179.998 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 358' ' ' VAL . . . . . 0.52 ' O ' HG23 ' B' ' 362' ' ' VAL . 70.5 t -66.76 -58.19 7.36 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.02 -0.536 . . . . 0.0 111.114 179.933 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 359' ' ' TYR . . . . . . . . . . . . . 40.3 t80 -52.09 -32.43 34.9 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.611 -0.268 . . . . 0.0 111.087 -179.626 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 360' ' ' ALA . . . . . . . . . . . . . . . -68.91 -56.51 7.66 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.412 -0.358 . . . . 0.0 111.043 179.868 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 361' ' ' GLN . . . . . . . . . . . . . 53.4 mt-30 -57.01 -44.35 82.74 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.73 179.872 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 362' ' ' VAL . . . . . 0.52 HG23 ' O ' ' B' ' 358' ' ' VAL . 45.2 t -65.56 -32.96 60.49 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.524 179.84 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 363' ' ' ALA . . . . . 0.693 ' HA ' HD21 ' B' ' 373' ' ' LEU . . . -62.48 -51.67 66.53 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.722 179.645 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 364' ' ' ARG . . . . . . . . . . . . . 96.7 mtt180 -75.1 -18.38 60.27 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.625 179.58 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 365' ' ' LEU . . . . . . . . . . . . . 7.2 tp -59.66 -31.91 69.98 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.731 179.894 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 366' ' ' PHE . . . . . . . . . . . . . 58.4 m-85 -118.16 173.32 6.86 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.57 179.8 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 367' ' ' LYS . . . . . . . . . . . . . 47.3 mmtm -129.25 -78.16 0.55 Allowed 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.754 0.312 . . . . 0.0 111.373 -179.775 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 368' ' ' ASN . . . . . . . . . . . . . 7.5 t30 -82.95 -10.17 58.93 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.142 -179.65 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 369' ' ' GLN . . . . . . . . . . . . . 19.5 mp0 -94.2 87.59 5.31 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.411 -0.359 . . . . 0.0 111.143 -179.784 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 370' ' ' GLU . . . . . . . . . . . . . 44.0 mt-10 -94.45 -10.59 31.89 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.726 179.516 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 371' ' ' ASP . . . . . . . . . . . . . 13.8 t70 -58.48 -38.05 76.81 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.429 179.674 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 372' ' ' LEU . . . . . 0.45 ' H ' HD12 ' B' ' 372' ' ' LEU . 6.0 mp -70.12 -39.2 75.6 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.905 -0.588 . . . . 0.0 110.49 179.316 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 373' ' ' LEU . . . . . 0.693 HD21 ' HA ' ' B' ' 363' ' ' ALA . 1.4 mp -65.73 -36.27 83.12 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.582 -0.735 . . . . 0.0 111.305 -179.702 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 374' ' ' SER . . . . . . . . . . . . . 87.8 p -71.72 -51.18 24.16 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.883 0.373 . . . . 0.0 110.287 179.663 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 375' ' ' GLU . . . . . . . . . . . . . 11.1 mm-40 -58.33 -33.38 69.45 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.263 179.347 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 376' ' ' PHE . . . . . 0.436 ' HA ' ' HB2' ' B' ' 379' ' ' PHE . 64.6 t80 -80.8 -29.7 36.0 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.151 179.373 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 377' ' ' GLY . . . . . . . . . . . . . . . -62.84 -40.13 98.87 Favored Glycine 0 N--CA 1.45 -0.412 0 C-N-CA 120.715 -0.755 . . . . 0.0 111.388 179.267 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 378' ' ' GLN . . . . . . . . . . . . . 12.9 mm100 -78.04 -16.89 57.68 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.053 0.454 . . . . 0.0 110.093 179.074 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 379' ' ' PHE . . . . . 0.436 ' HB2' ' HA ' ' B' ' 376' ' ' PHE . 0.2 OUTLIER -68.31 -42.3 79.61 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.714 -0.675 . . . . 0.0 110.622 179.803 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 380' ' ' LEU . . . . . . . . . . . . . 64.0 mt -56.82 147.32 53.74 Favored Pre-proline 0 C--N 1.33 -0.247 0 CA-C-N 116.013 -0.54 . . . . 0.0 110.866 -179.932 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 381' ' ' PRO . . . . . . . . . . . . . 70.9 Cg_exo . . . . . 0 C--N 1.347 0.497 0 C-N-CA 122.68 2.253 . . . . 0.0 112.554 -179.989 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 366' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.233 0.209 0 CA-C-O 120.786 0.327 . . . . 0.0 111.418 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 367' ' ' VAL . . . . . . . . . . . . . 20.6 m -60.36 -30.29 45.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.232 179.911 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 368' ' ' TYR . . . . . . . . . . . . . 37.1 t80 -75.87 -40.54 54.35 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.991 -179.76 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 369' ' ' VAL . . . . . 0.45 HG22 ' HB2' ' B' ' 336' ' ' GLN . 20.1 t -63.31 -43.56 98.69 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.162 -179.923 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 370' ' ' LEU . . . . . . . . . . . . . 96.5 mt -71.37 -47.14 58.14 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.018 179.93 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 371' ' ' SER . . . . . 0.474 ' HA ' ' HB2' ' B' ' 303' ' ' GLU . 79.7 p -58.92 -33.0 70.07 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.219 -179.859 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 372' ' ' SER . . . . . . . . . . . . . 79.1 p -76.82 -58.01 3.52 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.417 -0.356 . . . . 0.0 111.409 -179.475 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 373' ' ' MET . . . . . . . . . . . . . 20.4 ptm -55.59 -26.81 45.84 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.382 -0.372 . . . . 0.0 111.605 -179.451 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 374' ' ' ALA . . . . . . . . . . . . . . . -87.04 -44.04 11.87 Favored 'General case' 0 C--N 1.33 -0.271 0 N-CA-C 111.692 0.256 . . . . 0.0 111.692 -179.722 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 375' ' ' ARG . . . . . 0.658 ' HB2' ' HG2' ' B' ' 303' ' ' GLU . 21.4 tpp180 -64.89 -26.67 68.42 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.83 0.348 . . . . 0.0 110.753 -179.969 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 376' ' ' GLN . . . . . . . . . . . . . 15.1 mm100 . . . . . 0 C--N 1.329 -0.288 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.045 179.852 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' B' B ' 302' ' ' VAL . . . . . 0.52 HG23 ' H ' ' B' ' 303' ' ' GLU . 8.8 m . . . . . 0 C--O 1.231 0.12 0 CA-C-O 120.794 0.33 . . . . 0.0 111.752 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 303' ' ' GLU . . . . . 0.658 ' HG2' ' HB2' ' A' ' 375' ' ' ARG . 0.0 OUTLIER -72.26 -30.92 65.31 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.266 -0.425 . . . . 0.0 111.72 -179.273 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' B' B ' 304' ' ' PHE . . . . . 0.409 ' O ' HG12 ' B' ' 308' ' ' ILE . 84.7 t80 -72.65 -51.05 21.14 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.678 0.275 . . . . 0.0 110.915 -179.663 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 305' ' ' ASN . . . . . 0.496 HD22 HD11 ' B' ' 308' ' ' ILE . 3.0 t-20 -64.46 -40.39 95.62 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.858 -179.975 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 306' ' ' HIS . . . . . . . . . . . . . 15.6 t-160 -66.8 -39.48 87.75 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.344 -0.389 . . . . 0.0 111.011 179.954 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 307' ' ' ALA . . . . . . . . . . . . . . . -67.09 -49.93 63.31 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.39 -0.368 . . . . 0.0 111.58 -179.712 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 308' ' ' ILE . . . . . 0.496 HD11 HD22 ' B' ' 305' ' ' ASN . 47.6 pt -62.38 -38.41 81.16 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.221 0 CA-C-O 120.682 0.277 . . . . 0.0 111.204 -179.681 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 309' ' ' ASN . . . . . 0.427 ' N ' HG13 ' B' ' 308' ' ' ILE . 95.9 m-20 -70.41 -32.64 70.34 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.404 -0.362 . . . . 0.0 110.605 179.681 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 310' ' ' TYR . . . . . . . . . . . . . 49.3 t80 -67.07 -51.63 52.07 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.607 179.808 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 311' ' ' VAL . . . . . . . . . . . . . 97.8 t -60.27 -43.8 94.25 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.212 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.605 179.338 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 312' ' ' ASN . . . . . . . . . . . . . 2.9 t-20 -64.37 -31.69 72.99 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.513 179.578 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 313' ' ' LYS . . . . . . . . . . . . . 20.6 tttp -65.04 -56.8 10.95 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.912 -0.586 . . . . 0.0 110.672 179.648 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 314' ' ' ILE . . . . . . . . . . . . . 30.3 mt -62.61 -28.87 45.65 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.777 -179.912 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 315' ' ' LYS . . . . . . . . . . . . . 22.1 ttmm -70.47 -36.75 74.07 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.74 179.726 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 316' ' ' ASN . . . . . . . . . . . . . 66.5 m-20 -82.23 -58.78 2.8 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.942 -0.572 . . . . 0.0 111.445 -179.8 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 317' ' ' ARG . . . . . . . . . . . . . 25.4 tpp180 -54.13 -64.4 0.84 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.096 179.988 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 318' ' ' PHE . . . . . . . . . . . . . 91.6 m-85 -86.71 42.8 1.03 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.97 179.896 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 319' ' ' GLN . . . . . . . . . . . . . 6.6 tp-100 -68.39 -22.57 64.63 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.821 179.904 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 320' ' ' GLY . . . . . . . . . . . . . . . -89.02 -15.77 58.76 Favored Glycine 0 N--CA 1.452 -0.291 0 C-N-CA 120.761 -0.733 . . . . 0.0 112.507 179.969 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 321' ' ' GLN . . . . . . . . . . . . . 2.2 mp0 -111.24 91.89 14.56 Favored Pre-proline 0 C--N 1.33 -0.267 0 CA-C-O 120.586 0.231 . . . . 0.0 110.958 -179.975 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 322' ' ' PRO . . . . . . . . . . . . . 96.7 Cg_endo -82.24 -18.28 7.37 Favored 'Trans proline' 0 C--N 1.348 0.513 0 C-N-CA 122.625 2.217 . . . . 0.0 112.392 179.875 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 323' ' ' ASP . . . . . . . . . . . . . 18.0 t70 -69.65 -50.58 42.76 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.701 -179.907 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 324' ' ' ILE . . . . . . . . . . . . . 56.3 mt -64.58 -43.86 96.76 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-N 116.081 -0.508 . . . . 0.0 110.85 179.857 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 325' ' ' TYR . . . . . 0.402 ' O ' ' HG ' ' B' ' 329' ' ' LEU . 25.8 t80 -59.61 -48.18 82.67 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.647 179.822 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 326' ' ' LYS . . . . . . . . . . . . . 60.6 tttm -60.05 -45.51 92.63 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.937 -179.972 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 327' ' ' ALA . . . . . . . . . . . . . . . -55.08 -50.47 69.08 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.123 179.944 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 328' ' ' PHE . . . . . . . . . . . . . 66.3 t80 -55.78 -49.33 73.45 Favored 'General case' 0 C--O 1.234 0.273 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.53 179.781 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 329' ' ' LEU . . . . . 0.402 ' HG ' ' O ' ' B' ' 325' ' ' TYR . 93.1 mt -56.26 -34.3 66.28 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.53 179.541 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 330' ' ' GLU . . . . . . . . . . . . . 19.4 mm-40 -69.56 -37.45 77.02 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.869 179.85 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 331' ' ' ILE . . . . . 0.513 HG22 HG22 ' B' ' 358' ' ' VAL . 71.0 mt -62.48 -48.21 89.36 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-N 116.391 -0.368 . . . . 0.0 110.433 179.358 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 332' ' ' LEU . . . . . . . . . . . . . 10.7 mp -68.53 -31.03 69.97 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.97 179.786 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 333' ' ' HIS . . . . . . . . . . . . . 40.4 t60 -63.97 -59.52 4.39 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.93 0.395 . . . . 0.0 110.231 179.532 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 334' ' ' THR . . . . . 0.416 HG22 HD13 ' B' ' 353' ' ' LEU . 94.6 m -58.03 -38.97 77.22 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.87 -0.604 . . . . 0.0 110.471 179.366 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 335' ' ' TYR . . . . . . . . . . . . . 75.2 t80 -58.14 -43.85 87.51 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.744 -0.662 . . . . 0.0 110.306 179.509 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 336' ' ' GLN . . . . . 0.45 ' HB2' HG22 ' A' ' 369' ' ' VAL . 8.1 tt0 -64.57 -42.57 95.55 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.769 -0.651 . . . . 0.0 110.802 179.974 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 337' ' ' LYS . . . . . . . . . . . . . 28.2 ttpp -58.3 -41.38 84.35 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.734 179.82 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 338' ' ' GLU . . . . . . . . . . . . . 24.9 mm-40 -66.13 -42.23 89.43 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.884 179.661 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 339' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -59.97 -49.29 78.24 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.13 -0.487 . . . . 0.0 110.593 179.668 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 340' ' ' ARG . . . . . . . . . . . . . 99.6 mtt180 -57.0 -53.82 53.7 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.896 179.867 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 341' ' ' ASN . . . . . . . . . . . . . 14.6 m120 -53.63 -38.47 64.1 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.936 179.923 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 342' ' ' ALA . . . . . . . . . . . . . . . -68.41 -32.95 73.36 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.92 179.875 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 343' ' ' LYS . . . . . . . . . . . . . 61.2 tttp -68.94 -49.23 59.85 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.092 -0.504 . . . . 0.0 111.006 179.822 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 344' ' ' GLU . . . . . . . . . . . . . 14.8 mm-40 -65.15 -36.03 82.97 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.236 -179.817 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 345' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.31 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.253 -179.965 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' B' B ' 351' ' ' PRO . . . . . . . . . . . . . 46.2 Cg_exo . . . . . 0 C--O 1.231 0.147 0 CA-C-O 120.77 0.237 . . . . 0.0 112.126 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' B' B ' 352' ' ' ALA . . . . . . . . . . . . . . . -98.41 -69.44 0.76 Allowed 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.378 -0.374 . . . . 0.0 111.458 -179.858 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 353' ' ' LEU . . . . . 0.446 ' HG ' ' HG2' ' B' ' 357' ' ' GLU . 6.2 mp -87.62 119.68 28.16 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.308 -0.405 . . . . 0.0 111.205 -179.777 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 354' ' ' THR . . . . . . . . . . . . . 81.7 p -107.42 -175.16 2.71 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.978 -0.556 . . . . 0.0 110.368 179.342 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 355' ' ' GLU . . . . . . . . . . . . . 39.9 mt-10 -54.36 -35.93 63.29 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.056 0.455 . . . . 0.0 110.484 179.718 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 356' ' ' GLN . . . . . . . . . . . . . 22.6 mt-30 -72.93 -41.22 64.75 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.928 -179.998 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 357' ' ' GLU . . . . . 0.446 ' HG2' ' HG ' ' B' ' 353' ' ' LEU . 5.3 tp10 -57.52 -50.72 72.14 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.933 0.397 . . . . 0.0 110.58 -179.914 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 358' ' ' VAL . . . . . 0.559 ' O ' HG23 ' B' ' 362' ' ' VAL . 55.0 t -64.33 -58.88 5.38 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 115.982 -0.554 . . . . 0.0 111.013 179.887 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 359' ' ' TYR . . . . . . . . . . . . . 39.0 t80 -51.14 -27.16 7.87 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.491 -0.322 . . . . 0.0 111.279 -179.452 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 360' ' ' ALA . . . . . . . . . . . . . . . -74.09 -54.21 8.31 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.77 0.319 . . . . 0.0 110.838 179.59 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 361' ' ' GLN . . . . . . . . . . . . . 77.2 mt-30 -60.54 -36.01 77.39 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.527 179.705 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 362' ' ' VAL . . . . . 0.559 HG23 ' O ' ' B' ' 358' ' ' VAL . 51.2 t -70.02 -40.31 78.38 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.214 0 CA-C-N 116.013 -0.54 . . . . 0.0 110.347 179.538 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 363' ' ' ALA . . . . . 0.606 ' HA ' HD21 ' B' ' 373' ' ' LEU . . . -61.82 -38.09 86.86 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.346 179.414 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 364' ' ' ARG . . . . . . . . . . . . . 38.3 ttm180 -80.08 -23.84 41.02 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.783 -0.644 . . . . 0.0 110.146 179.317 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 365' ' ' LEU . . . . . . . . . . . . . 2.5 tp -60.64 -29.03 69.0 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.487 179.627 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 366' ' ' PHE . . . . . . . . . . . . . 25.0 m-85 -125.55 -177.98 4.09 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.38 179.747 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 367' ' ' LYS . . . . . . . . . . . . . 68.4 mttm -137.4 -82.87 0.34 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.399 -0.364 . . . . 0.0 111.164 179.919 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 368' ' ' ASN . . . . . . . . . . . . . 27.6 p-10 -82.65 1.03 40.39 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.802 0.334 . . . . 0.0 110.918 179.995 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 369' ' ' GLN . . . . . 0.409 ' HB3' HD13 ' B' ' 372' ' ' LEU . 21.2 mp0 -98.32 58.14 1.26 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.6 179.842 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 370' ' ' GLU . . . . . . . . . . . . . 41.2 mt-10 -69.78 -13.0 62.06 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.852 -179.928 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 371' ' ' ASP . . . . . . . . . . . . . 11.6 m-20 -55.58 -39.69 71.03 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.459 179.809 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 372' ' ' LEU . . . . . 0.421 ' H ' HD12 ' B' ' 372' ' ' LEU . 6.2 mp -69.97 -37.99 75.95 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.567 179.649 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 373' ' ' LEU . . . . . 0.606 HD21 ' HA ' ' B' ' 363' ' ' ALA . 2.7 mp -62.19 -34.65 76.85 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.844 179.828 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 374' ' ' SER . . . . . . . . . . . . . 51.0 m -73.44 -55.66 6.07 Favored 'General case' 0 C--O 1.234 0.28 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.261 179.335 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 375' ' ' GLU . . . . . . . . . . . . . 43.0 mt-10 -54.91 -33.25 61.89 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-N 115.934 -0.576 . . . . 0.0 110.26 179.357 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 376' ' ' PHE . . . . . 0.429 ' O ' ' HB2' ' B' ' 379' ' ' PHE . 87.3 t80 -82.27 -30.21 30.77 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.025 179.333 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 377' ' ' GLY . . . . . . . . . . . . . . . -61.93 -33.51 85.74 Favored Glycine 0 N--CA 1.448 -0.564 0 C-N-CA 120.474 -0.87 . . . . 0.0 111.207 179.114 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 378' ' ' GLN . . . . . . . . . . . . . 98.1 mt-30 -69.75 -29.25 66.56 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.798 0.332 . . . . 0.0 110.56 179.155 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 379' ' ' PHE . . . . . 0.429 ' HB2' ' O ' ' B' ' 376' ' ' PHE . 10.2 m-85 -61.15 -40.35 93.51 Favored 'General case' 0 C--N 1.333 -0.123 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.639 179.541 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 380' ' ' LEU . . . . . . . . . . . . . 95.3 mt -58.19 136.26 84.65 Favored Pre-proline 0 C--N 1.33 -0.265 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.526 179.848 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 381' ' ' PRO . . . . . . . . . . . . . 51.5 Cg_exo . . . . . 0 C--N 1.348 0.508 0 C-N-CA 122.377 2.051 . . . . 0.0 112.251 -179.574 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 366' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.232 0.152 0 CA-C-O 120.871 0.367 . . . . 0.0 111.353 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 367' ' ' VAL . . . . . . . . . . . . . 28.0 m -68.3 -29.51 44.54 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.354 -179.925 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 368' ' ' TYR . . . . . . . . . . . . . 71.3 t80 -72.1 -47.65 49.7 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.47 -0.332 . . . . 0.0 111.252 -179.749 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 369' ' ' VAL . . . . . 0.413 ' O ' ' HB2' ' A' ' 373' ' ' MET . 13.3 m -64.58 -48.37 85.13 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.487 -0.324 . . . . 0.0 111.273 -179.846 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 370' ' ' LEU . . . . . 0.583 HD23 ' HA ' ' B' ' 307' ' ' ALA . 8.3 mp -62.97 -42.92 99.97 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.645 -0.252 . . . . 0.0 111.362 179.997 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 371' ' ' SER . . . . . 0.424 ' O ' ' HB2' ' A' ' 375' ' ' ARG . 88.7 p -57.46 -60.3 3.86 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.481 -0.327 . . . . 0.0 110.942 179.957 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 372' ' ' SER . . . . . . . . . . . . . 44.1 t -62.96 -24.2 67.77 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.31 -0.405 . . . . 0.0 111.15 -179.783 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 373' ' ' MET . . . . . 0.413 ' HB2' ' O ' ' A' ' 369' ' ' VAL . 50.6 tpp -65.11 -49.16 71.06 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.797 0.332 . . . . 0.0 111.196 -179.939 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 374' ' ' ALA . . . . . . . . . . . . . . . -85.32 -17.37 37.03 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.818 -179.391 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 375' ' ' ARG . . . . . 0.424 ' HB2' ' O ' ' A' ' 371' ' ' SER . 0.0 OUTLIER -88.3 -22.21 24.01 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.712 0.291 . . . . 0.0 111.083 -179.68 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 376' ' ' GLN . . . . . . . . . . . . . 57.6 tp60 . . . . . 0 C--N 1.331 -0.198 0 CA-C-N 116.429 -0.35 . . . . 0.0 110.749 -179.937 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' B' B ' 302' ' ' VAL . . . . . 0.554 ' HA ' HD21 ' B' ' 305' ' ' ASN . 7.7 p . . . . . 0 C--O 1.234 0.265 0 CA-C-O 120.976 0.417 . . . . 0.0 111.03 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 303' ' ' GLU . . . . . 0.447 ' N ' HG13 ' B' ' 302' ' ' VAL . 29.1 mt-10 -58.15 -33.83 69.63 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.888 -179.958 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 304' ' ' PHE . . . . . . . . . . . . . 76.5 t80 -58.05 -76.94 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.895 -0.593 . . . . 0.0 111.225 -179.612 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 305' ' ' ASN . . . . . 0.554 HD21 ' HA ' ' B' ' 302' ' ' VAL . 9.5 p30 -49.36 -38.8 29.55 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.757 -179.507 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 306' ' ' HIS . . . . . . . . . . . . . 2.0 m-70 -59.24 -74.63 0.07 Allowed 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 112.301 0.482 . . . . 0.0 112.301 -179.391 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 307' ' ' ALA . . . . . 0.583 ' HA ' HD23 ' A' ' 370' ' ' LEU . . . -56.48 -44.75 80.93 Favored 'General case' 0 C--N 1.33 -0.26 0 N-CA-C 112.455 0.539 . . . . 0.0 112.455 -178.542 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 308' ' ' ILE . . . . . . . . . . . . . 46.4 mm -58.11 -64.24 0.57 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 N-CA-C 111.737 0.273 . . . . 0.0 111.737 -179.51 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 309' ' ' ASN . . . . . . . . . . . . . 49.9 t30 -50.77 -37.29 41.32 Favored 'General case' 0 N--CA 1.463 0.196 0 CA-C-O 120.735 0.303 . . . . 0.0 110.972 -179.692 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 310' ' ' TYR . . . . . 0.532 ' O ' HG12 ' B' ' 314' ' ' ILE . 90.9 t80 -58.32 -65.92 0.57 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.731 179.705 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 311' ' ' VAL . . . . . . . . . . . . . 59.6 t -51.23 -29.39 8.57 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.378 -0.374 . . . . 0.0 111.163 -179.759 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 312' ' ' ASN . . . . . . . . . . . . . 27.0 t-20 -65.04 -57.09 9.56 Favored 'General case' 0 C--O 1.234 0.262 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.596 -179.832 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 313' ' ' LYS . . . . . 0.434 ' HG3' ' O ' ' B' ' 310' ' ' TYR . 0.1 OUTLIER -65.62 -28.95 69.49 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 120.587 0.232 . . . . 0.0 111.623 -179.371 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 314' ' ' ILE . . . . . 0.532 HG12 ' O ' ' B' ' 310' ' ' TYR . 20.3 mm -67.7 -44.98 85.57 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-O 120.879 0.371 . . . . 0.0 110.841 179.791 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 315' ' ' LYS . . . . . 0.434 ' HE3' ' HB3' ' B' ' 315' ' ' LYS . 1.2 tmmt? -67.34 -42.37 83.66 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.897 -179.988 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 316' ' ' ASN . . . . . . . . . . . . . 6.0 t30 -61.14 -54.39 45.1 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.398 -0.364 . . . . 0.0 111.326 -179.73 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 317' ' ' ARG . . . . . . . . . . . . . 27.9 mmm180 -59.68 -24.33 63.84 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.831 0.348 . . . . 0.0 111.123 -179.875 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 318' ' ' PHE . . . . . . . . . . . . . 34.9 m-85 -114.46 36.76 3.63 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.809 179.837 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 319' ' ' GLN . . . . . . . . . . . . . 32.1 tt0 -64.84 -18.15 64.89 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.903 -0.589 . . . . 0.0 110.893 -179.996 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 320' ' ' GLY . . . . . . . . . . . . . . . -115.64 27.03 8.6 Favored Glycine 0 N--CA 1.452 -0.269 0 C-N-CA 120.851 -0.69 . . . . 0.0 112.591 -179.956 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 321' ' ' GLN . . . . . 0.571 ' HA ' HE21 ' B' ' 321' ' ' GLN . 0.1 OUTLIER -148.74 89.32 5.03 Favored Pre-proline 0 C--N 1.329 -0.302 0 CA-C-O 120.517 0.199 . . . . 0.0 110.717 179.946 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 322' ' ' PRO . . . . . . . . . . . . . 87.8 Cg_endo -81.27 -22.04 6.09 Favored 'Trans proline' 0 C--N 1.347 0.459 0 C-N-CA 122.608 2.205 . . . . 0.0 112.827 -179.764 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 323' ' ' ASP . . . . . 0.4 ' OD2' HG13 ' B' ' 324' ' ' ILE . 6.4 p-10 -68.37 -53.92 20.75 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.495 -0.321 . . . . 0.0 111.219 -179.667 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 324' ' ' ILE . . . . . 0.419 HD12 ' HG2' ' B' ' 321' ' ' GLN . 56.1 mt -64.89 -44.41 96.22 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-O 120.786 0.326 . . . . 0.0 111.007 179.958 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 325' ' ' TYR . . . . . . . . . . . . . 37.3 t80 -58.72 -43.39 90.14 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.599 179.89 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 326' ' ' LYS . . . . . . . . . . . . . 63.3 tttm -62.85 -43.82 97.76 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.449 179.54 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 327' ' ' ALA . . . . . . . . . . . . . . . -55.9 -44.27 78.05 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.78 179.547 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 328' ' ' PHE . . . . . . . . . . . . . 71.5 t80 -60.67 -50.63 72.72 Favored 'General case' 0 C--O 1.233 0.223 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.484 179.732 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 329' ' ' LEU . . . . . . . . . . . . . 95.6 mt -58.3 -28.85 65.38 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 115.816 -0.629 . . . . 0.0 110.863 179.662 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 330' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 -73.07 -41.23 64.33 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.894 179.845 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 331' ' ' ILE . . . . . 0.427 HG22 HG22 ' B' ' 358' ' ' VAL . 78.8 mt -62.01 -44.51 99.05 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.199 0 CA-C-O 120.852 0.358 . . . . 0.0 110.357 179.227 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 332' ' ' LEU . . . . . . . . . . . . . 9.6 mp -69.37 -34.98 75.36 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.619 179.603 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 333' ' ' HIS . . . . . . . . . . . . . 49.4 t-80 -62.59 -53.87 48.12 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.297 179.428 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 334' ' ' THR . . . . . . . . . . . . . 86.0 m -59.87 -38.94 83.59 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.306 179.303 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 335' ' ' TYR . . . . . . . . . . . . . 55.6 t80 -62.04 -37.83 86.42 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.211 179.396 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 336' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -64.85 -47.98 75.95 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 115.76 -0.654 . . . . 0.0 110.372 179.806 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 337' ' ' LYS . . . . . . . . . . . . . 39.5 ttpt -55.17 -48.11 74.22 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.66 179.575 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 338' ' ' GLU . . . . . 0.42 ' HB3' ' HB3' ' B' ' 351' ' ' PRO . 13.6 mm-40 -60.37 -40.36 90.55 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.71 179.685 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 339' ' ' GLN . . . . . . . . . . . . . 8.6 tp-100 -58.27 -44.9 88.63 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.741 179.883 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 340' ' ' ARG . . . . . . . . . . . . . 59.1 mtp180 -62.02 -53.28 57.77 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.433 179.755 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 341' ' ' ASN . . . . . . . . . . . . . 86.6 m-20 -53.37 -31.87 46.67 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.846 -0.616 . . . . 0.0 110.577 179.341 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 342' ' ' ALA . . . . . . . . . . . . . . . -74.28 -43.15 58.06 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.97 -0.559 . . . . 0.0 111.13 179.932 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 343' ' ' LYS . . . . . . . . . . . . . 64.0 tttm -75.6 -11.8 60.09 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.709 -179.966 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 344' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -92.41 -40.48 10.85 Favored 'General case' 0 N--CA 1.453 -0.298 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.478 179.786 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 345' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.331 -0.222 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.985 179.926 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' B' B ' 351' ' ' PRO . . . . . 0.42 ' HB3' ' HB3' ' B' ' 338' ' ' GLU . 47.0 Cg_exo . . . . . 0 C--O 1.232 0.214 0 CA-C-O 120.798 0.249 . . . . 0.0 112.43 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 352' ' ' ALA . . . . . . . . . . . . . . . -83.08 -63.15 1.42 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.041 179.868 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 353' ' ' LEU . . . . . 0.416 ' HG ' ' HG2' ' B' ' 357' ' ' GLU . 6.3 mp -88.12 116.51 26.36 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.137 -179.99 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 354' ' ' THR . . . . . . . . . . . . . 61.3 p -111.25 -166.06 1.04 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.269 179.397 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 355' ' ' GLU . . . . . . . . . . . . . 8.1 pt-20 -56.8 -42.29 79.27 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.912 0.387 . . . . 0.0 110.638 179.616 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 356' ' ' GLN . . . . . . . . . . . . . 15.0 mm100 -68.07 -42.6 80.2 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.875 -0.602 . . . . 0.0 111.42 -179.888 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 357' ' ' GLU . . . . . 0.416 ' HG2' ' HG ' ' B' ' 353' ' ' LEU . 5.0 tp10 -60.31 -51.45 69.49 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.515 -0.311 . . . . 0.0 111.082 -179.584 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 358' ' ' VAL . . . . . 0.433 ' O ' HG23 ' B' ' 362' ' ' VAL . 4.4 t -60.41 -59.84 3.5 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.352 -0.386 . . . . 0.0 111.24 179.941 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 359' ' ' TYR . . . . . . . . . . . . . 4.4 t80 -51.97 -31.65 30.09 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.616 -0.266 . . . . 0.0 111.05 -179.285 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 360' ' ' ALA . . . . . . . . . . . . . . . -67.99 -59.71 3.06 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.527 -0.306 . . . . 0.0 110.954 179.659 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 361' ' ' GLN . . . . . . . . . . . . . 14.7 mm100 -53.43 -40.49 65.2 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.264 -0.426 . . . . 0.0 110.722 179.7 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 362' ' ' VAL . . . . . 0.433 HG23 ' O ' ' B' ' 358' ' ' VAL . 60.2 t -68.81 -37.03 76.88 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.366 179.502 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 363' ' ' ALA . . . . . 0.55 ' HA ' HD11 ' B' ' 373' ' ' LEU . . . -60.54 -35.72 76.69 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 121.042 0.449 . . . . 0.0 110.003 179.136 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 364' ' ' ARG . . . . . . . . . . . . . 77.3 ttt180 -86.16 -20.02 29.24 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.673 -0.694 . . . . 0.0 109.799 179.048 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 365' ' ' LEU . . . . . . . . . . . . . 24.8 tp -65.6 -42.33 91.75 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 115.594 -0.73 . . . . 0.0 110.393 179.497 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 366' ' ' PHE . . . . . . . . . . . . . 25.4 m-85 -112.83 144.5 42.27 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.289 179.358 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 367' ' ' LYS . . . . . . . . . . . . . 37.4 mtmm -120.76 -79.73 0.61 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.691 0.281 . . . . 0.0 111.358 -179.754 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 368' ' ' ASN . . . . . . . . . . . . . 33.6 m-80 -70.99 -14.83 62.49 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.341 -0.39 . . . . 0.0 110.938 -179.842 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 369' ' ' GLN . . . . . 0.401 HE21 ' HB2' ' B' ' 369' ' ' GLN . 17.4 mt-30 -107.7 94.03 4.86 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.0 179.932 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 370' ' ' GLU . . . . . . . . . . . . . 45.1 mt-10 -93.56 -5.06 49.79 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.996 -179.982 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 371' ' ' ASP . . . . . . . . . . . . . 8.9 m-20 -47.29 -63.78 0.95 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.322 -179.856 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 372' ' ' LEU . . . . . 0.734 HD22 ' H ' ' B' ' 372' ' ' LEU . 0.0 OUTLIER -58.6 -33.34 69.88 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.37 -0.377 . . . . 0.0 111.172 -179.906 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 373' ' ' LEU . . . . . 0.55 HD11 ' HA ' ' B' ' 363' ' ' ALA . 5.4 tp -58.54 -52.93 63.59 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.112 -0.494 . . . . 0.0 111.236 -179.399 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 374' ' ' SER . . . . . . . . . . . . . 46.7 t -64.95 -46.21 82.54 Favored 'General case' 0 C--O 1.233 0.23 0 CA-C-O 120.942 0.401 . . . . 0.0 110.536 179.788 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 375' ' ' GLU . . . . . . . . . . . . . 10.5 tp10 -54.36 -35.11 62.43 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.792 -0.64 . . . . 0.0 110.441 179.647 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 376' ' ' PHE . . . . . . . . . . . . . 85.9 t80 -78.31 -32.77 49.46 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.089 179.49 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 377' ' ' GLY . . . . . . . . . . . . . . . -60.99 -36.0 91.57 Favored Glycine 0 N--CA 1.449 -0.481 0 C-N-CA 120.805 -0.712 . . . . 0.0 111.977 179.581 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 378' ' ' GLN . . . . . . . . . . . . . 88.5 mt-30 -55.49 -28.33 53.96 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-O 120.826 0.346 . . . . 0.0 110.67 179.497 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 379' ' ' PHE . . . . . 0.405 ' HB3' ' H ' ' B' ' 380' ' ' LEU . 67.0 m-85 -72.69 -146.2 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.399 179.39 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 380' ' ' LEU . . . . . 0.405 ' H ' ' HB3' ' B' ' 379' ' ' PHE . 40.4 mt 67.13 143.18 0.08 OUTLIER Pre-proline 0 N--CA 1.462 0.173 0 CA-C-N 116.492 -0.322 . . . . 0.0 110.871 -179.874 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 381' ' ' PRO . . . . . . . . . . . . . 52.2 Cg_exo . . . . . 0 C--N 1.347 0.456 0 C-N-CA 122.563 2.176 . . . . 0.0 112.398 -179.988 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 366' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.237 0.418 0 CA-C-O 121.229 0.538 . . . . 0.0 110.333 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 367' ' ' VAL . . . . . . . . . . . . . 32.7 m -59.66 -29.05 41.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 115.441 -0.799 . . . . 0.0 110.52 179.533 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 368' ' ' TYR . . . . . . . . . . . . . 91.6 t80 -62.43 -42.27 99.33 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.35 179.452 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 369' ' ' VAL . . . . . . . . . . . . . 18.6 t -68.29 -52.76 34.25 Favored 'Isoleucine or valine' 0 C--O 1.234 0.285 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.635 179.641 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 370' ' ' LEU . . . . . . . . . . . . . 97.0 mt -57.16 -36.07 70.31 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.995 179.923 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 371' ' ' SER . . . . . . . . . . . . . 67.7 m -69.49 -41.69 75.8 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.587 179.773 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 372' ' ' SER . . . . . . . . . . . . . 64.4 m -61.31 -35.14 76.54 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.642 179.746 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 373' ' ' MET . . . . . . . . . . . . . 65.4 mtt -70.44 -48.54 55.5 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.313 179.728 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 374' ' ' ALA . . . . . . . . . . . . . . . -72.92 -19.2 61.31 Favored 'General case' 0 C--N 1.331 -0.239 0 N-CA-C 112.054 0.39 . . . . 0.0 112.054 -179.283 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 375' ' ' ARG . . . . . . . . . . . . . 28.9 mmt180 -90.84 -32.67 15.97 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 111.582 0.216 . . . . 0.0 111.582 -179.584 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 376' ' ' GLN . . . . . . . . . . . . . 6.3 tp-100 . . . . . 0 C--N 1.329 -0.304 0 CA-C-O 120.677 0.275 . . . . 0.0 110.814 -179.996 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' B' B ' 302' ' ' VAL . . . . . . . . . . . . . 35.9 m . . . . . 0 C--O 1.232 0.151 0 CA-C-O 120.771 0.32 . . . . 0.0 111.093 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' B' B ' 303' ' ' GLU . . . . . . . . . . . . . 46.5 mt-10 -58.04 -83.25 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.0 -0.545 . . . . 0.0 111.422 -179.724 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 304' ' ' PHE . . . . . . . . . . . . . 99.6 m-85 -59.97 -30.46 69.13 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.339 -179.583 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 305' ' ' ASN . . . . . . . . . . . . . 27.3 t-20 -58.21 -69.69 0.17 Allowed 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.402 -0.363 . . . . 0.0 111.45 -179.599 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 306' ' ' HIS . . . . . . . . . . . . . 20.5 m-70 -62.57 -47.16 85.04 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.123 -0.489 . . . . 0.0 112.147 -179.152 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 307' ' ' ALA . . . . . . . . . . . . . . . -56.61 -62.45 1.72 Allowed 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 112.361 0.504 . . . . 0.0 112.361 -178.921 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 308' ' ' ILE . . . . . . . . . . . . . 85.1 mt -56.56 -49.41 77.75 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.247 0 N-CA-C 111.644 0.239 . . . . 0.0 111.644 -179.335 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 309' ' ' ASN . . . . . . . . . . . . . 36.7 t30 -54.21 -42.73 70.12 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.885 0.374 . . . . 0.0 111.011 -179.82 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 310' ' ' TYR . . . . . 0.483 ' O ' HG12 ' B' ' 314' ' ' ILE . 84.5 t80 -61.94 -62.78 1.54 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.949 -179.808 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 311' ' ' VAL . . . . . . . . . . . . . 43.6 t -54.24 -25.61 13.81 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-O 120.859 0.361 . . . . 0.0 110.978 -179.833 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 312' ' ' ASN . . . . . . . . . . . . . 2.8 t-20 -67.9 -56.71 8.03 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.026 -179.924 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 313' ' ' LYS . . . . . 0.449 ' HD3' ' N ' ' B' ' 314' ' ' ILE . 0.1 OUTLIER -65.32 -30.53 71.38 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.519 -0.309 . . . . 0.0 111.514 -179.592 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' B' B ' 314' ' ' ILE . . . . . 0.483 HG12 ' O ' ' B' ' 310' ' ' TYR . 25.9 mm -70.06 -40.55 78.55 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.197 0 CA-C-O 120.945 0.402 . . . . 0.0 110.744 179.578 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 315' ' ' LYS . . . . . . . . . . . . . 4.3 ttmp? -66.92 -42.42 85.4 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.936 -0.574 . . . . 0.0 110.911 -179.899 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 316' ' ' ASN . . . . . . . . . . . . . 27.6 t-20 -64.19 -52.61 58.05 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.333 -179.713 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 317' ' ' ARG . . . . . 0.441 ' HA ' ' NE ' ' B' ' 317' ' ' ARG . 4.7 mmp_? -59.38 -60.75 3.36 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.904 0.383 . . . . 0.0 111.197 -179.873 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 318' ' ' PHE . . . . . . . . . . . . . 65.4 m-85 -85.23 38.14 0.71 Allowed 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.093 -0.503 . . . . 0.0 111.379 -179.559 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 319' ' ' GLN . . . . . . . . . . . . . 22.6 tt0 -65.28 -26.17 67.96 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.706 179.863 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 320' ' ' GLY . . . . . . . . . . . . . . . -96.9 -5.43 58.49 Favored Glycine 0 N--CA 1.451 -0.301 0 C-N-CA 120.804 -0.712 . . . . 0.0 112.624 -179.845 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 321' ' ' GLN . . . . . . . . . . . . . 27.8 mm-40 -108.33 94.04 12.65 Favored Pre-proline 0 C--N 1.329 -0.298 0 CA-C-O 120.45 0.167 . . . . 0.0 110.945 -179.962 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 322' ' ' PRO . . . . . . . . . . . . . 97.1 Cg_endo -79.69 -33.78 1.16 Allowed 'Trans proline' 0 C--N 1.348 0.531 0 C-N-CA 122.459 2.106 . . . . 0.0 112.458 -179.911 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 323' ' ' ASP . . . . . . . . . . . . . 20.8 m-20 -63.86 -51.7 63.44 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.146 -179.682 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 324' ' ' ILE . . . . . . . . . . . . . 57.1 mt -65.12 -46.24 91.73 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.424 -179.696 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 325' ' ' TYR . . . . . 0.422 ' O ' HD23 ' B' ' 329' ' ' LEU . 35.0 t80 -57.57 -58.43 8.34 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.996 -179.624 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 326' ' ' LYS . . . . . . . . . . . . . 14.2 mptt -54.03 -44.73 71.23 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.017 179.916 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 327' ' ' ALA . . . . . . . . . . . . . . . -53.59 -45.64 70.09 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 121.055 0.455 . . . . 0.0 110.916 179.802 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 328' ' ' PHE . . . . . . . . . . . . . 54.9 t80 -60.54 -54.92 39.7 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.857 -0.611 . . . . 0.0 110.822 179.961 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 329' ' ' LEU . . . . . 0.422 HD23 ' O ' ' B' ' 325' ' ' TYR . 4.0 mm? -59.76 -25.63 65.03 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.652 179.815 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 330' ' ' GLU . . . . . . . . . . . . . 10.2 mm-40 -69.76 -41.97 74.48 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.39 -0.368 . . . . 0.0 110.037 179.107 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 331' ' ' ILE . . . . . . . . . . . . . 84.8 mt -63.88 -42.41 95.71 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.038 178.814 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 332' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -64.48 -44.42 91.09 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.655 -0.702 . . . . 0.0 110.671 179.532 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 333' ' ' HIS . . . . . . . . . . . . . 54.1 t-80 -61.95 -56.27 20.9 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.777 -179.99 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 334' ' ' THR . . . . . 0.415 HG22 HD13 ' B' ' 353' ' ' LEU . 70.9 m -54.16 -37.51 64.52 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.338 179.486 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 335' ' ' TYR . . . . . . . . . . . . . 60.7 t80 -63.27 -38.56 91.66 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.069 179.299 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 336' ' ' GLN . . . . . . . . . . . . . 23.8 tt0 -64.68 -43.83 92.27 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.729 179.454 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 337' ' ' LYS . . . . . . . . . . . . . 26.9 ttpp -59.16 -52.24 66.57 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.821 -179.849 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 338' ' ' GLU . . . . . . . . . . . . . 35.5 mm-40 -58.29 -42.84 87.48 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.797 179.706 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 339' ' ' GLN . . . . . . . . . . . . . 8.7 tt0 -59.36 -41.1 88.46 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.755 -179.963 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 340' ' ' ARG . . . . . . . . . . . . . 99.1 mtt180 -62.41 -52.03 65.2 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.753 179.772 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 341' ' ' ASN . . . . . . . . . . . . . 18.9 m120 -60.96 -27.2 68.09 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.872 179.881 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 342' ' ' ALA . . . . . . . . . . . . . . . -73.8 -42.22 61.26 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.21 179.973 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 343' ' ' LYS . . . . . . . . . . . . . 98.6 mttt -76.61 -24.66 53.41 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.99 -179.95 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 344' ' ' GLU . . . . . . . . . . . . . 15.6 mm-40 -82.43 -34.01 28.35 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.264 -0.426 . . . . 0.0 110.861 179.814 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 345' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.295 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.066 179.911 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' B' B ' 351' ' ' PRO . . . . . . . . . . . . . 51.8 Cg_exo . . . . . 0 C--O 1.231 0.138 0 CA-C-O 120.88 0.283 . . . . 0.0 112.288 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' B' B ' 352' ' ' ALA . . . . . . . . . . . . . . . -62.75 -57.27 11.52 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.066 -0.516 . . . . 0.0 111.401 -179.739 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 353' ' ' LEU . . . . . 0.46 ' HG ' ' HG2' ' B' ' 357' ' ' GLU . 5.9 mp -101.33 121.97 42.86 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 120.924 0.392 . . . . 0.0 111.375 -179.846 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 354' ' ' THR . . . . . . . . . . . . . 79.9 p -112.35 -170.76 1.72 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.389 179.158 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 355' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -57.57 -37.45 73.17 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.997 0.427 . . . . 0.0 110.28 179.654 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 356' ' ' GLN . . . . . . . . . . . . . 93.5 mt-30 -71.21 -40.71 70.96 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.807 -0.633 . . . . 0.0 111.029 -179.857 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 357' ' ' GLU . . . . . 0.46 ' HG2' ' HG ' ' B' ' 353' ' ' LEU . 6.6 tp10 -59.34 -52.74 64.32 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 116.345 -0.389 . . . . 0.0 110.908 -179.62 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 358' ' ' VAL . . . . . 0.51 ' O ' HG23 ' B' ' 362' ' ' VAL . 76.3 t -61.51 -54.66 31.87 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.942 179.842 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 359' ' ' TYR . . . . . . . . . . . . . 38.4 t80 -54.57 -28.66 47.59 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.689 0.281 . . . . 0.0 111.196 -179.444 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 360' ' ' ALA . . . . . . . . . . . . . . . -72.09 -60.66 2.12 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.867 0.365 . . . . 0.0 110.981 179.768 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 361' ' ' GLN . . . . . . . . . . . . . 24.2 mm-40 -55.0 -40.33 69.99 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.593 179.788 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 362' ' ' VAL . . . . . 0.51 HG23 ' O ' ' B' ' 358' ' ' VAL . 90.5 t -66.25 -39.87 85.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.304 179.338 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 363' ' ' ALA . . . . . 0.561 ' HA ' HD21 ' B' ' 373' ' ' LEU . . . -58.98 -36.93 75.7 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.139 179.227 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 364' ' ' ARG . . . . . . . . . . . . . 98.2 mtt180 -80.74 -25.29 38.13 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.729 -0.669 . . . . 0.0 110.41 179.387 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 365' ' ' LEU . . . . . . . . . . . . . 14.6 tp -61.14 -29.67 69.93 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.456 179.843 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 366' ' ' PHE . . . . . . . . . . . . . 43.9 m-85 -120.09 -170.2 1.92 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.855 -0.611 . . . . 0.0 110.164 179.545 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 367' ' ' LYS . . . . . . . . . . . . . 61.0 tttp -158.32 -84.24 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.663 0.268 . . . . 0.0 111.38 179.944 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 368' ' ' ASN . . . . . . . . . . . . . 80.6 m-20 -70.0 -7.87 44.41 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.378 -0.373 . . . . 0.0 110.948 -179.83 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 369' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -110.57 86.83 2.39 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.888 179.999 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 370' ' ' GLU . . . . . . . . . . . . . 42.8 mt-10 -91.36 -12.55 34.57 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.396 -0.365 . . . . 0.0 110.553 179.837 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 371' ' ' ASP . . . . . . . . . . . . . 19.2 t70 -55.1 -34.11 63.4 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 116.158 -0.473 . . . . 0.0 110.155 179.476 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 372' ' ' LEU . . . . . 0.465 ' N ' HD12 ' B' ' 372' ' ' LEU . 6.0 mp -69.97 -38.16 76.0 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.662 -0.699 . . . . 0.0 110.211 179.15 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 373' ' ' LEU . . . . . 0.561 HD21 ' HA ' ' B' ' 363' ' ' ALA . 1.7 mp -63.26 -37.31 86.75 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.733 -0.667 . . . . 0.0 110.783 179.793 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 374' ' ' SER . . . . . . . . . . . . . 61.6 m -72.67 -57.14 4.35 Favored 'General case' 0 C--O 1.235 0.339 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.462 179.532 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 375' ' ' GLU . . . . . . . . . . . . . 17.2 mm-40 -52.56 -40.58 62.72 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.565 179.503 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 376' ' ' PHE . . . . . . . . . . . . . 81.5 t80 -72.8 -34.47 66.92 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.13 -0.487 . . . . 0.0 109.99 179.442 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 377' ' ' GLY . . . . . . . . . . . . . . . -58.97 -32.74 71.36 Favored Glycine 0 N--CA 1.449 -0.485 0 C-N-CA 120.583 -0.818 . . . . 0.0 111.373 179.091 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 378' ' ' GLN . . . . . . . . . . . . . 15.8 mm100 -56.98 -36.31 70.18 Favored 'General case' 0 C--N 1.333 -0.142 0 CA-C-O 120.929 0.395 . . . . 0.0 110.09 178.829 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 379' ' ' PHE . . . . . . . . . . . . . 70.3 m-85 -68.14 -42.06 80.68 Favored 'General case' 0 C--N 1.333 -0.144 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.243 179.339 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 380' ' ' LEU . . . . . 0.414 HD12 ' HA ' ' B' ' 380' ' ' LEU . 5.8 tp -51.38 121.27 16.62 Favored Pre-proline 0 C--N 1.329 -0.306 0 CA-C-N 115.554 -0.748 . . . . 0.0 110.667 -179.829 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 381' ' ' PRO . . . . . . . . . . . . . 84.9 Cg_exo . . . . . 0 C--N 1.351 0.677 0 C-N-CA 122.413 2.075 . . . . 0.0 112.462 -179.984 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 366' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.234 0.253 0 CA-C-O 120.906 0.384 . . . . 0.0 110.643 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 367' ' ' VAL . . . . . . . . . . . . . 21.4 t -53.28 -32.65 19.74 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 115.892 -0.595 . . . . 0.0 110.986 179.969 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 368' ' ' TYR . . . . . . . . . . . . . 66.3 t80 -68.02 -36.78 80.52 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.675 179.785 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 369' ' ' VAL . . . . . 0.406 HG22 ' HB2' ' B' ' 336' ' ' GLN . 6.0 t -67.26 -52.97 36.99 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.238 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.728 179.85 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 370' ' ' LEU . . . . . 0.412 HD22 ' N ' ' A' ' 370' ' ' LEU . 3.4 mm? -62.32 -32.36 73.1 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.766 179.801 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 371' ' ' SER . . . . . . . . . . . . . 27.2 t -64.12 -58.34 6.94 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.045 179.878 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 372' ' ' SER . . . . . . . . . . . . . 41.7 t -59.68 -32.5 70.54 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.09 -179.86 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 373' ' ' MET . . . . . . . . . . . . . 55.6 ttm -63.99 -47.24 81.09 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.402 -0.363 . . . . 0.0 111.174 179.935 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 374' ' ' ALA . . . . . . . . . . . . . . . -83.17 -13.79 54.77 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.363 -0.38 . . . . 0.0 111.686 -179.715 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 375' ' ' ARG . . . . . 0.533 ' HG2' ' HG2' ' B' ' 303' ' ' GLU . 7.0 mmt180 -86.07 -30.73 22.38 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.487 -0.324 . . . . 0.0 111.25 -179.844 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 376' ' ' GLN . . . . . 0.47 ' HB3' ' HG3' ' B' ' 381' ' ' PRO . 52.6 tt0 . . . . . 0 C--N 1.329 -0.322 0 CA-C-N 116.255 -0.429 . . . . 0.0 111.179 -179.617 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 302' ' ' VAL . . . . . . . . . . . . . 15.0 p . . . . . 0 C--O 1.232 0.137 0 CA-C-O 120.89 0.376 . . . . 0.0 110.805 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' B' B ' 303' ' ' GLU . . . . . 0.533 ' HG2' ' HG2' ' A' ' 375' ' ' ARG . 35.5 mt-10 -51.64 -80.75 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.77 -0.65 . . . . 0.0 111.879 -179.34 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 304' ' ' PHE . . . . . 0.492 ' O ' HG12 ' B' ' 308' ' ' ILE . 81.0 m-85 -54.79 -55.0 34.78 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.918 -0.583 . . . . 0.0 112.043 -179.023 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 305' ' ' ASN . . . . . . . . . . . . . 2.8 t-20 -47.58 -68.89 0.15 Allowed 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 112.87 0.693 . . . . 0.0 112.87 -178.668 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 306' ' ' HIS . . . . . . . . . . . . . 2.5 t-160 -54.98 -46.33 75.1 Favored 'General case' 0 C--N 1.33 -0.266 0 N-CA-C 112.417 0.525 . . . . 0.0 112.417 -178.244 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 307' ' ' ALA . . . . . . . . . . . . . . . -58.6 -62.19 2.04 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 112.37 0.507 . . . . 0.0 112.37 -178.89 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 308' ' ' ILE . . . . . 0.492 HG12 ' O ' ' B' ' 304' ' ' PHE . 30.9 pt -54.68 -37.74 40.72 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.208 0 N-CA-C 111.825 0.306 . . . . 0.0 111.825 -179.173 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 309' ' ' ASN . . . . . 0.433 ' N ' HG13 ' B' ' 308' ' ' ILE . 5.3 m-20 -61.58 -45.27 94.85 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.896 0.379 . . . . 0.0 110.804 179.987 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 310' ' ' TYR . . . . . 0.509 ' O ' HG12 ' B' ' 314' ' ' ILE . 81.4 t80 -61.54 -60.13 4.16 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.847 179.869 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 311' ' ' VAL . . . . . . . . . . . . . 47.5 t -54.13 -31.26 21.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-O 120.896 0.379 . . . . 0.0 111.178 -179.572 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 312' ' ' ASN . . . . . . . . . . . . . 3.2 t-20 -65.11 -56.52 12.48 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.361 -179.668 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 313' ' ' LYS . . . . . 0.516 ' NZ ' ' HB2' ' B' ' 313' ' ' LYS . 0.0 OUTLIER -65.31 -23.52 67.04 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 116.493 -0.321 . . . . 0.0 111.595 -179.555 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 314' ' ' ILE . . . . . 0.509 HG12 ' O ' ' B' ' 310' ' ' TYR . 24.6 mm -76.68 -36.61 27.45 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-O 120.814 0.34 . . . . 0.0 111.087 179.723 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 315' ' ' LYS . . . . . . . . . . . . . 1.2 tmmt? -75.84 -35.94 59.8 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.404 -0.362 . . . . 0.0 110.858 -179.982 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 316' ' ' ASN . . . . . . . . . . . . . 27.0 t-20 -74.4 -46.0 43.11 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.045 -0.525 . . . . 0.0 111.525 -179.47 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 317' ' ' ARG . . . . . . . . . . . . . 19.1 tpt180 -68.61 -25.55 64.91 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.448 -0.342 . . . . 0.0 111.177 -179.644 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 318' ' ' PHE . . . . . . . . . . . . . 95.7 m-85 -117.31 37.51 3.85 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.172 -179.837 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 319' ' ' GLN . . . . . . . . . . . . . 3.0 pt20 -63.4 -15.15 56.7 Favored 'General case' 0 N--CA 1.447 -0.586 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.925 179.591 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 320' ' ' GLY . . . . . . . . . . . . . . . -104.98 -7.22 38.79 Favored Glycine 0 C--N 1.331 0.284 0 C-N-CA 120.837 -0.697 . . . . 0.0 112.697 -179.85 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 321' ' ' GLN . . . . . . . . . . . . . 23.5 mp0 -113.05 88.32 11.92 Favored Pre-proline 0 C--N 1.33 -0.281 0 CA-C-O 120.549 0.214 . . . . 0.0 111.004 -179.991 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 322' ' ' PRO . . . . . . . . . . . . . 90.2 Cg_endo -80.87 -26.5 3.6 Favored 'Trans proline' 0 C--N 1.348 0.507 0 C-N-CA 122.474 2.116 . . . . 0.0 112.689 179.778 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 323' ' ' ASP . . . . . . . . . . . . . 12.4 m-20 -67.05 -56.82 8.41 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.383 -179.542 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 324' ' ' ILE . . . . . . . . . . . . . 57.1 mt -64.3 -43.39 97.17 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 CA-C-N 116.299 -0.41 . . . . 0.0 111.195 -179.784 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 325' ' ' TYR . . . . . 0.45 ' O ' HD23 ' B' ' 329' ' ' LEU . 55.1 t80 -57.12 -58.23 9.09 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.714 179.957 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 326' ' ' LYS . . . . . 0.438 ' O ' ' HG2' ' B' ' 330' ' ' GLU . 58.6 mtpt -52.2 -50.02 62.72 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.012 179.833 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 327' ' ' ALA . . . . . 0.439 ' O ' ' HB2' ' B' ' 330' ' ' GLU . . . -50.35 -46.46 55.76 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 116.369 -0.378 . . . . 0.0 111.207 179.997 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 328' ' ' PHE . . . . . . . . . . . . . 71.3 t80 -58.01 -53.5 57.49 Favored 'General case' 0 C--O 1.237 0.44 0 CA-C-O 121.062 0.458 . . . . 0.0 109.985 179.293 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 329' ' ' LEU . . . . . 0.45 HD23 ' O ' ' B' ' 325' ' ' TYR . 4.2 mm? -58.73 -27.73 65.19 Favored 'General case' 0 N--CA 1.452 -0.327 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.372 179.082 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 330' ' ' GLU . . . . . 0.439 ' HB2' ' O ' ' B' ' 327' ' ' ALA . 27.4 mm-40 -69.23 -39.22 78.66 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.035 179.464 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 331' ' ' ILE . . . . . 0.463 HG22 HG22 ' B' ' 358' ' ' VAL . 68.2 mt -63.8 -50.51 77.39 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.23 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.254 179.204 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 332' ' ' LEU . . . . . . . . . . . . . 11.0 mp -66.48 -28.92 68.96 Favored 'General case' 0 C--O 1.233 0.2 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.796 179.643 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 333' ' ' HIS . . . . . . . . . . . . . 34.4 t-80 -66.88 -61.05 2.14 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.401 179.348 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 334' ' ' THR . . . . . . . . . . . . . 95.3 m -56.1 -34.29 65.89 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.925 -0.579 . . . . 0.0 110.242 179.286 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 335' ' ' TYR . . . . . . . . . . . . . 52.4 t80 -63.79 -41.73 97.88 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.809 -0.632 . . . . 0.0 110.245 179.31 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 336' ' ' GLN . . . . . 0.406 ' HB2' HG22 ' A' ' 369' ' ' VAL . 44.4 tt0 -62.77 -47.07 85.08 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.773 179.665 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 337' ' ' LYS . . . . . . . . . . . . . 28.7 ttpp -56.72 -54.32 47.52 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.177 -179.914 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 338' ' ' GLU . . . . . . . . . . . . . 19.7 mm-40 -60.94 -33.34 73.03 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.272 -179.916 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 339' ' ' GLN . . . . . . . . . . . . . 60.5 tt0 -63.14 -61.22 2.52 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.854 -179.949 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 340' ' ' ARG . . . . . . . . . . . . . 95.4 mtt180 -52.54 -52.67 53.68 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.011 -0.54 . . . . 0.0 111.084 -179.99 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 341' ' ' ASN . . . . . . . . . . . . . 80.2 m-20 -54.32 -40.66 68.2 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.952 179.906 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 342' ' ' ALA . . . . . . . . . . . . . . . -66.89 -31.25 71.72 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.119 179.961 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 343' ' ' LYS . . . . . . . . . . . . . 14.0 mmmm -72.35 -46.64 54.61 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.112 -0.494 . . . . 0.0 111.195 -179.885 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 344' ' ' GLU . . . . . . . . . . . . . 14.1 mm-40 -69.7 -29.23 66.59 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.17 -179.706 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 345' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.297 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.215 -179.898 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' B' B ' 351' ' ' PRO . . . . . . . . . . . . . 52.5 Cg_exo . . . . . 0 C--O 1.232 0.176 0 CA-C-O 120.843 0.268 . . . . 0.0 112.459 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' B' B ' 352' ' ' ALA . . . . . . . . . . . . . . . -77.26 -41.71 39.94 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.058 179.947 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 353' ' ' LEU . . . . . 0.453 ' HG ' ' HG2' ' B' ' 357' ' ' GLU . 7.1 mp -114.74 130.32 56.82 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.01 179.969 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 354' ' ' THR . . . . . . . . . . . . . 81.0 p -112.36 -174.86 2.55 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.055 -0.521 . . . . 0.0 110.805 179.769 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 355' ' ' GLU . . . . . . . . . . . . . 8.5 pt-20 -56.54 -42.14 77.97 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 121.209 0.528 . . . . 0.0 110.573 179.985 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 356' ' ' GLN . . . . . . . . . . . . . 15.8 mm100 -65.95 -38.92 89.85 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.5 -0.773 . . . . 0.0 111.055 179.789 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 357' ' ' GLU . . . . . 0.453 ' HG2' ' HG ' ' B' ' 353' ' ' LEU . 5.5 tp10 -61.33 -46.48 90.09 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 120.856 0.36 . . . . 0.0 110.707 -179.833 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 358' ' ' VAL . . . . . 0.512 ' O ' HG23 ' B' ' 362' ' ' VAL . 71.5 t -63.5 -59.92 3.57 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-N 116.101 -0.499 . . . . 0.0 111.173 179.889 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 359' ' ' TYR . . . . . . . . . . . . . 46.5 t80 -52.36 -32.47 38.6 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.375 -0.375 . . . . 0.0 111.569 -179.335 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 360' ' ' ALA . . . . . . . . . . . . . . . -68.42 -60.54 2.36 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.77 0.319 . . . . 0.0 111.075 -179.95 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 361' ' ' GLN . . . . . . . . . . . . . 25.0 mt-30 -55.44 -45.5 76.82 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.68 179.939 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 362' ' ' VAL . . . . . 0.512 HG23 ' O ' ' B' ' 358' ' ' VAL . 57.5 t -61.61 -36.96 76.66 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.217 0 CA-C-N 116.152 -0.477 . . . . 0.0 110.305 179.399 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 363' ' ' ALA . . . . . . . . . . . . . . . -63.84 -34.69 78.49 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.104 179.133 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 364' ' ' ARG . . . . . . . . . . . . . 59.2 ttt180 -75.83 -26.93 57.64 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.821 -0.627 . . . . 0.0 110.085 179.197 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 365' ' ' LEU . . . . . . . . . . . . . 2.5 mp -60.04 -57.97 10.53 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.792 179.333 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 366' ' ' PHE . . . . . 0.423 ' HB3' ' HB2' ' B' ' 369' ' ' GLN . 4.9 m-85 -104.97 133.72 49.29 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.609 179.937 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 367' ' ' LYS . . . . . . . . . . . . . 96.7 mttt -105.23 -78.0 0.58 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.844 0.354 . . . . 0.0 111.15 -179.636 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 368' ' ' ASN . . . . . . . . . . . . . 14.8 m120 -66.88 -16.59 64.41 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.935 -179.982 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 369' ' ' GLN . . . . . 0.423 ' HB2' ' HB3' ' B' ' 366' ' ' PHE . 22.7 mt-30 -97.02 85.75 3.81 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.947 179.964 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 370' ' ' GLU . . . . . . . . . . . . . 10.5 mm-40 -94.06 -6.03 46.09 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.068 -0.515 . . . . 0.0 111.095 179.847 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 371' ' ' ASP . . . . . . . . . . . . . 20.2 t70 -58.67 -62.77 1.62 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.009 -179.976 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 372' ' ' LEU . . . . . 0.558 HD12 ' N ' ' B' ' 373' ' ' LEU . 0.3 OUTLIER -62.25 -22.52 66.04 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.077 179.927 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 373' ' ' LEU . . . . . 0.558 ' N ' HD12 ' B' ' 372' ' ' LEU . 6.1 tp -70.18 -39.82 75.04 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.25 -179.997 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 374' ' ' SER . . . . . . . . . . . . . 54.7 m -71.98 -48.82 42.24 Favored 'General case' 0 C--O 1.234 0.274 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.065 179.247 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 375' ' ' GLU . . . . . . . . . . . . . 15.3 mm-40 -54.43 -44.79 72.75 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-N 116.009 -0.542 . . . . 0.0 110.057 179.361 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 376' ' ' PHE . . . . . . . . . . . . . 82.3 t80 -65.54 -38.52 89.85 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.015 -0.538 . . . . 0.0 109.934 179.206 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 377' ' ' GLY . . . . . . . . . . . . . . . -58.05 -34.27 72.12 Favored Glycine 0 N--CA 1.449 -0.451 0 C-N-CA 120.683 -0.77 . . . . 0.0 111.721 179.332 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 378' ' ' GLN . . . . . . . . . . . . . 98.1 mt-30 -60.99 -34.73 75.24 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.68 0.276 . . . . 0.0 110.711 179.381 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 379' ' ' PHE . . . . . . . . . . . . . 56.6 m-85 -59.57 -36.5 76.34 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.57 179.656 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 380' ' ' LEU . . . . . . . . . . . . . 93.5 mt -54.22 145.49 35.44 Favored Pre-proline 0 C--N 1.331 -0.204 0 CA-C-N 115.921 -0.581 . . . . 0.0 110.644 179.834 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 381' ' ' PRO . . . . . 0.47 ' HG3' ' HB3' ' A' ' 376' ' ' GLN . 76.6 Cg_exo . . . . . 0 C--N 1.346 0.428 0 C-N-CA 122.408 2.072 . . . . 0.0 112.226 179.929 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 366' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.232 0.132 0 CA-C-O 120.973 0.416 . . . . 0.0 110.762 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 367' ' ' VAL . . . . . . . . . . . . . 21.9 t -59.64 -19.4 16.81 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.744 179.918 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 368' ' ' TYR . . . . . . . . . . . . . 84.7 t80 -65.91 -60.03 3.26 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.061 -179.993 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 369' ' ' VAL . . . . . 0.439 HG21 ' HB3' ' B' ' 332' ' ' LEU . 20.8 m -67.82 -36.82 77.14 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.19 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.555 -179.697 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 370' ' ' LEU . . . . . . . . . . . . . 97.5 mt -62.4 -58.46 7.56 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.958 0.409 . . . . 0.0 110.94 179.88 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 371' ' ' SER . . . . . . . . . . . . . 36.6 t -58.87 -51.4 70.17 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.045 -0.525 . . . . 0.0 111.037 179.8 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 372' ' ' SER . . . . . . . . . . . . . 93.0 p -55.17 -41.32 71.72 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.338 -179.503 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 373' ' ' MET . . . . . 0.575 ' HG2' ' H ' ' B' ' 380' ' ' LEU . 54.3 ttm -62.97 -41.49 99.56 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.458 -0.337 . . . . 0.0 111.186 -179.724 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 374' ' ' ALA . . . . . . . . . . . . . . . -87.03 -6.68 58.65 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.357 -0.383 . . . . 0.0 111.922 -179.595 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 375' ' ' ARG . . . . . . . . . . . . . 22.1 mmm180 -107.81 -12.64 15.16 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.591 0.234 . . . . 0.0 111.603 -179.804 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 376' ' ' GLN . . . . . 0.573 ' HB3' ' HG3' ' B' ' 381' ' ' PRO . 54.0 tt0 . . . . . 0 C--N 1.33 -0.244 0 CA-C-O 121.039 0.447 . . . . 0.0 110.892 -179.727 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 302' ' ' VAL . . . . . . . . . . . . . 8.2 p . . . . . 0 C--O 1.232 0.182 0 CA-C-O 121.071 0.463 . . . . 0.0 110.912 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' B' B ' 303' ' ' GLU . . . . . 0.408 ' HG3' ' H ' ' B' ' 303' ' ' GLU . 18.7 mt-10 -54.48 -81.18 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.629 -0.714 . . . . 0.0 111.709 -179.244 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 304' ' ' PHE . . . . . 0.561 ' HA ' HD13 ' B' ' 308' ' ' ILE . 80.8 t80 -51.07 -50.15 59.25 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.871 -179.199 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 305' ' ' ASN . . . . . . . . . . . . . 27.7 t-20 -50.43 -72.76 0.05 OUTLIER 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 112.634 0.605 . . . . 0.0 112.634 -178.817 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 306' ' ' HIS . . . . . . . . . . . . . 20.1 m-70 -58.95 -55.27 37.33 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 113.024 0.75 . . . . 0.0 113.024 -177.994 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 307' ' ' ALA . . . . . . . . . . . . . . . -50.66 -62.37 1.64 Allowed 'General case' 0 CA--C 1.532 0.277 0 N-CA-C 112.554 0.576 . . . . 0.0 112.554 -178.678 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 308' ' ' ILE . . . . . 0.561 HD13 ' HA ' ' B' ' 304' ' ' PHE . 1.8 mp -57.91 -52.79 53.78 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.219 0 N-CA-C 112.024 0.379 . . . . 0.0 112.024 -179.071 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 309' ' ' ASN . . . . . . . . . . . . . 12.3 m120 -54.33 -28.97 46.24 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.643 0.258 . . . . 0.0 111.427 -179.473 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 310' ' ' TYR . . . . . 0.563 ' O ' ' HG3' ' B' ' 313' ' ' LYS . 43.7 t80 -74.09 -61.26 1.92 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.948 0.404 . . . . 0.0 111.059 -179.674 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 311' ' ' VAL . . . . . . . . . . . . . 58.5 t -58.64 -27.73 35.01 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.428 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.673 179.949 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 312' ' ' ASN . . . . . . . . . . . . . 7.5 t30 -72.49 -56.69 5.01 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.71 -179.148 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 313' ' ' LYS . . . . . 0.563 ' HG3' ' O ' ' B' ' 310' ' ' TYR . 0.0 OUTLIER -56.56 -38.09 71.45 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.648 0.261 . . . . 0.0 111.465 -179.359 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' B' B ' 314' ' ' ILE . . . . . 0.419 HG13 ' O ' ' B' ' 310' ' ' TYR . 11.0 mt -78.08 -31.14 16.4 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.22 0 N-CA-C 111.958 0.355 . . . . 0.0 111.958 -179.409 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 315' ' ' LYS . . . . . 0.409 ' HE3' ' HB3' ' B' ' 315' ' ' LYS . 1.4 tmmt? -70.54 -34.92 72.81 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.61 0.243 . . . . 0.0 111.281 -179.983 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 316' ' ' ASN . . . . . . . . . . . . . 61.5 t30 -86.01 -38.55 17.78 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.478 -0.328 . . . . 0.0 111.746 -179.087 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 317' ' ' ARG . . . . . . . . . . . . . 32.6 tpt180 -75.58 -44.13 44.71 Favored 'General case' 0 C--N 1.327 -0.374 0 N-CA-C 111.733 0.272 . . . . 0.0 111.733 -179.29 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 318' ' ' PHE . . . . . . . . . . . . . 62.9 m-85 -98.0 34.63 1.88 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.537 -0.302 . . . . 0.0 111.394 -179.455 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 319' ' ' GLN . . . . . . . . . . . . . 3.8 pt20 -67.97 -9.13 42.97 Favored 'General case' 0 N--CA 1.447 -0.602 0 CA-C-N 116.443 -0.344 . . . . 0.0 111.068 179.658 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 320' ' ' GLY . . . . . . . . . . . . . . . -96.05 -19.11 29.56 Favored Glycine 0 N--CA 1.451 -0.347 0 C-N-CA 120.845 -0.693 . . . . 0.0 112.711 -179.857 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 321' ' ' GLN . . . . . . . . . . . . . 58.9 mt-30 -108.07 92.27 9.1 Favored Pre-proline 0 C--N 1.33 -0.274 0 CA-C-O 120.473 0.178 . . . . 0.0 111.139 179.935 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 322' ' ' PRO . . . . . . . . . . . . . 93.0 Cg_endo -79.03 -23.57 7.67 Favored 'Trans proline' 0 C--N 1.349 0.601 0 C-N-CA 122.502 2.135 . . . . 0.0 112.355 179.75 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 323' ' ' ASP . . . . . . . . . . . . . 10.0 m-20 -69.36 -52.69 24.67 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.824 179.949 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 324' ' ' ILE . . . . . . . . . . . . . 64.4 mt -69.12 -42.54 81.85 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.98 179.929 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 325' ' ' TYR . . . . . . . . . . . . . 40.3 t80 -58.21 -57.17 14.03 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.697 179.874 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 326' ' ' LYS . . . . . 0.463 ' O ' ' HG2' ' B' ' 330' ' ' GLU . 28.6 mtpp -57.84 -46.8 84.22 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.938 179.789 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 327' ' ' ALA . . . . . . . . . . . . . . . -48.19 -54.14 14.51 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 116.308 -0.405 . . . . 0.0 111.193 -179.916 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 328' ' ' PHE . . . . . . . . . . . . . 84.0 t80 -56.12 -47.29 78.41 Favored 'General case' 0 C--O 1.237 0.405 0 CA-C-O 121.14 0.495 . . . . 0.0 109.903 179.283 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 329' ' ' LEU . . . . . . . . . . . . . 91.7 mt -61.36 -26.19 67.66 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.614 -0.721 . . . . 0.0 110.636 179.496 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 330' ' ' GLU . . . . . 0.463 ' HG2' ' O ' ' B' ' 326' ' ' LYS . 16.1 mm-40 -75.63 -32.89 60.42 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.151 -0.477 . . . . 0.0 109.983 179.454 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 331' ' ' ILE . . . . . 0.493 HG22 HG22 ' B' ' 358' ' ' VAL . 74.4 mt -67.22 -47.53 81.2 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.191 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.343 179.063 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 332' ' ' LEU . . . . . 0.439 ' HB3' HG21 ' A' ' 369' ' ' VAL . 9.3 mp -69.21 -35.87 76.66 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.755 179.426 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 333' ' ' HIS . . . . . . . . . . . . . 17.0 t-80 -64.05 -52.94 57.03 Favored 'General case' 0 C--O 1.232 0.182 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.37 179.608 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 334' ' ' THR . . . . . . . . . . . . . 84.4 m -60.44 -36.78 79.02 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.036 -0.529 . . . . 0.0 109.838 179.094 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 335' ' ' TYR . . . . . . . . . . . . . 50.9 t80 -61.36 -37.1 82.13 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.516 -0.765 . . . . 0.0 109.933 179.249 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 336' ' ' GLN . . . . . . . . . . . . . 9.8 tt0 -66.01 -51.6 56.87 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 115.798 -0.637 . . . . 0.0 110.492 179.315 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 337' ' ' LYS . . . . . . . . . . . . . 27.1 ttpp -55.36 -39.21 69.8 Favored 'General case' 0 C--O 1.233 0.195 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.936 179.853 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 338' ' ' GLU . . . . . . . . . . . . . 15.6 mm-40 -66.47 -42.29 87.75 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.94 179.881 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 339' ' ' GLN . . . . . . . . . . . . . 74.0 mt-30 -61.45 -42.4 98.71 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.323 -0.398 . . . . 0.0 110.957 179.608 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 340' ' ' ARG . . . . . . . . . . . . . 73.6 mtp180 -62.39 -55.27 29.52 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.901 -179.875 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 341' ' ' ASN . . . . . . . . . . . . . 82.7 m-20 -57.17 -35.01 69.04 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.874 179.912 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 342' ' ' ALA . . . . . . . . . . . . . . . -66.31 -43.24 86.79 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.061 -0.518 . . . . 0.0 111.102 179.92 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 343' ' ' LYS . . . . . . . . . . . . . 14.4 tmtt? -65.03 -46.64 80.44 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.634 -179.979 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 344' ' ' GLU . . . . . . . . . . . . . 12.5 mm-40 -63.98 -32.44 73.98 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.886 -179.999 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 345' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.33 -0.265 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.029 179.938 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' B' B ' 351' ' ' PRO . . . . . . . . . . . . . 54.7 Cg_exo . . . . . 0 C--O 1.231 0.152 0 CA-C-O 120.758 0.232 . . . . 0.0 112.497 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' B' B ' 352' ' ' ALA . . . . . . . . . . . . . . . -61.04 -59.43 5.38 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.028 179.936 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 353' ' ' LEU . . . . . 0.447 ' HG ' ' HG2' ' B' ' 357' ' ' GLU . 5.9 mp -89.88 117.6 28.82 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.856 0.36 . . . . 0.0 111.137 179.921 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 354' ' ' THR . . . . . 0.423 ' H ' ' HB2' ' B' ' 357' ' ' GLU . 73.1 p -110.62 -171.19 1.78 Allowed 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.088 -0.506 . . . . 0.0 110.551 179.427 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 355' ' ' GLU . . . . . . . . . . . . . 34.8 mt-10 -54.9 -42.55 72.29 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 121.065 0.46 . . . . 0.0 110.406 179.671 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 356' ' ' GLN . . . . . . . . . . . . . 96.5 mt-30 -67.2 -35.86 80.5 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.667 -0.697 . . . . 0.0 111.054 -179.936 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 357' ' ' GLU . . . . . 0.447 ' HG2' ' HG ' ' B' ' 353' ' ' LEU . 5.7 tp10 -62.41 -53.85 48.95 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.528 -0.306 . . . . 0.0 110.877 -179.703 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 358' ' ' VAL . . . . . 0.502 ' O ' HG23 ' B' ' 362' ' ' VAL . 72.6 t -59.83 -57.03 13.49 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.413 -0.358 . . . . 0.0 111.042 179.984 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 359' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -51.85 -35.19 43.9 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.806 0.336 . . . . 0.0 110.932 -179.527 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 360' ' ' ALA . . . . . . . . . . . . . . . -68.38 -59.21 3.34 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.501 -0.318 . . . . 0.0 111.451 -179.904 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 361' ' ' GLN . . . . . . . . . . . . . 13.3 mm100 -53.66 -42.68 68.11 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.993 -179.991 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 362' ' ' VAL . . . . . 0.502 HG23 ' O ' ' B' ' 358' ' ' VAL . 49.0 t -68.96 -37.66 77.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.732 179.82 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 363' ' ' ALA . . . . . 0.587 ' HA ' HD21 ' B' ' 373' ' ' LEU . . . -59.62 -38.25 80.82 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.736 179.687 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 364' ' ' ARG . . . . . . . . . . . . . 77.6 ttt180 -90.33 -18.79 24.92 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.826 -0.624 . . . . 0.0 110.723 179.964 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 365' ' ' LEU . . . . . . . . . . . . . 25.2 tp -55.7 -30.82 61.77 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.531 179.749 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 366' ' ' PHE . . . . . . . . . . . . . 69.3 m-85 -112.63 159.89 18.43 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.31 179.724 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 367' ' ' LYS . . . . . . . . . . . . . 34.5 mmtp -89.34 -75.67 0.43 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.407 -0.36 . . . . 0.0 111.551 -179.31 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 368' ' ' ASN . . . . . . . . . . . . . 29.4 m-80 -115.48 14.95 16.74 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.406 -0.361 . . . . 0.0 111.136 -179.59 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 369' ' ' GLN . . . . . . . . . . . . . 70.9 mt-30 -89.61 90.3 8.19 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.891 179.989 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 370' ' ' GLU . . . . . . . . . . . . . 34.3 mt-10 -91.8 -11.44 36.59 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.755 179.986 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 371' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -58.4 -57.58 12.27 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.83 179.947 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 372' ' ' LEU . . . . . . . . . . . . . 23.1 mt -61.74 -38.59 88.51 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.491 179.75 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 373' ' ' LEU . . . . . 0.587 HD21 ' HA ' ' B' ' 363' ' ' ALA . 1.0 OUTLIER -56.71 -38.93 73.02 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.567 179.866 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' B' B ' 374' ' ' SER . . . . . . . . . . . . . 70.8 m -73.25 -44.87 58.64 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.046 -0.524 . . . . 0.0 110.296 179.417 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 375' ' ' GLU . . . . . . . . . . . . . 28.1 mm-40 -56.76 -34.34 67.49 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.347 179.437 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 376' ' ' PHE . . . . . . . . . . . . . 66.8 t80 -82.58 -30.12 29.8 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.878 -0.601 . . . . 0.0 109.854 179.266 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 377' ' ' GLY . . . . . . . . . . . . . . . -64.59 -31.37 80.67 Favored Glycine 0 N--CA 1.45 -0.389 0 C-N-CA 120.837 -0.697 . . . . 0.0 111.909 179.326 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 378' ' ' GLN . . . . . . . . . . . . . 30.1 mm-40 -56.8 -26.76 58.58 Favored 'General case' 0 C--N 1.333 -0.139 0 CA-C-O 120.953 0.406 . . . . 0.0 110.477 179.553 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 379' ' ' PHE . . . . . . . . . . . . . 63.6 m-85 -73.12 -148.19 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.627 179.527 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 380' ' ' LEU . . . . . 0.575 ' H ' ' HG2' ' A' ' 373' ' ' MET . 32.7 mt 66.81 131.13 0.03 OUTLIER Pre-proline 0 CA--C 1.531 0.226 0 CA-C-N 116.482 -0.326 . . . . 0.0 110.789 179.991 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 381' ' ' PRO . . . . . 0.573 ' HG3' ' HB3' ' A' ' 376' ' ' GLN . 62.8 Cg_exo . . . . . 0 C--N 1.349 0.582 0 C-N-CA 122.28 1.986 . . . . 0.0 112.486 179.989 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 366' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.231 0.114 0 CA-C-O 120.853 0.359 . . . . 0.0 111.09 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 367' ' ' VAL . . . . . . . . . . . . . 39.9 t -73.22 -31.39 34.21 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.051 -179.995 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 368' ' ' TYR . . . . . . . . . . . . . 49.1 t80 -70.42 -42.77 71.17 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.932 -179.885 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 369' ' ' VAL . . . . . 0.431 HG13 ' N ' ' A' ' 370' ' ' LEU . 5.7 p -70.56 -46.88 68.05 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.216 0 CA-C-N 116.242 -0.436 . . . . 0.0 111.157 -179.923 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 370' ' ' LEU . . . . . 0.51 HD13 ' HA ' ' B' ' 307' ' ' ALA . 89.8 mt -60.18 -43.85 95.53 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.816 0.341 . . . . 0.0 110.868 179.808 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 371' ' ' SER . . . . . . . . . . . . . 45.2 t -62.01 -57.28 12.25 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.967 179.89 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 372' ' ' SER . . . . . 0.407 ' O ' ' HG2' ' A' ' 376' ' ' GLN . 47.3 t -51.59 -50.85 59.36 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.224 -179.77 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 373' ' ' MET . . . . . . . . . . . . . 94.2 mtp -54.18 -45.54 72.14 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.353 -179.768 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 374' ' ' ALA . . . . . . . . . . . . . . . -79.81 -9.81 59.71 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.583 -0.28 . . . . 0.0 111.635 -179.832 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 375' ' ' ARG . . . . . . . . . . . . . 22.3 mmm180 -100.68 -12.13 19.41 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.558 -0.292 . . . . 0.0 111.363 179.871 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 376' ' ' GLN . . . . . 0.573 ' HB2' ' HG3' ' B' ' 381' ' ' PRO . 18.1 mm-40 . . . . . 0 C--N 1.329 -0.322 0 CA-C-N 116.511 -0.313 . . . . 0.0 111.084 179.952 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 302' ' ' VAL . . . . . . . . . . . . . 10.3 p . . . . . 0 C--O 1.231 0.127 0 CA-C-O 120.787 0.327 . . . . 0.0 111.147 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' B' B ' 303' ' ' GLU . . . . . . . . . . . . . 27.7 mt-10 -52.12 -74.08 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.859 -0.609 . . . . 0.0 112.016 -179.407 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 304' ' ' PHE . . . . . . . . . . . . . 90.3 m-85 -50.07 -66.52 0.38 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.968 -0.56 . . . . 0.0 112.291 -178.96 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 305' ' ' ASN . . . . . . . . . . . . . 16.8 m120 -41.77 -61.91 1.01 Allowed 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 112.798 0.666 . . . . 0.0 112.798 -178.704 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 306' ' ' HIS . . . . . . . . . . . . . 11.2 m170 -60.46 -67.52 0.39 Allowed 'General case' 0 C--N 1.33 -0.246 0 N-CA-C 112.703 0.631 . . . . 0.0 112.703 -178.519 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 307' ' ' ALA . . . . . 0.51 ' HA ' HD13 ' A' ' 370' ' ' LEU . . . -48.64 -58.11 5.23 Favored 'General case' 0 C--N 1.33 -0.27 0 N-CA-C 112.388 0.514 . . . . 0.0 112.388 -178.542 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 308' ' ' ILE . . . . . . . . . . . . . 42.8 mm -53.37 -60.0 1.51 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 N-CA-C 112.001 0.371 . . . . 0.0 112.001 -179.247 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 309' ' ' ASN . . . . . . . . . . . . . 14.0 m120 -57.82 -25.02 60.05 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 120.594 0.235 . . . . 0.0 111.615 -179.298 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 310' ' ' TYR . . . . . . . . . . . . . 36.3 t80 -69.87 -56.27 7.53 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.506 -0.315 . . . . 0.0 111.128 -179.541 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 311' ' ' VAL . . . . . . . . . . . . . 40.7 t -59.29 -44.05 91.33 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.719 179.976 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 312' ' ' ASN . . . . . . . . . . . . . 7.2 t30 -62.01 -39.94 93.98 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.925 179.914 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 313' ' ' LYS . . . . . . . . . . . . . 4.5 ttmm -60.62 -60.17 4.22 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.985 -179.924 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 314' ' ' ILE . . . . . . . . . . . . . 32.3 mt -59.48 -27.71 37.94 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.129 -179.5 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 315' ' ' LYS . . . . . . . . . . . . . 23.3 ttmm -70.18 -40.86 74.41 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.534 -0.303 . . . . 0.0 111.031 179.649 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 316' ' ' ASN . . . . . . . . . . . . . 60.3 t30 -88.89 -8.53 54.08 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.352 -0.386 . . . . 0.0 110.976 -179.716 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 317' ' ' ARG . . . . . . . . . . . . . 20.7 tpp180 -95.34 -61.8 1.41 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.084 -179.933 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 318' ' ' PHE . . . . . . . . . . . . . 73.6 m-85 -94.37 34.73 1.26 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.333 -179.767 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 319' ' ' GLN . . . . . . . . . . . . . 20.9 tm0? -61.62 -31.01 71.07 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.37 179.557 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 320' ' ' GLY . . . . . . . . . . . . . . . -60.33 -62.51 5.94 Favored Glycine 0 C--N 1.332 0.312 0 C-N-CA 120.986 -0.626 . . . . 0.0 112.704 -179.858 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 321' ' ' GLN . . . . . . . . . . . . . 15.0 mm100 -79.36 111.75 23.08 Favored Pre-proline 0 CA--C 1.531 0.22 0 CA-C-N 116.513 0.157 . . . . 0.0 110.989 -179.865 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 322' ' ' PRO . . . . . . . . . . . . . 97.1 Cg_endo -83.96 -22.81 3.36 Favored 'Trans proline' 0 C--N 1.349 0.582 0 C-N-CA 122.547 2.165 . . . . 0.0 112.619 179.989 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 323' ' ' ASP . . . . . . . . . . . . . 6.7 m-20 -70.12 -49.06 54.5 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.268 -0.423 . . . . 0.0 111.155 -179.725 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 324' ' ' ILE . . . . . . . . . . . . . 51.5 mt -64.7 -47.58 88.2 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.205 -179.825 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 325' ' ' TYR . . . . . . . . . . . . . 23.5 t80 -60.09 -52.4 65.52 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.078 -179.767 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 326' ' ' LYS . . . . . 0.402 ' O ' ' HG3' ' B' ' 330' ' ' GLU . 87.8 tttt -59.36 -36.24 75.38 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.726 179.879 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 327' ' ' ALA . . . . . . . . . . . . . . . -59.9 -52.81 63.82 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.722 179.644 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 328' ' ' PHE . . . . . . . . . . . . . 81.2 t80 -55.51 -49.58 72.21 Favored 'General case' 0 C--O 1.236 0.346 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.74 179.818 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 329' ' ' LEU . . . . . . . . . . . . . 89.4 mt -57.54 -38.47 74.77 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.931 -0.577 . . . . 0.0 111.023 179.89 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 330' ' ' GLU . . . . . 0.402 ' HG3' ' O ' ' B' ' 326' ' ' LYS . 44.7 mt-10 -67.08 -35.35 79.62 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.361 -0.381 . . . . 0.0 111.086 -179.845 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 331' ' ' ILE . . . . . . . . . . . . . 94.4 mt -64.67 -50.91 73.45 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-O 120.855 0.359 . . . . 0.0 110.442 179.348 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 332' ' ' LEU . . . . . . . . . . . . . 4.8 mp -65.97 -31.64 72.67 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.769 179.709 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 333' ' ' HIS . . . . . . . . . . . . . 52.9 t-80 -64.28 -58.06 7.63 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.025 179.34 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 334' ' ' THR . . . . . . . . . . . . . 96.7 m -58.22 -32.44 68.3 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.78 -0.645 . . . . 0.0 110.232 179.139 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 335' ' ' TYR . . . . . . . . . . . . . 74.9 t80 -63.04 -44.43 95.9 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 115.701 -0.681 . . . . 0.0 110.062 179.239 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 336' ' ' GLN . . . . . . . . . . . . . 54.0 tt0 -63.35 -39.47 94.63 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.739 -0.664 . . . . 0.0 110.33 179.488 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 337' ' ' LYS . . . . . . . . . . . . . 14.6 tppt? -58.68 -59.5 5.3 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.929 179.544 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 338' ' ' GLU . . . . . . . . . . . . . 13.6 mm-40 -60.67 -31.08 70.34 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.969 -0.56 . . . . 0.0 111.086 -179.819 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 339' ' ' GLN . . . . . . . . . . . . . 53.5 tt0 -64.47 -45.64 86.51 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.896 0.379 . . . . 0.0 110.793 179.895 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 340' ' ' ARG . . . . . . . . . . . . . 65.7 mtt180 -65.42 -51.61 59.04 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.003 -0.544 . . . . 0.0 111.049 -179.979 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 341' ' ' ASN . . . . . . . . . . . . . 25.8 t-20 -56.43 -39.0 72.36 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.11 -0.496 . . . . 0.0 111.032 -179.8 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 342' ' ' ALA . . . . . . . . . . . . . . . -69.62 -38.64 77.32 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.297 -0.41 . . . . 0.0 111.146 -179.905 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 343' ' ' LYS . . . . . . . . . . . . . 62.8 tttm -65.02 -43.63 91.82 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.262 -0.427 . . . . 0.0 110.888 -179.997 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 344' ' ' GLU . . . . . . . . . . . . . 18.3 mm-40 -70.02 -35.92 74.7 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.041 -179.963 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 345' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.328 -0.336 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.188 -179.893 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' B' B ' 351' ' ' PRO . . . . . . . . . . . . . 48.8 Cg_exo . . . . . 0 C--O 1.231 0.165 0 CA-C-O 120.797 0.249 . . . . 0.0 112.284 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' B' B ' 352' ' ' ALA . . . . . . . . . . . . . . . -86.82 -43.11 12.74 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.177 179.978 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 353' ' ' LEU . . . . . 0.437 ' HG ' ' HG2' ' B' ' 357' ' ' GLU . 6.6 mp -115.64 125.78 53.32 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.954 0.407 . . . . 0.0 111.182 -179.99 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 354' ' ' THR . . . . . . . . . . . . . 74.0 p -114.19 -170.23 1.68 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.509 179.329 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 355' ' ' GLU . . . . . 0.401 ' CD ' ' H ' ' B' ' 355' ' ' GLU . 2.8 mp0 -59.81 -33.69 72.07 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.926 0.393 . . . . 0.0 110.511 179.744 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 356' ' ' GLN . . . . . . . . . . . . . 95.8 mt-30 -74.21 -43.93 55.21 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.006 -0.543 . . . . 0.0 111.331 -179.796 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 357' ' ' GLU . . . . . 0.437 ' HG2' ' HG ' ' B' ' 353' ' ' LEU . 6.2 tp10 -57.23 -48.95 77.53 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 120.992 0.425 . . . . 0.0 110.552 -179.981 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 358' ' ' VAL . . . . . 0.506 ' O ' HG23 ' B' ' 362' ' ' VAL . 73.7 t -64.43 -58.41 7.34 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 115.853 -0.612 . . . . 0.0 111.277 -179.941 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 359' ' ' TYR . . . . . . . . . . . . . 50.1 t80 -53.93 -26.62 26.24 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.598 -0.274 . . . . 0.0 111.159 -179.48 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 360' ' ' ALA . . . . . . . . . . . . . . . -72.48 -60.36 2.27 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.773 0.321 . . . . 0.0 111.147 179.855 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 361' ' ' GLN . . . . . . . . . . . . . 72.7 mt-30 -57.3 -39.44 75.77 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.922 179.886 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 362' ' ' VAL . . . . . 0.506 HG23 ' O ' ' B' ' 358' ' ' VAL . 58.1 t -68.39 -38.59 79.58 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.638 179.637 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 363' ' ' ALA . . . . . 0.509 ' HA ' HD11 ' B' ' 373' ' ' LEU . . . -59.21 -43.76 92.29 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.457 179.43 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 364' ' ' ARG . . . . . . . . . . . . . 41.8 ttm180 -79.99 -21.62 43.43 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.859 -0.61 . . . . 0.0 110.484 179.742 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 365' ' ' LEU . . . . . . . . . . . . . 7.5 tp -58.73 -25.9 63.41 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.44 179.657 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 366' ' ' PHE . . . . . . . . . . . . . 47.2 m-85 -129.05 169.12 15.11 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.757 -0.656 . . . . 0.0 110.38 179.818 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 367' ' ' LYS . . . . . . . . . . . . . 55.9 mtmt -132.2 -79.58 0.5 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.786 0.327 . . . . 0.0 111.131 179.974 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 368' ' ' ASN . . . . . . . . . . . . . 22.3 t-20 -73.5 -12.44 60.78 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.827 -179.859 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 369' ' ' GLN . . . . . . . . . . . . . 26.8 mm-40 -96.54 84.12 3.62 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.104 -179.941 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 370' ' ' GLU . . . . . . . . . . . . . 17.4 mm-40 -94.13 -8.9 38.19 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.67 179.438 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 371' ' ' ASP . . . . . . . . . . . . . 7.4 m-20 -57.64 -63.65 1.17 Allowed 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.911 -179.984 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 372' ' ' LEU . . . . . 0.608 HD12 ' N ' ' B' ' 373' ' ' LEU . 0.4 OUTLIER -57.87 -23.14 51.72 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.994 179.872 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 373' ' ' LEU . . . . . 0.608 ' N ' HD12 ' B' ' 372' ' ' LEU . 4.6 tp -72.69 -39.91 66.66 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.253 179.869 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 374' ' ' SER . . . . . . . . . . . . . 47.4 t -69.16 -51.79 34.6 Favored 'General case' 0 C--O 1.235 0.315 0 CA-C-N 116.025 -0.534 . . . . 0.0 109.916 179.058 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 375' ' ' GLU . . . . . . . . . . . . . 43.0 mt-10 -53.23 -43.61 67.44 Favored 'General case' 0 N--CA 1.455 -0.221 0 CA-C-N 115.791 -0.64 . . . . 0.0 109.698 178.915 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 376' ' ' PHE . . . . . 0.403 ' O ' ' HB2' ' B' ' 379' ' ' PHE . 70.9 t80 -62.81 -39.63 94.9 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 115.714 -0.675 . . . . 0.0 110.043 179.172 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 377' ' ' GLY . . . . . . . . . . . . . . . -58.83 -34.9 79.91 Favored Glycine 0 N--CA 1.449 -0.498 0 C-N-CA 120.735 -0.745 . . . . 0.0 111.724 179.32 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 378' ' ' GLN . . . . . . . . . . . . . 55.8 mt-30 -62.99 -30.92 71.97 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.654 0.264 . . . . 0.0 110.962 179.534 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 379' ' ' PHE . . . . . 0.403 ' HB2' ' O ' ' B' ' 376' ' ' PHE . 50.2 m-85 -61.45 -35.34 77.32 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.354 -0.384 . . . . 0.0 110.74 179.715 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 380' ' ' LEU . . . . . . . . . . . . . 89.4 mt -56.07 138.25 72.92 Favored Pre-proline 0 C--N 1.329 -0.289 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.864 179.884 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 381' ' ' PRO . . . . . 0.573 ' HG3' ' HB2' ' A' ' 376' ' ' GLN . 72.3 Cg_exo . . . . . 0 C--N 1.347 0.473 0 C-N-CA 122.447 2.098 . . . . 0.0 112.309 179.953 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 366' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.232 0.147 0 CA-C-O 120.861 0.362 . . . . 0.0 110.89 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 367' ' ' VAL . . . . . . . . . . . . . 26.9 m -51.22 -21.42 1.5 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.209 0 CA-C-N 115.974 -0.557 . . . . 0.0 111.732 -179.871 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 368' ' ' TYR . . . . . . . . . . . . . 45.7 m-85 -65.19 -61.08 2.35 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.58 -0.282 . . . . 0.0 110.836 179.758 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 369' ' ' VAL . . . . . 0.671 HG13 HD22 ' A' ' 370' ' ' LEU . 2.9 p -64.25 -43.63 97.27 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.204 0 CA-C-N 116.551 -0.295 . . . . 0.0 111.541 -179.882 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 370' ' ' LEU . . . . . 0.671 HD22 HG13 ' A' ' 369' ' ' VAL . 4.2 mm? -57.9 -59.59 5.01 Favored 'General case' 0 C--O 1.235 0.295 0 CA-C-O 120.936 0.398 . . . . 0.0 111.254 -179.955 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 371' ' ' SER . . . . . . . . . . . . . 55.2 m -59.84 -32.33 70.57 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.041 -179.844 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 372' ' ' SER . . . . . . . . . . . . . 47.8 t -59.51 -50.08 75.3 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.849 0.357 . . . . 0.0 110.972 179.904 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 373' ' ' MET . . . . . . . . . . . . . 83.8 mtp -67.1 -34.64 78.07 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.48 -179.749 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 374' ' ' ALA . . . . . . . . . . . . . . . -83.66 -12.69 55.61 Favored 'General case' 0 C--N 1.33 -0.267 0 N-CA-C 112.161 0.43 . . . . 0.0 112.161 -179.239 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 375' ' ' ARG . . . . . . . . . . . . . 27.4 tpt180 -108.74 -13.05 14.85 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.75 0.309 . . . . 0.0 111.059 -179.757 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 376' ' ' GLN . . . . . 0.541 ' HB3' ' HG3' ' B' ' 381' ' ' PRO . 34.2 tt0 . . . . . 0 C--N 1.331 -0.215 0 CA-C-O 121.002 0.43 . . . . 0.0 110.573 179.764 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 302' ' ' VAL . . . . . . . . . . . . . 12.8 p . . . . . 0 CA--C 1.528 0.134 0 CA-C-O 120.699 0.285 . . . . 0.0 111.689 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' B' B ' 303' ' ' GLU . . . . . . . . . . . . . 44.2 mt-10 -56.8 -87.35 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.404 -0.362 . . . . 0.0 111.638 -179.461 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 304' ' ' PHE . . . . . . . . . . . . . 42.6 p90 -65.61 -21.12 66.55 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.319 -0.401 . . . . 0.0 111.722 -179.176 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 305' ' ' ASN . . . . . . . . . . . . . 6.2 t30 -68.37 -64.68 0.82 Allowed 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.777 0.322 . . . . 0.0 111.032 -179.744 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 306' ' ' HIS . . . . . . . . . . . . . 18.8 t-160 -64.74 -34.44 78.32 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.3 -179.435 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 307' ' ' ALA . . . . . . . . . . . . . . . -64.43 -59.54 4.22 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.497 -0.32 . . . . 0.0 111.456 -179.736 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 308' ' ' ILE . . . . . . . . . . . . . 94.5 mt -56.98 -49.51 79.07 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 CA-C-N 116.53 -0.305 . . . . 0.0 111.406 -179.796 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 309' ' ' ASN . . . . . . . . . . . . . 3.6 m-20 -55.55 -40.93 72.54 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.809 0.338 . . . . 0.0 110.812 179.832 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 310' ' ' TYR . . . . . 0.454 ' O ' HG12 ' B' ' 314' ' ' ILE . 84.1 t80 -62.5 -64.24 0.98 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.902 -179.99 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 311' ' ' VAL . . . . . . . . . . . . . 55.4 t -52.84 -24.03 6.29 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.221 0 CA-C-O 120.873 0.368 . . . . 0.0 110.894 179.986 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 312' ' ' ASN . . . . . . . . . . . . . 44.2 t30 -69.89 -56.82 6.05 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.066 179.855 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 313' ' ' LYS . . . . . 0.435 ' HD3' ' N ' ' B' ' 314' ' ' ILE . 0.0 OUTLIER -66.28 -23.55 66.41 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-O 120.775 0.322 . . . . 0.0 111.152 -179.907 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 314' ' ' ILE . . . . . 0.454 HG12 ' O ' ' B' ' 310' ' ' TYR . 31.2 mm -74.65 -43.55 47.57 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 116.392 -0.367 . . . . 0.0 110.754 179.805 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 315' ' ' LYS . . . . . . . . . . . . . 25.5 ttpp -73.42 -27.64 61.55 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.785 179.84 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 316' ' ' ASN . . . . . . . . . . . . . 30.6 t30 -74.32 -50.48 18.61 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.958 179.885 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 317' ' ' ARG . . . . . . . . . . . . . 27.3 mmm180 -61.64 -53.64 53.49 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.142 179.979 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 318' ' ' PHE . . . . . . . . . . . . . 75.6 m-85 -90.77 31.62 1.05 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.082 -179.847 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 319' ' ' GLN . . . . . . . . . . . . . 35.3 tt0 -61.91 -25.64 67.69 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.851 179.936 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 320' ' ' GLY . . . . . . . . . . . . . . . -94.48 -18.38 35.93 Favored Glycine 0 N--CA 1.451 -0.361 0 C-N-CA 120.858 -0.687 . . . . 0.0 112.455 179.971 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 321' ' ' GLN . . . . . . . . . . . . . 8.7 tp-100 -109.83 91.47 10.8 Favored Pre-proline 0 C--N 1.33 -0.273 0 CA-C-O 120.437 0.16 . . . . 0.0 110.731 179.947 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 322' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_endo -76.26 -12.73 19.07 Favored 'Trans proline' 0 C--N 1.348 0.515 0 C-N-CA 122.552 2.168 . . . . 0.0 112.548 -179.891 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 323' ' ' ASP . . . . . . . . . . . . . 20.2 t70 -70.82 -56.32 6.58 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.19 -179.854 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 324' ' ' ILE . . . . . . . . . . . . . 62.1 mt -62.44 -40.63 88.79 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.222 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.096 -179.868 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 325' ' ' TYR . . . . . 0.422 ' CE2' HD11 ' B' ' 329' ' ' LEU . 35.0 t80 -63.22 -48.64 77.42 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.589 179.767 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 326' ' ' LYS . . . . . . . . . . . . . 41.0 ttmt -60.55 -37.3 80.79 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.706 179.887 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 327' ' ' ALA . . . . . . . . . . . . . . . -62.1 -54.48 40.69 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.133 179.941 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 328' ' ' PHE . . . . . . . . . . . . . 62.7 t80 -53.62 -45.55 70.14 Favored 'General case' 0 C--O 1.234 0.275 0 CA-C-O 121.008 0.432 . . . . 0.0 110.501 179.899 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 329' ' ' LEU . . . . . 0.422 HD11 ' CE2' ' B' ' 325' ' ' TYR . 92.1 mt -59.21 -43.34 92.3 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.868 -0.606 . . . . 0.0 110.645 179.56 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 330' ' ' GLU . . . . . . . . . . . . . 40.6 mt-10 -59.64 -37.79 79.65 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.763 179.713 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 331' ' ' ILE . . . . . . . . . . . . . 76.1 mt -63.47 -56.6 16.08 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.806 179.728 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 332' ' ' LEU . . . . . 0.41 HD23 HD22 ' A' ' 370' ' ' LEU . 7.3 mp -66.28 -19.19 65.75 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.257 -179.984 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 333' ' ' HIS . . . . . . . . . . . . . 34.6 t-80 -71.61 -59.52 2.71 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 121.031 0.443 . . . . 0.0 110.09 179.284 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 334' ' ' THR . . . . . . . . . . . . . 88.7 m -62.41 -29.77 70.74 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.049 179.21 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 335' ' ' TYR . . . . . . . . . . . . . 69.8 t80 -69.14 -41.55 77.18 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 115.729 -0.669 . . . . 0.0 110.488 179.461 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 336' ' ' GLN . . . . . 0.433 ' HB2' ' HB ' ' A' ' 369' ' ' VAL . 26.3 tt0 -68.23 -33.38 74.3 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.693 -179.993 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 337' ' ' LYS . . . . . 0.558 ' O ' ' HG2' ' B' ' 340' ' ' ARG . 1.0 OUTLIER -72.96 -47.95 40.99 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.885 -179.976 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 338' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -65.78 -28.27 68.89 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.034 0.445 . . . . 0.0 109.873 179.434 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 339' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -73.83 -49.39 25.4 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 115.716 -0.675 . . . . 0.0 110.497 179.407 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 340' ' ' ARG . . . . . 0.572 ' HG3' ' N ' ' B' ' 341' ' ' ASN . 14.9 ptm180 -56.46 -51.83 66.97 Favored 'General case' 0 C--N 1.333 -0.138 0 CA-C-O 121.078 0.466 . . . . 0.0 110.742 -179.838 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 341' ' ' ASN . . . . . 0.572 ' N ' ' HG3' ' B' ' 340' ' ' ARG . 2.3 t-20 -58.72 -47.66 83.82 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.62 -0.718 . . . . 0.0 110.732 179.387 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 342' ' ' ALA . . . . . . . . . . . . . . . -63.79 -23.08 67.22 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.022 179.788 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 343' ' ' LYS . . . . . . . . . . . . . 88.0 tttt -78.77 -39.06 37.04 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.799 179.924 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 344' ' ' GLU . . . . . . . . . . . . . 7.0 mm-40 -75.64 -26.97 58.19 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.831 179.829 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 345' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.328 -0.331 0 CA-C-N 116.042 -0.526 . . . . 0.0 111.029 -179.905 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' B' B ' 351' ' ' PRO . . . . . . . . . . . . . 34.9 Cg_exo . . . . . 0 C--O 1.232 0.22 0 CA-C-O 120.866 0.277 . . . . 0.0 112.638 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' B' B ' 352' ' ' ALA . . . . . . . . . . . . . . . -98.27 -73.57 0.61 Allowed 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.453 -179.751 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 353' ' ' LEU . . . . . 0.514 HD22 ' HG2' ' B' ' 357' ' ' GLU . 40.6 mt -99.25 133.32 43.71 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.934 0.397 . . . . 0.0 111.15 -179.778 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 354' ' ' THR . . . . . . . . . . . . . 57.6 p -104.08 -178.31 3.62 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.791 179.842 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 355' ' ' GLU . . . . . . . . . . . . . 41.4 mt-10 -60.65 -39.53 88.67 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.833 0.349 . . . . 0.0 110.786 179.914 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 356' ' ' GLN . . . . . . . . . . . . . 29.1 mm-40 -70.57 -38.82 74.14 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.0 -179.961 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 357' ' ' GLU . . . . . 0.514 ' HG2' HD22 ' B' ' 353' ' ' LEU . 9.6 tp10 -61.55 -49.37 76.94 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.41 -0.359 . . . . 0.0 110.55 179.999 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 358' ' ' VAL . . . . . 0.49 ' O ' HG23 ' B' ' 362' ' ' VAL . 53.3 t -61.42 -56.67 16.29 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.94 179.688 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 359' ' ' TYR . . . . . . . . . . . . . 2.8 t80 -53.96 -30.36 46.47 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.445 -0.343 . . . . 0.0 110.788 -179.802 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 360' ' ' ALA . . . . . . . . . . . . . . . -66.92 -60.42 2.66 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.165 179.821 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 361' ' ' GLN . . . . . . . . . . . . . 47.0 mt-30 -57.46 -39.01 75.41 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.477 179.865 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 362' ' ' VAL . . . . . 0.49 HG23 ' O ' ' B' ' 358' ' ' VAL . 94.2 t -66.53 -33.72 65.34 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.198 179.298 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 363' ' ' ALA . . . . . 0.554 ' HA ' HD21 ' B' ' 373' ' ' LEU . . . -63.85 -43.1 97.16 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.174 179.264 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 364' ' ' ARG . . . . . . . . . . . . . 9.6 mpt_? -80.06 -17.45 52.66 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.811 -0.631 . . . . 0.0 110.161 178.896 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 365' ' ' LEU . . . . . . . . . . . . . 14.1 tp -68.78 -40.76 79.51 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.787 -0.642 . . . . 0.0 111.226 -179.917 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 366' ' ' PHE . . . . . 0.682 ' HB3' ' HB2' ' B' ' 369' ' ' GLN . 32.8 m-85 -106.4 -29.84 9.49 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.438 -0.346 . . . . 0.0 111.393 -179.522 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 367' ' ' LYS . . . . . . . . . . . . . 92.0 mttt 54.01 -96.62 0.06 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.209 -0.451 . . . . 0.0 112.19 179.892 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 368' ' ' ASN . . . . . . . . . . . . . 18.5 m120 -54.75 -46.4 74.32 Favored 'General case' 0 N--CA 1.462 0.139 0 CA-C-N 116.541 -0.299 . . . . 0.0 111.561 -179.192 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 369' ' ' GLN . . . . . 0.682 ' HB2' ' HB3' ' B' ' 366' ' ' PHE . 2.4 mp0 -66.4 97.92 0.45 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.429 -0.35 . . . . 0.0 111.035 -179.778 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 370' ' ' GLU . . . . . . . . . . . . . 43.9 tt0 -93.69 -17.8 22.82 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.97 179.907 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 371' ' ' ASP . . . . . . . . . . . . . 6.9 m-20 -54.78 -45.35 74.27 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.31 -0.404 . . . . 0.0 110.676 179.81 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 372' ' ' LEU . . . . . 0.561 HD13 ' HB3' ' B' ' 369' ' ' GLN . 6.4 mp -64.85 -41.83 95.39 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.505 179.51 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 373' ' ' LEU . . . . . 0.554 HD21 ' HA ' ' B' ' 363' ' ' ALA . 1.1 mp -61.13 -32.2 71.9 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.808 179.842 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 374' ' ' SER . . . . . . . . . . . . . 56.0 m -71.61 -52.13 19.67 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.036 179.28 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 375' ' ' GLU . . . . . . . . . . . . . 7.7 tp10 -58.05 -33.05 68.59 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 115.732 -0.667 . . . . 0.0 109.898 179.279 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 376' ' ' PHE . . . . . . . . . . . . . 54.0 t80 -79.4 -27.81 41.81 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.736 -0.665 . . . . 0.0 109.906 179.263 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 377' ' ' GLY . . . . . . . . . . . . . . . -64.29 -41.2 98.32 Favored Glycine 0 N--CA 1.448 -0.546 0 C-N-CA 120.673 -0.775 . . . . 0.0 111.317 179.076 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 378' ' ' GLN . . . . . . . . . . . . . 46.1 mt-30 -71.63 -23.44 61.69 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.915 0.388 . . . . 0.0 110.144 179.095 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 379' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -62.33 -31.8 72.48 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-N 115.813 -0.631 . . . . 0.0 110.576 179.407 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 380' ' ' LEU . . . . . . . . . . . . . 39.8 mt -61.92 147.57 89.58 Favored Pre-proline 0 C--N 1.33 -0.28 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.714 -179.964 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 381' ' ' PRO . . . . . 0.541 ' HG3' ' HB3' ' A' ' 376' ' ' GLN . 52.1 Cg_exo . . . . . 0 C--N 1.347 0.456 0 C-N-CA 122.391 2.061 . . . . 0.0 112.333 179.946 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 366' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.233 0.223 0 CA-C-O 120.775 0.321 . . . . 0.0 111.618 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 367' ' ' VAL . . . . . . . . . . . . . 35.7 m -54.88 -35.14 32.84 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.925 179.904 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 368' ' ' TYR . . . . . . . . . . . . . 68.7 m-85 -71.04 -24.24 62.31 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.487 179.531 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 369' ' ' VAL . . . . . 0.592 HG22 ' HB2' ' B' ' 336' ' ' GLN . 6.7 t -73.03 -57.73 6.37 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.195 179.383 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 370' ' ' LEU . . . . . 0.478 ' H ' HD22 ' A' ' 370' ' ' LEU . 3.2 mm? -58.56 -37.91 76.74 Favored 'General case' 0 C--O 1.233 0.201 0 CA-C-N 115.763 -0.653 . . . . 0.0 110.443 179.793 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 371' ' ' SER . . . . . 0.641 ' HA ' ' HB2' ' B' ' 303' ' ' GLU . 99.0 p -63.53 -55.87 20.5 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.901 179.928 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 372' ' ' SER . . . . . . . . . . . . . 91.4 p -54.48 -34.37 61.44 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.3 -179.806 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 373' ' ' MET . . . . . . . . . . . . . 56.6 mtt -66.69 -52.26 46.78 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.522 -179.971 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 374' ' ' ALA . . . . . 0.43 ' HB3' ' HB3' ' B' ' 303' ' ' GLU . . . -81.6 -6.74 59.29 Favored 'General case' 0 C--N 1.331 -0.236 0 N-CA-C 112.387 0.514 . . . . 0.0 112.387 -178.973 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 375' ' ' ARG . . . . . . . . . . . . . 18.7 mmt180 -94.82 -42.58 8.63 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.81 0.338 . . . . 0.0 111.164 179.88 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 376' ' ' GLN . . . . . . . . . . . . . 44.2 tt0 . . . . . 0 C--N 1.33 -0.275 0 CA-C-N 116.046 -0.524 . . . . 0.0 111.077 -179.579 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' B' B ' 302' ' ' VAL . . . . . 0.571 HG13 ' H ' ' B' ' 303' ' ' GLU . 2.7 p . . . . . 0 C--O 1.233 0.193 0 N-CA-C 111.761 0.282 . . . . 0.0 111.761 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 303' ' ' GLU . . . . . 0.641 ' HB2' ' HA ' ' A' ' 371' ' ' SER . 0.1 OUTLIER -62.13 -29.71 70.52 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.404 -0.362 . . . . 0.0 111.769 -179.058 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' B' B ' 304' ' ' PHE . . . . . 0.443 ' O ' HD13 ' B' ' 308' ' ' ILE . 67.3 t80 -63.0 -71.33 0.17 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.77 0.319 . . . . 0.0 111.188 -179.648 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 305' ' ' ASN . . . . . . . . . . . . . 27.2 t-20 -53.68 -42.86 68.39 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.582 -179.413 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 306' ' ' HIS . . . . . . . . . . . . . 8.5 m-70 -62.53 -67.7 0.4 Allowed 'General case' 0 C--N 1.331 -0.22 0 N-CA-C 112.083 0.401 . . . . 0.0 112.083 -179.225 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 307' ' ' ALA . . . . . . . . . . . . . . . -49.89 -52.74 30.59 Favored 'General case' 0 N--CA 1.465 0.289 0 N-CA-C 112.331 0.493 . . . . 0.0 112.331 -178.905 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 308' ' ' ILE . . . . . 0.443 HD13 ' O ' ' B' ' 304' ' ' PHE . 1.7 mp -54.93 -58.96 2.79 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-O 120.595 0.236 . . . . 0.0 111.439 -179.617 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 309' ' ' ASN . . . . . . . . . . . . . 14.1 m120 -61.52 -19.4 62.07 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.546 -0.297 . . . . 0.0 111.265 -179.646 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 310' ' ' TYR . . . . . . . . . . . . . 24.0 t80 -74.95 -57.28 4.0 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.416 -0.356 . . . . 0.0 111.326 -179.479 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 311' ' ' VAL . . . . . . . . . . . . . 5.8 m -63.19 -33.69 62.42 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.203 0 CA-C-O 120.87 0.367 . . . . 0.0 110.639 -179.818 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 312' ' ' ASN . . . . . . . . . . . . . 6.3 t30 -70.11 -42.88 72.09 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.585 179.751 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 313' ' ' LYS . . . . . . . . . . . . . 4.5 ttmm -60.23 -49.57 77.11 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.035 179.807 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 314' ' ' ILE . . . . . . . . . . . . . 75.8 mt -64.6 -39.59 86.12 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.658 -179.43 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 315' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -65.51 -40.2 92.72 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.744 0.307 . . . . 0.0 111.095 -179.714 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 316' ' ' ASN . . . . . . . . . . . . . 28.2 t-20 -68.77 -51.35 42.06 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.321 -0.399 . . . . 0.0 111.355 -179.479 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 317' ' ' ARG . . . . . 0.569 HH22 HD11 ' B' ' 372' ' ' LEU . 35.7 mtm180 -59.99 -59.08 6.0 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.384 -0.371 . . . . 0.0 111.071 -179.91 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 318' ' ' PHE . . . . . . . . . . . . . 95.1 m-85 -87.65 40.87 0.96 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.917 -179.97 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 319' ' ' GLN . . . . . . . . . . . . . 63.3 tt0 -59.5 -33.64 71.6 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.972 -179.875 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 320' ' ' GLY . . . . . . . . . . . . . . . -80.27 -14.32 80.53 Favored Glycine 0 N--CA 1.452 -0.256 0 C-N-CA 120.853 -0.689 . . . . 0.0 112.261 179.735 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 321' ' ' GLN . . . . . . . . . . . . . 6.1 tp-100 -118.07 83.29 19.18 Favored Pre-proline 0 C--N 1.329 -0.315 0 CA-C-O 120.528 0.204 . . . . 0.0 110.802 -179.998 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 322' ' ' PRO . . . . . . . . . . . . . 76.5 Cg_endo -77.71 -10.17 17.06 Favored 'Trans proline' 0 C--N 1.346 0.404 0 C-N-CA 122.386 2.058 . . . . 0.0 112.338 179.844 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 323' ' ' ASP . . . . . . . . . . . . . 9.5 m-20 -70.08 -52.78 21.07 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.07 -0.514 . . . . 0.0 111.191 -179.742 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 324' ' ' ILE . . . . . . . . . . . . . 71.3 mt -63.89 -46.34 94.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.425 -0.352 . . . . 0.0 111.246 -179.904 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 325' ' ' TYR . . . . . . . . . . . . . 68.8 t80 -58.15 -58.27 9.21 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.155 179.982 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 326' ' ' LYS . . . . . . . . . . . . . 39.4 ttmt -56.95 -41.47 78.35 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.121 -179.728 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 327' ' ' ALA . . . . . . . . . . . . . . . -57.02 -48.29 78.85 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.907 0.384 . . . . 0.0 111.148 -179.997 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 328' ' ' PHE . . . . . . . . . . . . . 45.7 t80 -58.56 -53.87 53.43 Favored 'General case' 0 C--O 1.237 0.435 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.664 179.931 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 329' ' ' LEU . . . . . . . . . . . . . 10.4 mp -60.82 -26.71 67.51 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.979 -179.844 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 330' ' ' GLU . . . . . . . . . . . . . 28.4 mt-10 -70.38 -42.32 71.89 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.852 0.358 . . . . 0.0 110.207 179.306 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 331' ' ' ILE . . . . . 0.509 HG22 HG22 ' B' ' 358' ' ' VAL . 93.8 mt -61.03 -48.03 90.92 Favored 'Isoleucine or valine' 0 C--O 1.233 0.224 0 CA-C-N 116.126 -0.488 . . . . 0.0 109.956 179.085 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 332' ' ' LEU . . . . . . . . . . . . . 10.8 mp -64.81 -33.66 76.52 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 115.813 -0.631 . . . . 0.0 110.512 179.427 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 333' ' ' HIS . . . . . . . . . . . . . 43.3 t60 -60.83 -54.15 48.67 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.057 -0.52 . . . . 0.0 109.956 179.297 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 334' ' ' THR . . . . . . . . . . . . . 62.8 m -61.35 -30.48 70.54 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.687 -0.688 . . . . 0.0 110.338 179.238 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 335' ' ' TYR . . . . . . . . . . . . . 67.8 t80 -60.62 -53.79 53.19 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.844 -0.617 . . . . 0.0 111.158 179.696 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 336' ' ' GLN . . . . . 0.592 ' HB2' HG22 ' A' ' 369' ' ' VAL . 6.4 tp-100 -65.89 -36.64 83.97 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.417 -0.356 . . . . 0.0 111.029 -179.928 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 337' ' ' LYS . . . . . . . . . . . . . 39.8 ttpt -57.89 -56.65 19.27 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.951 0.405 . . . . 0.0 110.995 179.9 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 338' ' ' GLU . . . . . 0.462 ' HG3' ' HB3' ' B' ' 352' ' ' ALA . 19.5 mm-40 -64.11 -36.25 83.42 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.037 -0.528 . . . . 0.0 111.289 -179.857 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 339' ' ' GLN . . . . . . . . . . . . . 6.5 tp-100 -61.0 -46.07 92.25 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.312 -0.403 . . . . 0.0 110.847 179.968 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 340' ' ' ARG . . . . . . . . . . . . . 96.6 mtt180 -63.87 -51.71 63.32 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.652 179.836 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 341' ' ' ASN . . . . . . . . . . . . . 74.9 m-20 -56.59 -33.44 66.21 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.8 179.706 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 342' ' ' ALA . . . . . . . . . . . . . . . -72.75 -37.05 67.82 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.011 179.885 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 343' ' ' LYS . . . . . . . . . . . . . 64.6 tttp -71.85 -28.07 63.31 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.978 -0.555 . . . . 0.0 110.497 179.803 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 344' ' ' GLU . . . . . . . . . . . . . 17.3 mm-40 -77.9 -41.32 36.95 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.912 -0.585 . . . . 0.0 110.788 179.681 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 345' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.33 -0.269 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.272 179.898 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' B' B ' 351' ' ' PRO . . . . . . . . . . . . . 45.9 Cg_exo . . . . . 0 C--O 1.232 0.189 0 CA-C-O 120.727 0.22 . . . . 0.0 112.325 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' B' B ' 352' ' ' ALA . . . . . 0.462 ' HB3' ' HG3' ' B' ' 338' ' ' GLU . . . -70.11 -76.95 0.09 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.133 179.993 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 353' ' ' LEU . . . . . 0.608 ' HB3' ' HG2' ' B' ' 357' ' ' GLU . 0.3 OUTLIER -107.32 154.85 20.66 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 121.095 0.474 . . . . 0.0 111.726 179.965 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' B' B ' 354' ' ' THR . . . . . . . . . . . . . 59.6 p -114.85 -172.91 2.21 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.871 -0.604 . . . . 0.0 110.767 179.586 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 355' ' ' GLU . . . . . . . . . . . . . 7.8 pt-20 -58.92 -42.73 90.4 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 121.309 0.576 . . . . 0.0 110.072 179.577 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 356' ' ' GLN . . . . . . . . . . . . . 28.9 tt0 -64.56 -38.37 90.77 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.394 -0.821 . . . . 0.0 110.97 179.656 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 357' ' ' GLU . . . . . 0.608 ' HG2' ' HB3' ' B' ' 353' ' ' LEU . 4.6 tp10 -61.21 -50.03 74.75 Favored 'General case' 0 C--N 1.333 -0.138 0 CA-C-O 120.807 0.337 . . . . 0.0 110.506 179.948 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 358' ' ' VAL . . . . . 0.59 ' O ' HG23 ' B' ' 362' ' ' VAL . 93.5 t -59.09 -60.55 2.25 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.069 -0.514 . . . . 0.0 111.014 179.991 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 359' ' ' TYR . . . . . . . . . . . . . 2.2 t80 -52.0 -33.44 38.21 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.521 -0.309 . . . . 0.0 111.014 -179.325 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 360' ' ' ALA . . . . . . . . . . . . . . . -65.58 -60.59 2.76 Favored 'General case' 0 C--O 1.234 0.246 0 CA-C-N 116.502 -0.317 . . . . 0.0 111.242 179.896 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 361' ' ' GLN . . . . . 0.43 HE21 HD13 ' B' ' 331' ' ' ILE . 25.1 mt-30 -58.15 -36.23 72.7 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.98 0.419 . . . . 0.0 110.414 179.923 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 362' ' ' VAL . . . . . 0.59 HG23 ' O ' ' B' ' 358' ' ' VAL . 66.1 t -70.64 -32.05 48.17 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 115.902 -0.59 . . . . 0.0 109.988 179.246 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 363' ' ' ALA . . . . . 0.576 ' HA ' HD21 ' B' ' 373' ' ' LEU . . . -65.16 -38.87 91.96 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 115.914 -0.585 . . . . 0.0 109.876 179.124 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 364' ' ' ARG . . . . . . . . . . . . . 31.8 ttm180 -80.85 -23.41 39.12 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.574 -0.739 . . . . 0.0 110.109 179.011 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 365' ' ' LEU . . . . . . . . . . . . . 8.3 tp -58.12 -24.84 60.22 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.826 -0.625 . . . . 0.0 110.185 179.523 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 366' ' ' PHE . . . . . 0.474 ' HB3' ' HB2' ' B' ' 369' ' ' GLN . 38.1 m-85 -129.07 179.85 5.52 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.742 -0.663 . . . . 0.0 110.423 179.708 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 367' ' ' LYS . . . . . . . . . . . . . 98.4 mttt -138.49 -80.61 0.33 Allowed 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.584 -0.28 . . . . 0.0 111.246 179.904 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 368' ' ' ASN . . . . . . . . . . . . . 28.0 p30 -79.96 7.67 8.5 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.275 -0.421 . . . . 0.0 110.887 -179.886 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 369' ' ' GLN . . . . . 0.709 ' HB3' HD13 ' B' ' 372' ' ' LEU . 44.5 mt-30 -103.38 91.67 4.16 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.022 -0.536 . . . . 0.0 111.436 -179.788 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 370' ' ' GLU . . . . . . . . . . . . . 42.5 mt-10 -94.54 -20.24 19.81 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.875 179.504 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 371' ' ' ASP . . . . . . . . . . . . . 23.5 t70 -59.09 -45.3 91.2 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.69 179.748 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 372' ' ' LEU . . . . . 0.709 HD13 ' HB3' ' B' ' 369' ' ' GLN . 6.6 mp -62.5 -51.82 65.91 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.731 179.593 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 373' ' ' LEU . . . . . 0.576 HD21 ' HA ' ' B' ' 363' ' ' ALA . 1.1 mp -55.88 -37.47 68.87 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.797 -0.638 . . . . 0.0 111.282 -179.749 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 374' ' ' SER . . . . . . . . . . . . . 70.1 m -69.25 -53.39 20.07 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.676 179.754 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 375' ' ' GLU . . . . . . . . . . . . . 39.4 mm-40 -52.56 -36.76 56.5 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.259 179.485 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 376' ' ' PHE . . . . . . . . . . . . . 91.8 t80 -70.24 -41.09 73.99 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.28 179.429 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 377' ' ' GLY . . . . . . . . . . . . . . . -60.2 -32.59 76.93 Favored Glycine 0 N--CA 1.45 -0.379 0 C-N-CA 120.768 -0.729 . . . . 0.0 112.086 179.536 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 378' ' ' GLN . . . . . . . . . . . . . 23.4 mt-30 -60.31 -29.73 69.04 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.798 0.332 . . . . 0.0 110.614 179.656 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 379' ' ' PHE . . . . . . . . . . . . . 75.1 m-85 -69.9 -34.53 73.64 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.789 179.733 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 380' ' ' LEU . . . . . 0.427 ' HA ' ' HD2' ' B' ' 381' ' ' PRO . 90.8 mt -51.51 113.37 3.93 Favored Pre-proline 0 C--N 1.332 -0.164 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.612 179.861 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 381' ' ' PRO . . . . . 0.427 ' HD2' ' HA ' ' B' ' 380' ' ' LEU . 16.0 Cg_endo . . . . . 0 C--N 1.349 0.568 0 C-N-CA 122.312 2.008 . . . . 0.0 112.338 -179.726 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 366' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.232 0.173 0 CA-C-O 120.839 0.352 . . . . 0.0 110.911 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 367' ' ' VAL . . . . . . . . . . . . . 18.9 t -67.6 -21.27 27.28 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.788 179.891 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 368' ' ' TYR . . . . . . . . . . . . . 57.9 t80 -73.25 -48.99 30.26 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.977 -179.898 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 369' ' ' VAL . . . . . . . . . . . . . 14.6 m -70.11 -36.48 68.34 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.448 -179.782 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 370' ' ' LEU . . . . . 0.563 HD23 ' HA ' ' B' ' 307' ' ' ALA . 6.5 mp -69.35 -47.43 64.35 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.427 -0.352 . . . . 0.0 111.052 179.721 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 371' ' ' SER . . . . . 0.478 ' HB3' ' HB3' ' B' ' 303' ' ' GLU . 72.1 m -64.27 -38.84 92.48 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.294 -179.962 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 372' ' ' SER . . . . . . . . . . . . . 67.9 m -71.22 -61.33 1.81 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.475 -179.662 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 373' ' ' MET . . . . . 0.456 ' HB3' ' HD3' ' B' ' 381' ' ' PRO . 73.9 mtm -50.38 -41.06 51.3 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.626 -179.459 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 374' ' ' ALA . . . . . . . . . . . . . . . -73.01 -41.8 63.89 Favored 'General case' 0 C--N 1.331 -0.223 0 N-CA-C 112.008 0.373 . . . . 0.0 112.008 -179.426 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 375' ' ' ARG . . . . . 0.417 ' HB2' ' HG2' ' B' ' 303' ' ' GLU . 30.3 tpt180 -70.29 -23.08 62.8 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.692 0.282 . . . . 0.0 111.395 -179.55 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 376' ' ' GLN . . . . . . . . . . . . . 85.4 mm-40 . . . . . 0 C--N 1.33 -0.258 0 CA-C-N 116.424 -0.353 . . . . 0.0 111.119 -179.768 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' B' B ' 302' ' ' VAL . . . . . . . . . . . . . 15.0 p . . . . . 0 C--O 1.232 0.134 0 CA-C-O 120.845 0.355 . . . . 0.0 111.178 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' B' B ' 303' ' ' GLU . . . . . 0.478 ' HB3' ' HB3' ' A' ' 371' ' ' SER . 44.2 mt-10 -57.88 -78.77 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.974 -0.557 . . . . 0.0 111.647 -179.661 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 304' ' ' PHE . . . . . . . . . . . . . 64.7 m-85 -59.06 -31.55 68.97 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.898 -0.592 . . . . 0.0 111.914 -179.217 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 305' ' ' ASN . . . . . . . . . . . . . 26.9 t-20 -62.95 -71.4 0.16 Allowed 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.672 0.272 . . . . 0.0 111.57 -179.417 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 306' ' ' HIS . . . . . . . . . . . . . 4.3 t-160 -53.99 -41.1 67.55 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.36 -0.382 . . . . 0.0 111.509 -179.116 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 307' ' ' ALA . . . . . 0.563 ' HA ' HD23 ' A' ' 370' ' ' LEU . . . -60.72 -54.99 38.53 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.473 -0.33 . . . . 0.0 111.679 -179.564 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 308' ' ' ILE . . . . . . . . . . . . . 21.2 mm -57.09 -52.34 57.46 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.195 0 CA-C-N 116.662 -0.245 . . . . 0.0 111.407 -179.736 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 309' ' ' ASN . . . . . . . . . . . . . 28.5 m-80 -55.52 -34.65 64.85 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.473 -0.331 . . . . 0.0 111.211 -179.74 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 310' ' ' TYR . . . . . . . . . . . . . 80.6 t80 -66.5 -56.54 10.41 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.424 -0.353 . . . . 0.0 111.109 179.971 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 311' ' ' VAL . . . . . . . . . . . . . 61.5 t -56.14 -49.07 77.98 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.213 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.129 -179.832 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 312' ' ' ASN . . . . . . . . . . . . . 28.0 t-20 -61.99 -39.12 91.12 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.77 179.896 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 313' ' ' LYS . . . . . . . . . . . . . 42.9 tttp -55.12 -61.16 2.5 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.687 179.846 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 314' ' ' ILE . . . . . . . . . . . . . 98.2 mt -62.48 -28.07 44.0 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.077 -0.51 . . . . 0.0 111.177 -179.9 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 315' ' ' LYS . . . . . . . . . . . . . 1.6 tmmt? -67.21 -33.84 76.24 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.356 -0.383 . . . . 0.0 110.973 -179.851 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 316' ' ' ASN . . . . . . . . . . . . . 7.1 t30 -87.56 -50.45 6.51 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.454 -179.76 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 317' ' ' ARG . . . . . . . . . . . . . 29.3 mmm180 -57.75 -57.49 12.53 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.088 -179.728 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 318' ' ' PHE . . . . . . . . . . . . . 44.0 m-85 -88.41 39.54 0.91 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.944 -179.913 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 319' ' ' GLN . . . . . . . . . . . . . 9.0 tt0 -65.74 -18.04 65.05 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.594 179.815 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 320' ' ' GLY . . . . . . . . . . . . . . . -91.82 -9.62 62.39 Favored Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.845 -0.693 . . . . 0.0 112.547 -179.979 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 321' ' ' GLN . . . . . 0.587 ' N ' HE21 ' B' ' 321' ' ' GLN . 0.0 OUTLIER -112.42 88.06 10.37 Favored Pre-proline 0 C--N 1.33 -0.25 0 CA-C-O 120.582 0.23 . . . . 0.0 110.877 179.777 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' B' B ' 322' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_endo -77.35 -33.6 2.44 Favored 'Trans proline' 0 C--N 1.347 0.473 0 C-N-CA 122.537 2.158 . . . . 0.0 112.414 -179.976 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 323' ' ' ASP . . . . . . . . . . . . . 5.2 m-20 -65.46 -56.26 13.43 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.13 -0.487 . . . . 0.0 111.167 -179.761 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 324' ' ' ILE . . . . . . . . . . . . . 53.3 mt -59.28 -53.27 50.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.455 -179.713 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 325' ' ' TYR . . . . . 0.458 ' CE2' HD11 ' B' ' 329' ' ' LEU . 16.8 t80 -54.01 -47.07 71.89 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.886 -179.832 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 326' ' ' LYS . . . . . . . . . . . . . 61.7 tttm -60.09 -40.8 90.86 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.879 -179.953 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 327' ' ' ALA . . . . . . . . . . . . . . . -59.02 -53.02 63.14 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.157 -179.88 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 328' ' ' PHE . . . . . . . . . . . . . 84.0 t80 -54.66 -52.36 62.57 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.785 179.962 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 329' ' ' LEU . . . . . 0.458 HD11 ' CE2' ' B' ' 325' ' ' TYR . 77.3 mt -55.09 -39.17 69.03 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.986 -179.891 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 330' ' ' GLU . . . . . . . . . . . . . 16.4 mm-40 -63.81 -39.47 94.31 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.782 179.884 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 331' ' ' ILE . . . . . . . . . . . . . 90.4 mt -61.36 -45.71 98.06 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.17 0 CA-C-N 116.31 -0.405 . . . . 0.0 110.402 179.278 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 332' ' ' LEU . . . . . . . . . . . . . 7.7 mp -64.74 -34.7 78.93 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.867 179.533 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 333' ' ' HIS . . . . . . . . . . . . . 59.7 t-80 -62.09 -49.35 76.27 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.994 0.426 . . . . 0.0 110.111 179.502 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 334' ' ' THR . . . . . . . . . . . . . 53.1 m -63.09 -39.37 94.5 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.306 179.404 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 335' ' ' TYR . . . . . . . . . . . . . 55.7 t80 -62.72 -32.74 73.91 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.822 -0.626 . . . . 0.0 110.097 179.356 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 336' ' ' GLN . . . . . . . . . . . . . 8.8 tt0 -70.43 -45.5 65.74 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.593 -0.731 . . . . 0.0 110.64 179.808 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 337' ' ' LYS . . . . . . . . . . . . . 41.4 ttmt -60.88 -40.5 93.24 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.055 179.976 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 338' ' ' GLU . . . . . . . . . . . . . 20.8 mm-40 -67.29 -49.07 65.7 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.447 -179.753 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 339' ' ' GLN . . . . . . . . . . . . . 15.8 mm100 -61.06 -47.36 86.72 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.527 -0.306 . . . . 0.0 111.211 -179.85 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 340' ' ' ARG . . . . . . . . . . . . . 82.7 mtp180 -58.7 -51.98 67.66 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.209 -179.866 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 341' ' ' ASN . . . . . . . . . . . . . 5.6 t30 -59.76 -37.93 80.41 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.063 -179.751 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 342' ' ' ALA . . . . . . . . . . . . . . . -65.39 -35.74 81.87 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.043 179.938 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 343' ' ' LYS . . . . . . . . . . . . . 60.1 tttm -71.83 -38.59 70.13 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.923 179.976 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 344' ' ' GLU . . . . . . . . . . . . . 46.7 mt-10 -73.08 -28.51 62.34 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.145 -179.885 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 345' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.33 -0.275 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.146 -179.88 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' B' B ' 351' ' ' PRO . . . . . . . . . . . . . 31.7 Cg_exo . . . . . 0 C--O 1.231 0.154 0 CA-C-O 120.778 0.241 . . . . 0.0 112.425 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' B' B ' 352' ' ' ALA . . . . . . . . . . . . . . . -105.33 -71.17 0.75 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.38 -179.83 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 353' ' ' LEU . . . . . 0.424 ' HG ' ' HG2' ' B' ' 357' ' ' GLU . 7.3 mp -85.05 126.65 33.74 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 121.048 0.451 . . . . 0.0 111.332 -179.779 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 354' ' ' THR . . . . . 0.513 ' H ' ' HB2' ' B' ' 357' ' ' GLU . 81.4 p -111.61 -175.76 2.78 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.738 -0.664 . . . . 0.0 110.564 179.43 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 355' ' ' GLU . . . . . . . . . . . . . 8.9 pt-20 -53.06 -44.9 67.83 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.894 0.378 . . . . 0.0 110.933 179.861 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 356' ' ' GLN . . . . . . . . . . . . . 35.9 tt0 -69.53 -34.57 74.44 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.045 -0.525 . . . . 0.0 111.212 -179.701 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 357' ' ' GLU . . . . . 0.513 ' HB2' ' H ' ' B' ' 354' ' ' THR . 4.8 tp10 -60.28 -55.66 30.99 Favored 'General case' 0 C--O 1.233 0.203 0 CA-C-O 120.752 0.311 . . . . 0.0 110.655 -179.849 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 358' ' ' VAL . . . . . 0.555 ' O ' HG23 ' B' ' 362' ' ' VAL . 69.9 t -60.92 -54.51 34.34 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.872 179.825 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 359' ' ' TYR . . . . . . . . . . . . . 1.2 t80 -52.05 -34.36 43.09 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.774 0.321 . . . . 0.0 110.911 -179.661 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 360' ' ' ALA . . . . . . . . . . . . . . . -66.94 -60.43 2.65 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.357 -179.913 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 361' ' ' GLN . . . . . . . . . . . . . 49.1 mt-30 -55.52 -41.51 73.24 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.992 -179.949 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 362' ' ' VAL . . . . . 0.555 HG23 ' O ' ' B' ' 358' ' ' VAL . 50.1 t -67.59 -35.37 72.8 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.545 179.703 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 363' ' ' ALA . . . . . . . . . . . . . . . -62.06 -40.92 97.42 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.464 179.562 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 364' ' ' ARG . . . . . . . . . . . . . 67.3 ttt180 -81.34 -22.61 38.33 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.886 -0.597 . . . . 0.0 110.444 179.544 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 365' ' ' LEU . . . . . . . . . . . . . 6.4 tp -64.08 -23.14 67.21 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.75 179.989 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 366' ' ' PHE . . . . . . . . . . . . . 84.2 m-85 -125.72 165.72 18.09 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.643 179.811 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 367' ' ' LYS . . . . . . . . . . . . . 63.3 mttp -128.38 -77.32 0.56 Allowed 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.352 -0.386 . . . . 0.0 111.016 -179.859 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 368' ' ' ASN . . . . . . . . . . . . . 38.5 m-80 -85.17 7.9 20.21 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.847 179.951 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 369' ' ' GLN . . . . . . . . . . . . . 14.7 mm100 -112.22 56.33 0.66 Allowed 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.065 -179.842 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 370' ' ' GLU . . . . . . . . . . . . . 6.3 tm-20 -69.0 -23.23 64.08 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.511 179.753 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 371' ' ' ASP . . . . . . . . . . . . . 13.1 m-20 -52.66 -32.64 43.26 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.866 179.949 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 372' ' ' LEU . . . . . . . . . . . . . 78.1 mt -73.53 -35.74 65.59 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.68 179.717 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 373' ' ' LEU . . . . . . . . . . . . . 48.8 mt -65.5 -38.59 90.15 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.441 179.75 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 374' ' ' SER . . . . . . . . . . . . . 87.7 p -70.48 -54.45 12.21 Favored 'General case' 0 C--O 1.234 0.256 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.608 179.559 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 375' ' ' GLU . . . . . . . . . . . . . 16.4 mm-40 -53.24 -39.65 63.98 Favored 'General case' 0 C--N 1.333 -0.144 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.292 179.451 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 376' ' ' PHE . . . . . . . . . . . . . 88.4 t80 -69.29 -36.44 77.04 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.042 -0.526 . . . . 0.0 109.795 179.087 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 377' ' ' GLY . . . . . . . . . . . . . . . -61.87 -31.0 76.79 Favored Glycine 0 N--CA 1.448 -0.512 0 C-N-CA 120.896 -0.669 . . . . 0.0 111.607 179.234 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 378' ' ' GLN . . . . . . . . . . . . . 23.4 mt-30 -58.51 -32.0 68.42 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.836 0.35 . . . . 0.0 110.287 179.252 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 379' ' ' PHE . . . . . . . . . . . . . 97.6 m-85 -75.62 -31.0 59.71 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.221 179.244 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 380' ' ' LEU . . . . . . . . . . . . . 5.7 tp -59.05 127.67 84.05 Favored Pre-proline 0 C--N 1.328 -0.364 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.654 -179.97 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 381' ' ' PRO . . . . . 0.456 ' HD3' ' HB3' ' A' ' 373' ' ' MET . 51.4 Cg_exo . . . . . 0 C--N 1.348 0.514 0 C-N-CA 122.348 2.032 . . . . 0.0 112.322 -179.71 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 366' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.233 0.191 0 N-CA-C 111.811 0.3 . . . . 0.0 111.811 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 367' ' ' VAL . . . . . . . . . . . . . 20.8 m -65.35 -37.93 81.3 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 CA-C-N 116.465 -0.334 . . . . 0.0 111.558 -179.515 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 368' ' ' TYR . . . . . . . . . . . . . 80.4 t80 -68.75 -53.02 24.36 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.355 -0.384 . . . . 0.0 111.539 -179.422 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 369' ' ' VAL . . . . . 0.578 HG11 ' HB3' ' B' ' 332' ' ' LEU . 5.1 p -57.62 -50.2 78.12 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.203 0 CA-C-N 116.611 -0.268 . . . . 0.0 111.513 -179.58 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 370' ' ' LEU . . . . . 0.531 ' HB3' ' HB2' ' B' ' 307' ' ' ALA . 8.1 mp -63.55 -35.73 81.46 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.689 0.28 . . . . 0.0 111.22 -179.866 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 371' ' ' SER . . . . . 0.527 ' HA ' ' HB2' ' B' ' 303' ' ' GLU . 34.6 t -62.41 -61.78 2.21 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 120.828 0.347 . . . . 0.0 111.107 179.85 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 372' ' ' SER . . . . . . . . . . . . . 40.4 t -62.43 -25.6 68.05 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.283 -179.515 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 373' ' ' MET . . . . . . . . . . . . . 56.0 ttm -66.38 -52.14 49.91 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.318 -0.401 . . . . 0.0 111.492 -179.628 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 374' ' ' ALA . . . . . . . . . . . . . . . -88.06 -8.86 54.93 Favored 'General case' 0 C--N 1.33 -0.281 0 N-CA-C 112.419 0.526 . . . . 0.0 112.419 -179.051 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 375' ' ' ARG . . . . . . . . . . . . . 10.4 ttp180 -94.09 -30.14 14.82 Favored 'General case' 0 C--N 1.33 -0.268 0 C-N-CA 120.962 -0.295 . . . . 0.0 111.515 -179.855 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 376' ' ' GLN . . . . . . . . . . . . . 24.0 tp60 . . . . . 0 C--N 1.33 -0.246 0 CA-C-O 120.615 0.245 . . . . 0.0 111.004 -179.837 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' B' B ' 302' ' ' VAL . . . . . 0.623 HG23 ' H ' ' B' ' 303' ' ' GLU . 3.3 m . . . . . 0 C--O 1.233 0.232 0 CA-C-O 120.735 0.302 . . . . 0.0 111.541 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 303' ' ' GLU . . . . . 0.623 ' H ' HG23 ' B' ' 302' ' ' VAL . 0.0 OUTLIER -59.67 -16.0 23.34 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.412 -0.358 . . . . 0.0 111.073 -179.791 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' B' B ' 304' ' ' PHE . . . . . . . . . . . . . 82.3 t80 -64.13 -75.64 0.08 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.519 179.786 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 305' ' ' ASN . . . . . . . . . . . . . 25.7 t-20 -61.49 -29.44 69.98 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.995 -179.92 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 306' ' ' HIS . . . . . . . . . . . . . 2.3 m-70 -62.36 -69.33 0.26 Allowed 'General case' 0 C--O 1.233 0.202 0 CA-C-N 116.41 -0.359 . . . . 0.0 111.494 179.875 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 307' ' ' ALA . . . . . 0.531 ' HB2' ' HB3' ' A' ' 370' ' ' LEU . . . -55.56 -42.31 74.5 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.961 -179.217 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 308' ' ' ILE . . . . . . . . . . . . . 97.7 mt -60.34 -63.83 0.7 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.181 0 CA-C-O 120.672 0.272 . . . . 0.0 111.214 -179.853 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 309' ' ' ASN . . . . . . . . . . . . . 2.9 m-20 -54.76 -24.76 23.93 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.321 -0.399 . . . . 0.0 110.704 179.942 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 310' ' ' TYR . . . . . 0.444 ' O ' ' HG3' ' B' ' 313' ' ' LYS . 19.2 t80 -65.7 -57.18 8.67 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.31 179.51 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 311' ' ' VAL . . . . . . . . . . . . . 59.5 t -60.24 -31.05 47.34 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.748 179.557 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 312' ' ' ASN . . . . . . . . . . . . . 51.1 t-20 -66.26 -57.06 8.37 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.97 -0.559 . . . . 0.0 111.58 -179.696 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 313' ' ' LYS . . . . . 0.444 ' HG3' ' O ' ' B' ' 310' ' ' TYR . 0.0 OUTLIER -61.79 -30.56 70.89 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.61 -0.268 . . . . 0.0 111.633 -179.187 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' B' B ' 314' ' ' ILE . . . . . . . . . . . . . 89.3 mt -76.78 -31.69 19.64 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.206 0 CA-C-O 120.878 0.371 . . . . 0.0 110.998 179.542 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 315' ' ' LYS . . . . . . . . . . . . . 23.8 ttmm -78.49 -26.47 46.02 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.298 -179.717 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 316' ' ' ASN . . . . . . . . . . . . . 26.6 t-20 -88.95 -46.08 9.17 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.423 -0.353 . . . . 0.0 111.427 -179.607 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 317' ' ' ARG . . . . . . . . . . . . . 32.0 tpt180 -65.17 -60.41 3.03 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.432 -0.349 . . . . 0.0 111.203 -179.742 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 318' ' ' PHE . . . . . . . . . . . . . 95.4 m-85 -80.94 25.68 0.45 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.242 -0.435 . . . . 0.0 111.27 -179.655 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 319' ' ' GLN . . . . . . . . . . . . . 56.7 tt0 -62.6 -23.88 67.28 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.658 179.775 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 320' ' ' GLY . . . . . . . . . . . . . . . -72.8 -46.08 31.58 Favored Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 120.886 -0.673 . . . . 0.0 112.689 -179.915 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 321' ' ' GLN . . . . . . . . . . . . . 8.4 tt0 -108.0 92.95 9.96 Favored Pre-proline 0 C--N 1.329 -0.301 0 CA-C-O 120.462 0.172 . . . . 0.0 110.828 179.964 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 322' ' ' PRO . . . . . . . . . . . . . 57.9 Cg_endo -71.34 -4.43 14.95 Favored 'Trans proline' 0 C--N 1.348 0.507 0 C-N-CA 122.433 2.089 . . . . 0.0 112.333 179.931 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 323' ' ' ASP . . . . . . . . . . . . . 16.2 t70 -68.97 -56.09 8.87 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.914 179.876 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 324' ' ' ILE . . . . . . . . . . . . . 63.8 mt -60.98 -46.25 96.97 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.938 179.887 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 325' ' ' TYR . . . . . 0.435 ' CE2' HD11 ' B' ' 329' ' ' LEU . 30.0 t80 -57.72 -47.88 81.15 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.989 -0.551 . . . . 0.0 110.887 179.936 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 326' ' ' LYS . . . . . . . . . . . . . 23.6 ttmm -57.3 -52.39 65.52 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.022 -179.977 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 327' ' ' ALA . . . . . . . . . . . . . . . -51.21 -47.13 62.37 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.053 179.964 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 328' ' ' PHE . . . . . . . . . . . . . 59.6 t80 -56.09 -48.71 75.61 Favored 'General case' 0 C--O 1.235 0.296 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.387 179.672 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 329' ' ' LEU . . . . . 0.435 HD11 ' CE2' ' B' ' 325' ' ' TYR . 77.9 mt -58.29 -34.67 70.79 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.844 -0.617 . . . . 0.0 110.813 179.584 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 330' ' ' GLU . . . . . . . . . . . . . 48.1 mt-10 -68.71 -37.07 79.22 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.934 -0.575 . . . . 0.0 110.825 -179.903 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 331' ' ' ILE . . . . . . . . . . . . . 75.8 mt -65.71 -45.28 92.35 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.229 0 CA-C-N 116.38 -0.373 . . . . 0.0 110.697 179.769 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 332' ' ' LEU . . . . . 0.578 ' HB3' HG11 ' A' ' 369' ' ' VAL . 25.0 mt -69.0 -32.44 71.99 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.972 -179.972 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 333' ' ' HIS . . . . . . . . . . . . . 49.7 t60 -66.58 -53.79 30.58 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.927 0.394 . . . . 0.0 110.543 179.649 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 334' ' ' THR . . . . . 0.403 HG22 HD13 ' B' ' 353' ' ' LEU . 89.3 m -62.03 -35.86 79.84 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.825 179.751 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 335' ' ' TYR . . . . . . . . . . . . . 71.7 t80 -64.74 -41.77 95.68 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.511 179.727 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 336' ' ' GLN . . . . . . . . . . . . . 6.8 tt0 -65.9 -38.04 87.68 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.881 -0.599 . . . . 0.0 110.798 179.816 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 337' ' ' LYS . . . . . . . . . . . . . 38.1 ttpt -64.88 -50.3 67.11 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.284 -0.416 . . . . 0.0 111.115 179.941 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 338' ' ' GLU . . . . . . . . . . . . . 21.5 mm-40 -63.3 -35.4 80.25 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.978 -179.854 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 339' ' ' GLN . . . . . . . . . . . . . 28.5 tt0 -64.17 -53.03 55.76 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.669 179.873 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 340' ' ' ARG . . . . . . . . . . . . . 99.1 mtt180 -57.94 -47.07 83.98 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.856 179.819 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 341' ' ' ASN . . . . . . . . . . . . . 49.2 t-20 -56.4 -46.04 80.34 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.481 179.513 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 342' ' ' ALA . . . . . . . . . . . . . . . -66.38 -27.2 67.68 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.064 -0.517 . . . . 0.0 110.707 179.757 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 343' ' ' LYS . . . . . . . . . . . . . 22.3 tptm -71.87 -46.52 57.59 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.809 179.781 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 344' ' ' GLU . . . . . . . . . . . . . 10.9 mm-40 -67.31 -34.84 78.2 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.868 -0.605 . . . . 0.0 110.919 -179.935 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 345' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.304 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.132 179.872 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' B' B ' 351' ' ' PRO . . . . . . . . . . . . . 40.5 Cg_exo . . . . . 0 C--O 1.232 0.184 0 CA-C-O 120.735 0.223 . . . . 0.0 112.053 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' B' B ' 352' ' ' ALA . . . . . . . . . . . . . . . -103.27 -51.5 3.22 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.319 -0.4 . . . . 0.0 111.496 -179.606 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 353' ' ' LEU . . . . . 0.468 ' HG ' ' HG2' ' B' ' 357' ' ' GLU . 7.0 mp -108.87 126.28 52.89 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 121.106 0.479 . . . . 0.0 111.521 -179.529 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 354' ' ' THR . . . . . 0.422 ' H ' ' HB2' ' B' ' 357' ' ' GLU . 40.4 p -111.93 -176.85 3.03 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.703 -0.68 . . . . 0.0 110.382 179.264 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 355' ' ' GLU . . . . . . . . . . . . . 8.4 pt-20 -53.44 -41.71 66.36 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.112 0.482 . . . . 0.0 110.483 179.558 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 356' ' ' GLN . . . . . . . . . . . . . 53.5 tt0 -67.57 -39.36 84.9 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.698 -0.683 . . . . 0.0 110.964 179.904 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 357' ' ' GLU . . . . . 0.468 ' HG2' ' HG ' ' B' ' 353' ' ' LEU . 4.8 tp10 -60.43 -54.07 49.97 Favored 'General case' 0 C--N 1.333 -0.136 0 CA-C-O 120.826 0.346 . . . . 0.0 110.976 -179.895 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 358' ' ' VAL . . . . . 0.553 ' O ' HG23 ' B' ' 362' ' ' VAL . 75.6 t -59.36 -59.63 3.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.104 -179.988 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 359' ' ' TYR . . . . . . . . . . . . . 78.2 t80 -51.04 -31.9 19.94 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.565 -0.289 . . . . 0.0 111.326 -179.466 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 360' ' ' ALA . . . . . . . . . . . . . . . -67.39 -60.37 2.64 Favored 'General case' 0 C--O 1.234 0.285 0 CA-C-O 120.849 0.356 . . . . 0.0 110.987 179.688 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 361' ' ' GLN . . . . . . . . . . . . . 45.1 mt-30 -57.56 -35.25 70.1 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.682 179.948 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 362' ' ' VAL . . . . . 0.553 HG23 ' O ' ' B' ' 358' ' ' VAL . 67.7 t -70.71 -34.7 57.7 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.336 179.456 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 363' ' ' ALA . . . . . 0.589 ' HA ' HD21 ' B' ' 373' ' ' LEU . . . -64.01 -39.42 94.06 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.132 179.212 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 364' ' ' ARG . . . . . . . . . . . . . 80.8 mtp180 -82.37 -22.19 35.58 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.701 -0.682 . . . . 0.0 110.325 179.193 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 365' ' ' LEU . . . . . 0.447 ' HB2' ' HA ' ' B' ' 362' ' ' VAL . 2.4 tp -60.14 -26.98 66.7 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 115.936 -0.574 . . . . 0.0 110.335 179.883 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 366' ' ' PHE . . . . . . . . . . . . . 45.3 m-85 -122.68 -176.29 3.35 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.447 179.659 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 367' ' ' LYS . . . . . 0.459 ' NZ ' ' HB2' ' B' ' 367' ' ' LYS . 0.0 OUTLIER -141.0 -75.95 0.31 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.424 -0.353 . . . . 0.0 110.885 -179.98 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' B' B ' 368' ' ' ASN . . . . . . . . . . . . . 6.6 t30 -81.12 -16.77 52.07 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.528 179.893 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 369' ' ' GLN . . . . . 0.637 ' HB3' HD13 ' B' ' 372' ' ' LEU . 12.7 mm100 -83.69 84.78 7.42 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.866 -179.939 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 370' ' ' GLU . . . . . . . . . . . . . 38.2 tt0 -93.75 -17.88 22.68 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.874 0.369 . . . . 0.0 110.519 179.81 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 371' ' ' ASP . . . . . . . . . . . . . 25.2 t70 -56.81 -40.28 75.69 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.625 179.722 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 372' ' ' LEU . . . . . 0.637 HD13 ' HB3' ' B' ' 369' ' ' GLN . 6.5 mp -65.86 -44.81 84.32 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.597 179.483 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 373' ' ' LEU . . . . . 0.589 HD21 ' HA ' ' B' ' 363' ' ' ALA . 1.3 mp -57.44 -43.33 83.8 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.76 -0.655 . . . . 0.0 111.417 -179.718 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 374' ' ' SER . . . . . . . . . . . . . 80.9 p -69.2 -53.23 21.04 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.959 0.409 . . . . 0.0 110.518 179.818 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 375' ' ' GLU . . . . . . . . . . . . . 40.0 tt0 -59.54 -24.57 63.81 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.969 -0.559 . . . . 0.0 110.509 179.776 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 376' ' ' PHE . . . . . . . . . . . . . 76.0 t80 -83.34 -34.01 25.75 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.12 179.378 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 377' ' ' GLY . . . . . . . . . . . . . . . -67.72 -32.46 78.15 Favored Glycine 0 N--CA 1.449 -0.436 0 C-N-CA 120.812 -0.708 . . . . 0.0 111.867 179.463 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 378' ' ' GLN . . . . . . . . . . . . . 54.7 mt-30 -61.75 -24.63 66.95 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.819 0.342 . . . . 0.0 110.547 179.442 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 379' ' ' PHE . . . . . . . . . . . . . 22.3 m-85 -72.06 -40.36 68.37 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.541 179.663 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 380' ' ' LEU . . . . . . . . . . . . . 75.8 mt -49.64 144.13 9.95 Favored Pre-proline 0 C--N 1.33 -0.256 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.294 179.72 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 381' ' ' PRO . . . . . . . . . . . . . 72.5 Cg_exo . . . . . 0 C--N 1.347 0.465 0 C-N-CA 122.418 2.079 . . . . 0.0 112.417 -179.462 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 366' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.233 0.196 0 CA-C-O 120.793 0.33 . . . . 0.0 110.973 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 367' ' ' VAL . . . . . . . . . . . . . 16.5 m -58.74 -35.62 56.54 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 116.03 -0.532 . . . . 0.0 111.115 179.913 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 368' ' ' TYR . . . . . . . . . . . . . 94.1 m-85 -64.65 -40.85 96.16 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.389 -0.368 . . . . 0.0 110.624 179.745 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 369' ' ' VAL . . . . . 0.585 HG22 ' HB2' ' B' ' 336' ' ' GLN . 21.9 t -63.99 -59.6 4.01 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-N 116.002 -0.544 . . . . 0.0 111.075 -179.897 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 370' ' ' LEU . . . . . 0.506 ' HB2' ' HB1' ' B' ' 307' ' ' ALA . 88.0 mt -57.81 -35.95 71.56 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.999 -0.546 . . . . 0.0 111.413 -179.604 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 371' ' ' SER . . . . . . . . . . . . . 47.3 t -61.83 -60.86 3.02 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.295 -0.412 . . . . 0.0 111.32 -179.558 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 372' ' ' SER . . . . . . . . . . . . . 79.4 p -56.93 -42.95 80.92 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.772 -179.368 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 373' ' ' MET . . . . . . . . . . . . . 90.2 mtp -57.29 -47.37 81.65 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.381 -0.372 . . . . 0.0 111.818 -179.355 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 374' ' ' ALA . . . . . 0.541 ' HB3' ' HB3' ' B' ' 303' ' ' GLU . . . -84.22 -17.93 38.21 Favored 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 112.044 0.387 . . . . 0.0 112.044 -179.341 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 375' ' ' ARG . . . . . . . . . . . . . 29.8 tpt180 -80.39 -26.49 38.52 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.769 0.319 . . . . 0.0 110.787 -179.881 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 376' ' ' GLN . . . . . . . . . . . . . 8.5 tt0 . . . . . 0 C--N 1.33 -0.265 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.132 -179.748 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' B' B ' 302' ' ' VAL . . . . . 0.632 HG23 ' H ' ' B' ' 303' ' ' GLU . 3.9 m . . . . . 0 C--O 1.233 0.223 0 CA-C-O 120.809 0.337 . . . . 0.0 111.353 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 303' ' ' GLU . . . . . 0.632 ' H ' HG23 ' B' ' 302' ' ' VAL . 3.3 mm-40 -69.12 -23.73 64.02 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.611 -179.749 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 304' ' ' PHE . . . . . 0.407 ' O ' HG13 ' B' ' 308' ' ' ILE . 68.9 t80 -67.5 -54.48 19.76 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.188 179.433 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 305' ' ' ASN . . . . . . . . . . . . . 24.6 t-20 -60.29 -48.7 80.61 Favored 'General case' 0 C--O 1.233 0.228 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.471 179.408 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 306' ' ' HIS . . . . . . . . . . . . . 18.5 t-80 -54.72 -42.99 72.18 Favored 'General case' 0 C--O 1.234 0.264 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.24 179.494 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 307' ' ' ALA . . . . . 0.506 ' HB1' ' HB2' ' A' ' 370' ' ' LEU . . . -59.4 -44.98 92.72 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.635 179.548 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 308' ' ' ILE . . . . . 0.407 HG13 ' O ' ' B' ' 304' ' ' PHE . 85.3 mt -54.87 -51.96 47.56 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.215 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.593 179.358 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 309' ' ' ASN . . . . . . . . . . . . . 19.1 m120 -55.48 -38.17 68.78 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.731 179.788 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 310' ' ' TYR . . . . . 0.425 ' O ' ' HG3' ' B' ' 313' ' ' LYS . 15.0 t80 -61.49 -48.49 80.84 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.093 -0.503 . . . . 0.0 111.056 179.785 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 311' ' ' VAL . . . . . . . . . . . . . 40.0 t -62.57 -32.37 55.15 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.224 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.041 179.931 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 312' ' ' ASN . . . . . . . . . . . . . 31.4 t30 -67.68 -55.44 13.21 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.559 -179.652 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 313' ' ' LYS . . . . . 0.425 ' HG3' ' O ' ' B' ' 310' ' ' TYR . 0.0 OUTLIER -59.65 -36.94 77.4 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.382 -0.372 . . . . 0.0 111.784 -179.109 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' B' B ' 314' ' ' ILE . . . . . 0.404 HD11 ' CZ ' ' B' ' 310' ' ' TYR . 68.3 mt -70.27 -40.1 77.53 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.162 0 C-N-CA 120.85 -0.34 . . . . 0.0 110.866 179.601 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 315' ' ' LYS . . . . . . . . . . . . . 12.9 ttpp -61.11 -47.29 86.95 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.324 -179.715 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 316' ' ' ASN . . . . . . . . . . . . . 57.6 t30 -67.51 -50.99 56.33 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.414 -179.329 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 317' ' ' ARG . . . . . . . . . . . . . 6.8 tpm_? -56.18 -61.26 2.52 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.186 -179.571 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 318' ' ' PHE . . . . . . . . . . . . . 66.9 m-85 -88.61 37.58 0.84 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.362 -179.686 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 319' ' ' GLN . . . . . . . . . . . . . 9.0 tt0 -68.66 -28.83 67.22 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.365 -0.38 . . . . 0.0 110.782 179.981 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 320' ' ' GLY . . . . . . . . . . . . . . . -82.84 -14.69 74.78 Favored Glycine 0 N--CA 1.452 -0.289 0 C-N-CA 120.847 -0.692 . . . . 0.0 112.451 179.856 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 321' ' ' GLN . . . . . . . . . . . . . 25.8 mp0 -110.21 88.53 7.29 Favored Pre-proline 0 C--N 1.33 -0.258 0 CA-C-O 120.451 0.167 . . . . 0.0 110.754 179.948 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 322' ' ' PRO . . . . . . . . . . . . . 70.2 Cg_endo -73.89 -30.8 8.84 Favored 'Trans proline' 0 C--N 1.348 0.537 0 C-N-CA 122.374 2.049 . . . . 0.0 112.391 -179.996 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 323' ' ' ASP . . . . . . . . . . . . . 8.7 m-20 -63.7 -50.74 68.0 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.03 -179.884 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 324' ' ' ILE . . . . . . . . . . . . . 58.7 mt -67.03 -49.16 76.11 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.266 -179.798 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 325' ' ' TYR . . . . . 0.403 ' O ' ' HG ' ' B' ' 329' ' ' LEU . 11.3 t80 -52.91 -50.79 63.23 Favored 'General case' 0 C--O 1.234 0.26 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.694 179.956 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 326' ' ' LYS . . . . . 0.463 ' O ' ' HG3' ' B' ' 330' ' ' GLU . 47.5 mttp -57.46 -53.95 52.31 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.774 179.423 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 327' ' ' ALA . . . . . 0.429 ' O ' HG13 ' B' ' 331' ' ' ILE . . . -46.31 -49.16 17.9 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.36 -179.935 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 328' ' ' PHE . . . . . . . . . . . . . 70.8 t80 -57.46 -55.26 37.09 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.747 179.844 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 329' ' ' LEU . . . . . 0.403 ' HG ' ' O ' ' B' ' 325' ' ' TYR . 62.1 mt -58.65 -26.97 64.31 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.723 179.853 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 330' ' ' GLU . . . . . 0.463 ' HG3' ' O ' ' B' ' 326' ' ' LYS . 45.5 mt-10 -73.91 -36.5 64.72 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.409 179.583 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 331' ' ' ILE . . . . . 0.429 HG13 ' O ' ' B' ' 327' ' ' ALA . 91.7 mt -64.44 -50.5 75.91 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.204 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.135 179.235 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 332' ' ' LEU . . . . . . . . . . . . . 8.9 mp -65.58 -34.33 77.99 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.58 179.411 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 333' ' ' HIS . . . . . . . . . . . . . 50.2 t-80 -59.96 -57.41 13.0 Favored 'General case' 0 C--O 1.233 0.216 0 CA-C-O 120.975 0.417 . . . . 0.0 110.312 179.155 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 334' ' ' THR . . . . . . . . . . . . . 58.0 m -59.18 -33.13 70.58 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.855 -0.611 . . . . 0.0 110.555 179.421 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 335' ' ' TYR . . . . . . . . . . . . . 59.3 t80 -59.84 -51.46 69.62 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.732 179.883 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 336' ' ' GLN . . . . . 0.585 ' HB2' HG22 ' A' ' 369' ' ' VAL . 0.0 OUTLIER -62.33 -40.51 96.58 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.605 179.87 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' B' B ' 337' ' ' LYS . . . . . . . . . . . . . 25.0 ttmm -57.19 -47.82 80.29 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.747 179.712 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 338' ' ' GLU . . . . . 0.442 ' HG3' ' HB3' ' B' ' 352' ' ' ALA . 22.5 mm-40 -64.92 -37.58 88.12 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.795 179.797 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 339' ' ' GLN . . . . . . . . . . . . . 59.1 tp60 -61.7 -41.58 97.78 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.465 179.751 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 340' ' ' ARG . . . . . . . . . . . . . 72.6 mtp180 -64.17 -52.9 56.77 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.335 179.462 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 341' ' ' ASN . . . . . . . . . . . . . 3.2 m-20 -56.93 -31.01 64.51 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.002 -0.544 . . . . 0.0 110.276 179.237 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 342' ' ' ALA . . . . . . . . . . . . . . . -70.19 -40.25 74.75 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.581 179.453 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 343' ' ' LYS . . . . . . . . . . . . . 59.7 tttm -70.78 -28.74 64.89 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.723 179.62 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 344' ' ' GLU . . . . . . . . . . . . . 20.1 mm-40 -79.27 -33.6 43.32 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.105 -179.776 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 345' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.295 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.379 -179.825 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' B' B ' 351' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_exo . . . . . 0 C--O 1.232 0.2 0 CA-C-O 120.736 0.223 . . . . 0.0 112.258 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' B' B ' 352' ' ' ALA . . . . . 0.442 ' HB3' ' HG3' ' B' ' 338' ' ' GLU . . . -67.05 -55.03 16.07 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.389 -179.64 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 353' ' ' LEU . . . . . 0.531 HD22 ' HG2' ' B' ' 357' ' ' GLU . 22.0 mt -106.12 130.92 53.92 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.86 0.362 . . . . 0.0 111.192 -179.709 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 354' ' ' THR . . . . . . . . . . . . . 73.8 p -113.79 -170.63 1.74 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.905 179.69 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 355' ' ' GLU . . . . . . . . . . . . . 37.5 mt-10 -60.77 -44.3 96.94 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.97 179.912 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 356' ' ' GLN . . . . . . . . . . . . . 27.7 mm-40 -68.17 -38.18 81.8 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.028 -0.533 . . . . 0.0 111.335 -179.661 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 357' ' ' GLU . . . . . 0.531 ' HG2' HD22 ' B' ' 353' ' ' LEU . 8.8 tp10 -63.05 -54.37 39.17 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.535 -0.302 . . . . 0.0 111.018 -179.714 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 358' ' ' VAL . . . . . 0.48 ' O ' HG23 ' B' ' 362' ' ' VAL . 54.2 t -59.07 -54.05 39.48 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 116.449 -0.341 . . . . 0.0 110.909 179.817 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 359' ' ' TYR . . . . . . . . . . . . . 72.8 t80 -54.66 -32.86 59.87 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.467 -0.333 . . . . 0.0 110.885 -179.819 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 360' ' ' ALA . . . . . . . . . . . . . . . -68.03 -59.58 3.15 Favored 'General case' 0 C--N 1.332 -0.196 0 CA-C-N 116.376 -0.374 . . . . 0.0 111.012 179.701 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 361' ' ' GLN . . . . . . . . . . . . . 24.4 mt-30 -55.63 -35.21 65.64 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.81 179.822 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 362' ' ' VAL . . . . . 0.48 HG23 ' O ' ' B' ' 358' ' ' VAL . 98.3 t -74.65 -34.49 34.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.509 179.541 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 363' ' ' ALA . . . . . . . . . . . . . . . -64.21 -33.9 76.87 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.059 -0.518 . . . . 0.0 110.232 179.484 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 364' ' ' ARG . . . . . . . . . . . . . 71.1 ttt180 -90.54 -22.03 21.5 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.188 179.374 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 365' ' ' LEU . . . . . . . . . . . . . 18.4 tp -55.17 -31.67 61.55 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.708 -0.678 . . . . 0.0 110.716 179.775 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 366' ' ' PHE . . . . . . . . . . . . . 52.3 m-85 -111.81 179.99 3.86 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.954 -0.567 . . . . 0.0 110.496 179.85 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 367' ' ' LYS . . . . . . . . . . . . . 64.9 tttm -123.44 -75.63 0.6 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.701 0.286 . . . . 0.0 111.313 -179.722 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 368' ' ' ASN . . . . . . . . . . . . . 20.1 m120 -98.91 6.31 46.83 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.254 -179.669 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 369' ' ' GLN . . . . . 0.559 ' HB3' HD13 ' B' ' 372' ' ' LEU . 21.8 mp0 -100.26 87.8 3.53 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.38 -0.373 . . . . 0.0 110.754 179.842 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 370' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -93.56 -16.37 24.48 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.749 179.962 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 371' ' ' ASP . . . . . . . . . . . . . 17.4 t70 -55.96 -37.15 68.64 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.766 179.856 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 372' ' ' LEU . . . . . 0.559 HD13 ' HB3' ' B' ' 369' ' ' GLN . 6.4 mp -69.98 -36.7 75.38 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.307 179.945 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 373' ' ' LEU . . . . . . . . . . . . . 24.4 mt -65.1 -38.27 90.16 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.442 -0.344 . . . . 0.0 110.26 179.811 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 374' ' ' SER . . . . . . . . . . . . . 57.9 m -69.15 -53.31 20.82 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.477 179.359 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 375' ' ' GLU . . . . . . . . . . . . . 22.6 mm-40 -54.21 -44.39 71.58 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.305 179.638 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 376' ' ' PHE . . . . . . . . . . . . . 70.5 t80 -68.8 -33.81 74.47 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.063 179.232 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 377' ' ' GLY . . . . . . . . . . . . . . . -61.11 -34.84 89.52 Favored Glycine 0 N--CA 1.451 -0.364 0 C-N-CA 120.78 -0.724 . . . . 0.0 111.663 179.38 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 378' ' ' GLN . . . . . . . . . . . . . 27.1 mt-30 -62.14 -31.22 71.67 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.692 0.282 . . . . 0.0 110.596 179.427 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 379' ' ' PHE . . . . . . . . . . . . . 60.7 m-85 -66.42 -31.1 71.65 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.773 179.74 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 380' ' ' LEU . . . . . . . . . . . . . 97.6 mt -60.48 134.52 91.45 Favored Pre-proline 0 C--N 1.329 -0.322 0 CA-C-N 116.356 -0.384 . . . . 0.0 110.657 179.91 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 381' ' ' PRO . . . . . . . . . . . . . 79.6 Cg_exo . . . . . 0 C--N 1.351 0.673 0 C-N-CA 122.638 2.226 . . . . 0.0 112.933 -179.641 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 366' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.234 0.259 0 CA-C-O 121.015 0.436 . . . . 0.0 110.7 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 367' ' ' VAL . . . . . . . . . . . . . 39.4 t -55.97 -34.47 38.05 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.214 0 CA-C-N 115.733 -0.667 . . . . 0.0 110.653 179.495 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 368' ' ' TYR . . . . . . . . . . . . . 62.6 t80 -65.66 -37.14 85.68 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.561 179.735 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 369' ' ' VAL . . . . . 0.495 HG22 ' HB2' ' B' ' 336' ' ' GLN . 11.1 t -65.89 -56.52 14.49 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.201 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.511 179.671 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 370' ' ' LEU . . . . . . . . . . . . . 95.0 mt -61.64 -31.74 71.85 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.817 -0.629 . . . . 0.0 110.939 179.958 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 371' ' ' SER . . . . . 0.447 ' HA ' ' HB2' ' B' ' 303' ' ' GLU . 40.7 t -64.76 -52.76 55.26 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.299 -0.409 . . . . 0.0 110.379 179.517 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 372' ' ' SER . . . . . . . . . . . . . 50.3 m -60.59 -32.01 71.13 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.33 179.517 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 373' ' ' MET . . . . . 0.506 ' HG3' ' HD3' ' B' ' 381' ' ' PRO . 54.9 tpp -61.35 -60.63 3.43 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.804 -0.635 . . . . 0.0 110.837 179.622 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 374' ' ' ALA . . . . . . . . . . . . . . . -60.12 -34.17 73.14 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.596 -179.641 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 375' ' ' ARG . . . . . . . . . . . . . 18.9 tpt180 -75.76 -22.43 56.48 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.47 -0.332 . . . . 0.0 110.882 -179.688 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 376' ' ' GLN . . . . . . . . . . . . . 6.2 tp-100 . . . . . 0 C--N 1.331 -0.235 0 CA-C-O 121.029 0.442 . . . . 0.0 110.431 179.566 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' B' B ' 302' ' ' VAL . . . . . . . . . . . . . 27.7 m . . . . . 0 C--O 1.232 0.148 0 CA-C-O 120.835 0.35 . . . . 0.0 111.596 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' B' B ' 303' ' ' GLU . . . . . 0.447 ' HB2' ' HA ' ' A' ' 371' ' ' SER . 5.1 pt-20 -69.42 -46.98 65.51 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.533 -179.505 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 304' ' ' PHE . . . . . . . . . . . . . 89.4 m-85 -64.36 -49.2 72.59 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.776 0.322 . . . . 0.0 111.309 -179.629 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 305' ' ' ASN . . . . . . . . . . . . . 3.4 t-20 -59.89 -53.17 61.05 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.768 -179.322 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 306' ' ' HIS . . . . . 0.41 ' O ' ' HB2' ' B' ' 310' ' ' TYR . 10.5 m-70 -60.7 -56.48 20.79 Favored 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 111.781 0.289 . . . . 0.0 111.781 -179.33 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 307' ' ' ALA . . . . . . . . . . . . . . . -51.9 -61.09 2.48 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 112.16 0.429 . . . . 0.0 112.16 -179.286 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 308' ' ' ILE . . . . . . . . . . . . . 46.9 mm -53.0 -56.68 6.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.504 -0.316 . . . . 0.0 111.841 -179.258 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 309' ' ' ASN . . . . . . . . . . . . . 2.7 t-20 -57.55 -29.22 64.22 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.483 -0.326 . . . . 0.0 111.482 -179.573 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 310' ' ' TYR . . . . . 0.451 ' O ' ' HG3' ' B' ' 313' ' ' LYS . 11.8 t80 -69.34 -59.94 2.67 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.359 -0.382 . . . . 0.0 111.266 -179.451 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 311' ' ' VAL . . . . . . . . . . . . . 36.2 t -62.17 -26.79 41.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.289 -179.483 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 312' ' ' ASN . . . . . . . . . . . . . 6.8 t30 -72.46 -56.68 5.03 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.477 -179.537 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 313' ' ' LYS . . . . . 0.457 ' NZ ' ' HB2' ' B' ' 313' ' ' LYS . 0.0 OUTLIER -61.31 -32.34 72.2 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.38 -0.373 . . . . 0.0 111.551 -179.452 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' B' B ' 314' ' ' ILE . . . . . . . . . . . . . 98.0 mt -76.89 -39.72 30.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.563 -0.29 . . . . 0.0 111.639 -179.74 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 315' ' ' LYS . . . . . 0.408 ' HE3' ' HB3' ' B' ' 315' ' ' LYS . 1.4 tmmt? -65.64 -38.62 89.87 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.522 -0.308 . . . . 0.0 110.937 -179.853 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 316' ' ' ASN . . . . . . . . . . . . . 42.6 t30 -76.31 -51.8 11.24 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.518 -179.466 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 317' ' ' ARG . . . . . . . . . . . . . 19.0 tpp180 -60.27 -62.93 1.5 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.368 -179.6 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 318' ' ' PHE . . . . . . . . . . . . . 66.7 m-85 -86.38 38.43 0.78 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.209 -179.672 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 319' ' ' GLN . . . . . . . . . . . . . 58.1 tt0 -65.54 -29.61 70.26 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.9 179.933 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 320' ' ' GLY . . . . . . . . . . . . . . . -84.82 -2.31 88.62 Favored Glycine 0 N--CA 1.453 -0.23 0 C-N-CA 120.763 -0.732 . . . . 0.0 112.624 -179.732 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 321' ' ' GLN . . . . . . . . . . . . . 24.2 mp0 -109.98 91.73 11.56 Favored Pre-proline 0 C--N 1.33 -0.245 0 CA-C-O 120.502 0.191 . . . . 0.0 110.884 179.944 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 322' ' ' PRO . . . . . . . . . . . . . 97.6 Cg_endo -78.6 -29.03 3.9 Favored 'Trans proline' 0 C--N 1.348 0.511 0 C-N-CA 122.41 2.074 . . . . 0.0 112.59 -179.857 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 323' ' ' ASP . . . . . . . . . . . . . 25.4 t70 -69.15 -46.0 68.66 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.413 -0.358 . . . . 0.0 111.053 -179.829 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 324' ' ' ILE . . . . . . . . . . . . . 75.5 mt -70.87 -42.04 77.26 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.013 179.928 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 325' ' ' TYR . . . . . . . . . . . . . 46.0 t80 -62.96 -50.62 70.06 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.042 -0.527 . . . . 0.0 110.92 179.955 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 326' ' ' LYS . . . . . 0.435 ' NZ ' ' HB3' ' B' ' 326' ' ' LYS . 6.5 ttpm? -61.55 -49.94 74.66 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.101 -179.862 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 327' ' ' ALA . . . . . 0.415 ' HB3' HD11 ' B' ' 365' ' ' LEU . . . -54.33 -47.23 72.73 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.365 -0.379 . . . . 0.0 110.987 179.937 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 328' ' ' PHE . . . . . . . . . . . . . 53.0 t80 -56.5 -51.1 69.79 Favored 'General case' 0 C--O 1.236 0.357 0 CA-C-N 115.969 -0.56 . . . . 0.0 110.633 179.875 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 329' ' ' LEU . . . . . . . . . . . . . 92.8 mt -56.45 -34.54 66.95 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.541 179.534 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 330' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -67.65 -37.89 83.04 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.711 179.652 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 331' ' ' ILE . . . . . . . . . . . . . 79.9 mt -62.96 -51.62 69.64 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.161 0 CA-C-N 116.407 -0.36 . . . . 0.0 110.427 179.552 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 332' ' ' LEU . . . . . . . . . . . . . 17.7 mt -66.87 -26.7 67.02 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.73 179.784 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 333' ' ' HIS . . . . . . . . . . . . . 57.0 t-80 -64.12 -60.02 3.73 Favored 'General case' 0 C--O 1.234 0.256 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.199 179.481 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 334' ' ' THR . . . . . . . . . . . . . 80.0 m -58.94 -37.25 76.28 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.253 179.285 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 335' ' ' TYR . . . . . . . . . . . . . 56.4 t80 -60.59 -36.83 79.51 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.091 179.312 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 336' ' ' GLN . . . . . 0.495 ' HB2' HG22 ' A' ' 369' ' ' VAL . 24.7 tt0 -67.9 -51.44 47.99 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.781 179.771 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 337' ' ' LYS . . . . . . . . . . . . . 39.5 ttpt -51.8 -51.67 54.69 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.14 -179.824 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 338' ' ' GLU . . . . . 0.493 ' HG3' ' HB3' ' B' ' 352' ' ' ALA . 27.2 mm-40 -62.75 -39.86 95.45 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.986 -179.886 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 339' ' ' GLN . . . . . 0.467 ' HG3' ' HE2' ' B' ' 343' ' ' LYS . 8.7 tp-100 -61.45 -39.39 90.67 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 121.023 0.439 . . . . 0.0 110.652 179.718 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 340' ' ' ARG . . . . . . . . . . . . . 64.9 mtp180 -64.1 -54.16 38.37 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.589 179.757 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 341' ' ' ASN . . . . . . . . . . . . . 43.7 t-20 -56.7 -32.42 65.47 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.356 179.555 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 342' ' ' ALA . . . . . . . . . . . . . . . -66.3 -46.6 76.37 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.801 179.75 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 343' ' ' LYS . . . . . 0.467 ' HE2' ' HG3' ' B' ' 339' ' ' GLN . 68.5 mttm -66.53 -29.2 69.23 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.845 179.763 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 344' ' ' GLU . . . . . . . . . . . . . 23.9 mm-40 -69.99 -62.01 1.55 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.085 179.941 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 345' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.305 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.016 179.943 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' B' B ' 351' ' ' PRO . . . . . . . . . . . . . 32.3 Cg_exo . . . . . 0 C--O 1.231 0.127 0 CA-C-O 120.725 0.219 . . . . 0.0 112.074 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' B' B ' 352' ' ' ALA . . . . . 0.493 ' HB3' ' HG3' ' B' ' 338' ' ' GLU . . . -86.2 -55.89 3.71 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.211 179.994 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 353' ' ' LEU . . . . . 0.451 HD22 ' HG2' ' B' ' 357' ' ' GLU . 13.6 mt -91.34 125.33 36.06 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.957 0.408 . . . . 0.0 111.241 -179.854 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 354' ' ' THR . . . . . . . . . . . . . 75.2 p -113.27 -173.44 2.26 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.855 -0.612 . . . . 0.0 110.593 179.668 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 355' ' ' GLU . . . . . . . . . . . . . 7.1 pt-20 -60.61 -41.42 94.75 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.951 0.405 . . . . 0.0 110.613 179.585 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 356' ' ' GLN . . . . . . . . . . . . . 14.5 mm100 -71.61 -38.87 70.79 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.866 -0.607 . . . . 0.0 111.225 -179.98 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 357' ' ' GLU . . . . . 0.451 ' HG2' HD22 ' B' ' 353' ' ' LEU . 9.2 tp10 -60.65 -53.85 52.4 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.518 -0.31 . . . . 0.0 110.851 -179.859 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 358' ' ' VAL . . . . . 0.434 ' O ' HG23 ' B' ' 362' ' ' VAL . 59.8 t -62.52 -50.57 79.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.112 -179.936 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 359' ' ' TYR . . . . . . . . . . . . . 65.4 t80 -58.2 -31.01 66.91 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.63 0.253 . . . . 0.0 111.178 -179.719 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 360' ' ' ALA . . . . . . . . . . . . . . . -69.57 -59.7 2.8 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.369 -0.378 . . . . 0.0 111.044 -179.976 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 361' ' ' GLN . . . . . . . . . . . . . 21.7 mt-30 -56.78 -40.59 76.16 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.579 179.861 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 362' ' ' VAL . . . . . 0.434 HG23 ' O ' ' B' ' 358' ' ' VAL . 74.0 t -66.82 -35.43 74.74 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 115.892 -0.595 . . . . 0.0 110.602 179.708 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 363' ' ' ALA . . . . . 0.643 ' HA ' HD21 ' B' ' 373' ' ' LEU . . . -62.39 -50.2 72.49 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.766 179.742 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 364' ' ' ARG . . . . . . . . . . . . . 57.5 mtp180 -73.54 -21.91 60.24 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.523 179.655 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 365' ' ' LEU . . . . . 0.415 HD11 ' HB3' ' B' ' 327' ' ' ALA . 13.9 tp -61.12 -60.89 3.06 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.86 179.978 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 366' ' ' PHE . . . . . 0.613 ' HB3' ' HB2' ' B' ' 369' ' ' GLN . 47.8 m-85 -74.34 -44.85 50.65 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.989 -179.927 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 367' ' ' LYS . . . . . 0.488 ' C ' ' H ' ' B' ' 369' ' ' GLN . 58.9 tttm 65.37 120.9 0.02 OUTLIER 'General case' 0 N--CA 1.465 0.277 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.706 179.359 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 368' ' ' ASN . . . . . . . . . . . . . 12.1 m120 70.3 -34.04 0.28 Allowed 'General case' 0 N--CA 1.463 0.19 0 CA-C-N 116.048 -0.523 . . . . 0.0 111.31 179.707 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 369' ' ' GLN . . . . . 0.613 ' HB2' ' HB3' ' B' ' 366' ' ' PHE . 15.3 mm100 -66.52 90.57 0.16 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.885 0.374 . . . . 0.0 110.532 179.635 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 370' ' ' GLU . . . . . . . . . . . . . 44.1 mt-10 -90.01 -6.21 55.83 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.996 -0.547 . . . . 0.0 111.012 -179.673 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 371' ' ' ASP . . . . . . . . . . . . . 21.4 t70 -67.09 -47.3 71.63 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.073 0.463 . . . . 0.0 110.258 179.494 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 372' ' ' LEU . . . . . 0.479 ' N ' HD12 ' B' ' 372' ' ' LEU . 5.6 mp -72.82 -40.53 65.71 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.779 -0.646 . . . . 0.0 110.111 179.358 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 373' ' ' LEU . . . . . 0.643 HD21 ' HA ' ' B' ' 363' ' ' ALA . 1.1 mp -62.3 -36.1 81.09 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.605 -0.725 . . . . 0.0 110.61 179.647 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 374' ' ' SER . . . . . . . . . . . . . 92.0 p -71.02 -48.93 50.19 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.086 179.433 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 375' ' ' GLU . . . . . . . . . . . . . 43.3 mt-10 -62.97 -23.15 67.29 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.143 179.011 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 376' ' ' PHE . . . . . . . . . . . . . 76.9 t80 -85.13 -29.05 25.13 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.696 -0.684 . . . . 0.0 110.163 179.529 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 377' ' ' GLY . . . . . . . . . . . . . . . -71.45 -41.89 57.26 Favored Glycine 0 C--N 1.331 0.257 0 C-N-CA 120.836 -0.697 . . . . 0.0 112.006 179.465 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 378' ' ' GLN . . . . . . . . . . . . . 4.3 pt20 -70.69 -28.01 64.44 Favored 'General case' 0 C--N 1.331 -0.196 0 N-CA-C 109.224 -0.658 . . . . 0.0 109.224 179.22 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 379' ' ' PHE . . . . . . . . . . . . . 3.7 t80 -82.34 -22.03 35.74 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 114.926 -1.034 . . . . 0.0 109.744 179.05 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 380' ' ' LEU . . . . . . . . . . . . . 18.8 tp -67.79 141.78 95.16 Favored Pre-proline 0 C--N 1.329 -0.306 0 CA-C-N 115.307 -0.86 . . . . 0.0 110.333 179.483 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 381' ' ' PRO . . . . . 0.506 ' HD3' ' HG3' ' A' ' 373' ' ' MET . 74.0 Cg_exo . . . . . 0 C--N 1.35 0.637 0 C-N-CA 122.187 1.925 . . . . 0.0 112.115 179.911 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 366' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.233 0.191 0 CA-C-O 121.06 0.457 . . . . 0.0 110.81 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 367' ' ' VAL . . . . . . . . . . . . . 23.5 t -65.58 -20.76 27.98 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.697 179.747 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 368' ' ' TYR . . . . . . . . . . . . . 25.7 t80 -71.01 -49.64 42.88 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.017 -179.808 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 369' ' ' VAL . . . . . 0.461 ' HB ' ' HB2' ' B' ' 336' ' ' GLN . 6.5 p -68.46 -44.46 83.2 Favored 'Isoleucine or valine' 0 C--O 1.233 0.217 0 CA-C-N 116.433 -0.349 . . . . 0.0 110.881 179.908 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 370' ' ' LEU . . . . . 0.41 ' N ' HG13 ' A' ' 369' ' ' VAL . 90.4 mt -60.43 -42.34 95.88 Favored 'General case' 0 C--O 1.233 0.236 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.887 179.807 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 371' ' ' SER . . . . . . . . . . . . . 87.6 p -72.64 -34.94 67.63 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.772 179.863 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 372' ' ' SER . . . . . . . . . . . . . 45.8 t -61.14 -42.81 99.23 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.341 -0.39 . . . . 0.0 111.185 -179.679 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 373' ' ' MET . . . . . 0.435 ' HB2' ' HD3' ' B' ' 381' ' ' PRO . 22.4 ptp -76.71 -38.4 54.41 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.432 -0.349 . . . . 0.0 111.722 -179.419 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 374' ' ' ALA . . . . . 0.483 ' HB3' ' OE1' ' B' ' 303' ' ' GLU . . . -78.62 -13.15 59.97 Favored 'General case' 0 C--N 1.33 -0.25 0 N-CA-C 112.015 0.376 . . . . 0.0 112.015 -179.421 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 375' ' ' ARG . . . . . . . . . . . . . 22.3 ttp180 -100.5 -32.62 10.7 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.823 0.345 . . . . 0.0 110.768 179.635 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 376' ' ' GLN . . . . . . . . . . . . . 6.5 tp-100 . . . . . 0 C--N 1.331 -0.238 0 CA-C-N 116.121 -0.491 . . . . 0.0 111.181 -179.94 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' B' B ' 302' ' ' VAL . . . . . . . . . . . . . 15.0 p . . . . . 0 C--O 1.231 0.121 0 CA-C-O 120.814 0.34 . . . . 0.0 111.293 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' B' B ' 303' ' ' GLU . . . . . 0.483 ' OE1' ' HB3' ' A' ' 374' ' ' ALA . 55.3 mm-40 -65.04 -51.13 63.27 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.169 -0.468 . . . . 0.0 111.402 -179.465 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 304' ' ' PHE . . . . . . . . . . . . . 85.6 m-85 -59.99 -57.39 13.07 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.329 -179.815 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 305' ' ' ASN . . . . . . . . . . . . . 6.6 t30 -51.07 -55.16 19.0 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.874 -179.279 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 306' ' ' HIS . . . . . . . . . . . . . 12.2 m-70 -61.24 -64.1 1.07 Allowed 'General case' 0 C--N 1.33 -0.267 0 N-CA-C 112.357 0.503 . . . . 0.0 112.357 -178.947 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 307' ' ' ALA . . . . . . . . . . . . . . . -53.08 -57.13 11.47 Favored 'General case' 0 N--CA 1.464 0.245 0 N-CA-C 112.468 0.544 . . . . 0.0 112.468 -178.736 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 308' ' ' ILE . . . . . . . . . . . . . 87.4 mt -53.58 -53.57 24.5 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 N-CA-C 111.985 0.365 . . . . 0.0 111.985 -179.298 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 309' ' ' ASN . . . . . . . . . . . . . 3.0 t-20 -59.46 -30.44 68.52 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.811 0.338 . . . . 0.0 110.951 -179.706 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 310' ' ' TYR . . . . . . . . . . . . . 74.8 t80 -66.99 -51.57 53.43 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.021 -179.78 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 311' ' ' VAL . . . . . . . . . . . . . 46.2 t -61.19 -52.14 64.89 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.224 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.065 -179.832 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 312' ' ' ASN . . . . . . . . . . . . . 27.6 t-20 -59.37 -34.3 72.24 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.339 -0.392 . . . . 0.0 110.976 -179.951 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 313' ' ' LYS . . . . . . . . . . . . . 39.8 tttp -62.41 -63.14 1.32 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.978 179.957 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 314' ' ' ILE . . . . . . . . . . . . . 97.9 mt -60.28 -27.79 40.35 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.352 -179.792 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 315' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -66.5 -46.34 76.6 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.413 -0.358 . . . . 0.0 110.741 -179.969 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 316' ' ' ASN . . . . . . . . . . . . . 6.7 t30 -72.48 -47.45 48.58 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.264 -179.732 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 317' ' ' ARG . . . . . . . . . . . . . 1.4 tmt_? -62.8 -63.9 1.08 Allowed 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.031 -179.836 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 318' ' ' PHE . . . . . . . . . . . . . 87.0 m-85 -85.11 40.93 0.85 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.121 -0.49 . . . . 0.0 111.043 -179.991 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 319' ' ' GLN . . . . . . . . . . . . . 35.0 tt0 -70.07 -22.61 63.04 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.885 -179.981 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 320' ' ' GLY . . . . . . . . . . . . . . . -86.59 -13.61 67.23 Favored Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.833 -0.699 . . . . 0.0 112.726 -179.793 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 321' ' ' GLN . . . . . . . . . . . . . 22.3 mp0 -110.28 93.41 15.69 Favored Pre-proline 0 C--N 1.329 -0.324 0 CA-C-O 120.416 0.151 . . . . 0.0 110.921 -179.928 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 322' ' ' PRO . . . . . . . . . . . . . 92.1 Cg_endo -79.73 -22.86 7.41 Favored 'Trans proline' 0 C--N 1.348 0.517 0 C-N-CA 122.548 2.165 . . . . 0.0 112.38 179.833 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 323' ' ' ASP . . . . . . . . . . . . . 6.0 m-20 -71.09 -48.01 54.89 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.29 -179.569 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 324' ' ' ILE . . . . . . . . . . . . . 64.0 mt -70.23 -43.07 78.98 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.415 -0.357 . . . . 0.0 111.251 -179.881 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 325' ' ' TYR . . . . . . . . . . . . . 30.8 t80 -62.1 -48.14 81.47 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 120.902 0.382 . . . . 0.0 110.75 179.984 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 326' ' ' LYS . . . . . 0.403 ' O ' ' HG2' ' B' ' 330' ' ' GLU . 87.3 tttt -62.02 -50.11 73.35 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.824 179.896 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 327' ' ' ALA . . . . . 0.412 ' O ' ' HB2' ' B' ' 330' ' ' GLU . . . -54.45 -43.55 71.74 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.185 179.946 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 328' ' ' PHE . . . . . . . . . . . . . 84.5 t80 -59.39 -57.03 14.79 Favored 'General case' 0 C--O 1.235 0.331 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.569 179.927 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 329' ' ' LEU . . . . . . . . . . . . . 91.3 mt -56.85 -28.52 61.78 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.428 179.658 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 330' ' ' GLU . . . . . 0.412 ' HB2' ' O ' ' B' ' 327' ' ' ALA . 22.5 mm-40 -66.52 -44.47 82.37 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.175 179.217 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 331' ' ' ILE . . . . . . . . . . . . . 71.1 mt -61.33 -39.8 83.94 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.12 0 N-CA-C 109.78 -0.452 . . . . 0.0 109.78 178.828 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 332' ' ' LEU . . . . . . . . . . . . . 1.1 mm? -66.61 -36.22 82.07 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.533 -0.758 . . . . 0.0 110.646 179.5 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 333' ' ' HIS . . . . . . . . . . . . . 47.2 t-80 -67.52 -56.44 9.51 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.671 179.731 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 334' ' ' THR . . . . . . . . . . . . . 35.0 m -59.36 -37.78 78.74 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.805 179.697 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 335' ' ' TYR . . . . . . . . . . . . . 32.2 t80 -60.35 -48.34 82.17 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.473 179.554 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 336' ' ' GLN . . . . . 0.461 ' HB2' ' HB ' ' A' ' 369' ' ' VAL . 54.8 tp60 -60.94 -40.22 92.47 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.477 179.535 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 337' ' ' LYS . . . . . 0.459 ' NZ ' ' HB3' ' B' ' 337' ' ' LYS . 4.7 ttpm? -60.11 -47.7 84.8 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.643 179.683 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 338' ' ' GLU . . . . . 0.428 ' HG3' ' HB3' ' B' ' 352' ' ' ALA . 61.6 mm-40 -58.78 -42.02 88.03 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.627 179.572 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 339' ' ' GLN . . . . . . . . . . . . . 29.1 tt0 -61.94 -44.79 96.03 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.707 179.844 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 340' ' ' ARG . . . . . 0.403 ' HE ' HE21 ' B' ' 336' ' ' GLN . 99.7 mtt180 -57.05 -53.78 54.25 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.673 179.825 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 341' ' ' ASN . . . . . . . . . . . . . 45.5 t-20 -55.52 -39.89 71.1 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.557 179.86 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 342' ' ' ALA . . . . . . . . . . . . . . . -60.23 -41.99 94.3 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.843 179.863 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 343' ' ' LYS . . . . . . . . . . . . . 14.5 mptt -74.7 -27.19 60.29 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.847 179.706 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 344' ' ' GLU . . . . . . . . . . . . . 20.2 mm-40 -67.94 -40.05 83.37 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.69 179.556 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 345' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.331 -0.236 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.008 179.748 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' B' B ' 351' ' ' PRO . . . . . . . . . . . . . 58.7 Cg_exo . . . . . 0 C--O 1.23 0.12 0 CA-C-O 120.779 0.241 . . . . 0.0 112.297 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' B' B ' 352' ' ' ALA . . . . . 0.428 ' HB3' ' HG3' ' B' ' 338' ' ' GLU . . . -68.12 -23.17 64.87 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.894 179.848 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 353' ' ' LEU . . . . . 0.522 ' HG ' ' HG2' ' B' ' 357' ' ' GLU . 4.7 mp -131.93 124.11 28.77 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.119 -0.492 . . . . 0.0 111.225 179.848 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 354' ' ' THR . . . . . . . . . . . . . 75.6 p -114.76 -170.73 1.8 Allowed 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.716 -0.675 . . . . 0.0 109.594 178.66 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 355' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 -57.87 -35.98 71.71 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.093 0.473 . . . . 0.0 110.063 179.271 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 356' ' ' GLN . . . . . . . . . . . . . 5.9 tp-100 -73.1 -42.6 62.78 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 115.719 -0.673 . . . . 0.0 111.127 179.97 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 357' ' ' GLU . . . . . 0.522 ' HG2' ' HG ' ' B' ' 353' ' ' LEU . 9.4 tp10 -58.97 -56.14 26.14 Favored 'General case' 0 C--O 1.232 0.176 0 CA-C-N 116.479 -0.328 . . . . 0.0 110.893 -179.779 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 358' ' ' VAL . . . . . 0.509 ' O ' HG23 ' B' ' 362' ' ' VAL . 47.1 t -59.61 -55.1 26.11 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.115 179.912 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 359' ' ' TYR . . . . . . . . . . . . . 67.2 t80 -54.92 -29.71 56.86 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.566 -0.288 . . . . 0.0 111.457 -179.551 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 360' ' ' ALA . . . . . . . . . . . . . . . -70.38 -60.83 2.04 Favored 'General case' 0 C--O 1.234 0.281 0 CA-C-N 116.439 -0.346 . . . . 0.0 111.494 -179.745 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 361' ' ' GLN . . . . . . . . . . . . . 97.6 mt-30 -55.79 -40.48 72.73 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.925 0.393 . . . . 0.0 110.792 -179.892 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 362' ' ' VAL . . . . . 0.509 HG23 ' O ' ' B' ' 358' ' ' VAL . 91.2 t -66.38 -38.25 81.39 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.71 179.616 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 363' ' ' ALA . . . . . . . . . . . . . . . -59.42 -42.73 92.53 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 116.257 -0.428 . . . . 0.0 110.383 179.296 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 364' ' ' ARG . . . . . . . . . . . . . 36.3 ttm180 -77.78 -21.99 50.82 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.834 -0.621 . . . . 0.0 110.367 179.264 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 365' ' ' LEU . . . . . . . . . . . . . 10.4 tp -64.26 -29.81 70.89 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.75 -0.659 . . . . 0.0 110.919 179.909 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 366' ' ' PHE . . . . . 0.653 ' HB3' ' HB2' ' B' ' 369' ' ' GLN . 69.4 m-85 -118.32 -59.41 1.89 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.174 -179.824 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 367' ' ' LYS . . . . . . . . . . . . . 39.7 ttpt 68.55 -80.53 0.04 OUTLIER 'General case' 0 N--CA 1.463 0.184 0 CA-C-N 115.948 -0.569 . . . . 0.0 111.595 179.79 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 368' ' ' ASN . . . . . . . . . . . . . 31.2 p-10 -58.47 -17.63 22.44 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.223 -179.477 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 369' ' ' GLN . . . . . 0.653 ' HB2' ' HB3' ' B' ' 366' ' ' PHE . 15.3 mm100 -109.58 97.54 7.08 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.964 -179.999 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 370' ' ' GLU . . . . . . . . . . . . . 44.9 mt-10 -93.91 -11.53 30.81 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.057 179.714 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 371' ' ' ASP . . . . . . . . . . . . . 13.6 m-20 -57.93 -64.12 1.02 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.935 -179.758 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 372' ' ' LEU . . . . . 0.553 HD12 ' N ' ' B' ' 373' ' ' LEU . 0.4 OUTLIER -61.98 -22.57 65.77 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.965 179.824 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' B' B ' 373' ' ' LEU . . . . . 0.553 ' N ' HD12 ' B' ' 372' ' ' LEU . 4.3 tp -68.76 -43.15 76.42 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.3 179.918 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 374' ' ' SER . . . . . . . . . . . . . 53.1 m -69.12 -48.25 62.97 Favored 'General case' 0 C--O 1.236 0.373 0 N-CA-C 109.676 -0.491 . . . . 0.0 109.676 179.053 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 375' ' ' GLU . . . . . . . . . . . . . 42.0 tt0 -56.47 -32.53 65.07 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 115.747 -0.66 . . . . 0.0 109.701 178.989 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 376' ' ' PHE . . . . . . . . . . . . . 93.3 t80 -78.12 -33.44 50.54 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 115.804 -0.635 . . . . 0.0 110.066 179.014 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 377' ' ' GLY . . . . . . . . . . . . . . . -60.52 -36.49 91.45 Favored Glycine 0 N--CA 1.449 -0.467 0 C-N-CA 120.725 -0.75 . . . . 0.0 111.632 179.506 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 378' ' ' GLN . . . . . . . . . . . . . 54.5 mt-30 -56.55 -30.76 63.48 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.666 0.269 . . . . 0.0 110.823 179.464 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 379' ' ' PHE . . . . . . . . . . . . . 78.6 m-85 -66.87 -45.06 79.3 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.392 -0.367 . . . . 0.0 110.85 179.871 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 380' ' ' LEU . . . . . . . . . . . . . 92.5 mt -53.63 132.57 55.4 Favored Pre-proline 0 C--N 1.33 -0.268 0 CA-C-N 116.373 -0.376 . . . . 0.0 110.193 179.451 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 381' ' ' PRO . . . . . 0.435 ' HD3' ' HB2' ' A' ' 373' ' ' MET . 53.4 Cg_exo . . . . . 0 C--N 1.348 0.528 0 C-N-CA 122.263 1.975 . . . . 0.0 112.55 -179.581 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 366' ' ' ALA . . . . . 0.477 ' HB3' HG22 ' B' ' 311' ' ' VAL . . . . . . . . 0 C--O 1.234 0.268 0 CA-C-O 121.127 0.489 . . . . 0.0 110.551 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 367' ' ' VAL . . . . . 0.654 HG23 ' HB3' ' B' ' 307' ' ' ALA . 8.5 p -47.58 -22.99 0.56 Allowed 'Isoleucine or valine' 0 C--O 1.226 -0.178 0 CA-C-N 115.519 -0.764 . . . . 0.0 111.464 -179.969 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 368' ' ' TYR . . . . . . . . . . . . . 85.6 t80 -61.34 -66.09 0.59 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.896 0.379 . . . . 0.0 110.568 179.548 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 369' ' ' VAL . . . . . 0.51 HG11 ' HB3' ' B' ' 332' ' ' LEU . 4.3 p -58.42 -39.21 73.91 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.622 179.609 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 370' ' ' LEU . . . . . 0.462 HD23 ' HA ' ' B' ' 307' ' ' ALA . 2.7 mp -64.78 -35.91 82.63 Favored 'General case' 0 C--O 1.233 0.222 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.152 179.918 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 371' ' ' SER . . . . . . . . . . . . . 37.6 m -66.56 -44.99 80.82 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.387 -0.369 . . . . 0.0 110.856 -179.935 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 372' ' ' SER . . . . . . . . . . . . . 43.6 t -65.19 -36.28 83.69 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.389 -0.369 . . . . 0.0 110.869 179.724 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 373' ' ' MET . . . . . 0.417 ' SD ' HD23 ' B' ' 380' ' ' LEU . 51.4 ttm -66.0 -43.78 86.74 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.888 -179.42 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 374' ' ' ALA . . . . . . . . . . . . . . . -79.56 -42.16 25.65 Favored 'General case' 0 C--N 1.33 -0.245 0 N-CA-C 112.591 0.589 . . . . 0.0 112.591 -179.023 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 375' ' ' ARG . . . . . 0.501 ' HG2' ' HG2' ' B' ' 303' ' ' GLU . 18.1 mmm180 -66.96 -35.72 80.61 Favored 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 111.905 0.335 . . . . 0.0 111.905 -179.163 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 376' ' ' GLN . . . . . . . . . . . . . 24.1 tp60 . . . . . 0 C--N 1.332 -0.171 0 CA-C-N 116.617 -0.265 . . . . 0.0 111.478 -179.554 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' B' B ' 302' ' ' VAL . . . . . 0.499 HG13 ' N ' ' B' ' 303' ' ' GLU . 4.0 p . . . . . 0 C--O 1.234 0.286 0 CA-C-O 120.81 0.338 . . . . 0.0 111.319 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 303' ' ' GLU . . . . . 0.501 ' HG2' ' HG2' ' A' ' 375' ' ' ARG . 0.0 OUTLIER -58.78 -21.84 56.82 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.675 -179.499 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' B' B ' 304' ' ' PHE . . . . . . . . . . . . . 73.4 t80 -55.96 -82.22 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.518 -0.31 . . . . 0.0 110.839 -179.763 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 305' ' ' ASN . . . . . . . . . . . . . 8.7 p30 -62.21 -33.58 74.83 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.459 -179.48 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 306' ' ' HIS . . . . . . . . . . . . . 7.8 t-160 -63.31 -71.02 0.18 Allowed 'General case' 0 C--O 1.233 0.221 0 CA-C-O 120.661 0.267 . . . . 0.0 111.651 -179.163 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 307' ' ' ALA . . . . . 0.654 ' HB3' HG23 ' A' ' 367' ' ' VAL . . . -55.51 -47.93 75.45 Favored 'General case' 0 C--N 1.33 -0.266 0 N-CA-C 112.003 0.372 . . . . 0.0 112.003 -179.062 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 308' ' ' ILE . . . . . . . . . . . . . 22.4 mm -53.07 -57.57 4.41 Favored 'Isoleucine or valine' 0 C--O 1.233 0.226 0 CA-C-O 120.669 0.271 . . . . 0.0 111.444 -179.759 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 309' ' ' ASN . . . . . . . . . . . . . 14.0 m120 -61.27 -26.19 67.6 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.404 -0.362 . . . . 0.0 111.236 -179.623 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 310' ' ' TYR . . . . . 0.476 ' OH ' ' HB2' ' B' ' 375' ' ' GLU . 0.3 OUTLIER -71.4 -50.52 31.18 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.567 -0.288 . . . . 0.0 111.327 -179.838 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' B' B ' 311' ' ' VAL . . . . . 0.511 HG23 ' O ' ' B' ' 307' ' ' ALA . 15.2 t -63.46 -39.0 83.69 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.225 0 CA-C-N 116.506 -0.315 . . . . 0.0 111.071 -179.546 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 312' ' ' ASN . . . . . . . . . . . . . 6.7 t30 -69.39 -41.93 75.82 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.145 -179.95 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 313' ' ' LYS . . . . . 0.46 ' NZ ' ' HB3' ' B' ' 313' ' ' LYS . 0.0 OUTLIER -61.32 -46.42 90.36 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.018 -0.537 . . . . 0.0 111.746 -179.631 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' B' B ' 314' ' ' ILE . . . . . . . . . . . . . 79.9 mt -74.71 -36.45 40.37 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 N-CA-C 111.827 0.306 . . . . 0.0 111.827 -179.248 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 315' ' ' LYS . . . . . . . . . . . . . 1.6 tmmt? -67.24 -30.56 70.5 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.551 -0.295 . . . . 0.0 111.243 -179.656 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 316' ' ' ASN . . . . . . . . . . . . . 46.9 t-20 -88.85 -45.04 10.05 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.52 -0.309 . . . . 0.0 111.086 -179.854 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 317' ' ' ARG . . . . . . . . . . . . . 22.5 tpp180 -68.79 -63.86 0.98 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.423 -0.353 . . . . 0.0 111.124 -179.757 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 318' ' ' PHE . . . . . . . . . . . . . 97.2 m-85 -80.13 27.87 0.31 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.139 -179.827 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 319' ' ' GLN . . . . . . . . . . . . . 7.8 tt0 -61.46 -32.23 72.22 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.914 179.992 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 320' ' ' GLY . . . . . . . . . . . . . . . -74.35 -15.85 80.09 Favored Glycine 0 N--CA 1.45 -0.385 0 C-N-CA 120.873 -0.68 . . . . 0.0 112.637 -179.877 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 321' ' ' GLN . . . . . 0.502 HE21 ' H ' ' B' ' 323' ' ' ASP . 24.2 tp60 -109.75 92.68 12.81 Favored Pre-proline 0 C--N 1.33 -0.239 0 CA-C-O 120.401 0.143 . . . . 0.0 110.803 179.914 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 322' ' ' PRO . . . . . . . . . . . . . 90.9 Cg_endo -79.66 -19.01 10.25 Favored 'Trans proline' 0 C--N 1.346 0.426 0 C-N-CA 122.604 2.203 . . . . 0.0 112.723 -179.921 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 323' ' ' ASP . . . . . 0.502 ' H ' HE21 ' B' ' 321' ' ' GLN . 25.9 m-20 -70.05 -54.51 12.78 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.389 -0.369 . . . . 0.0 111.217 -179.652 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 324' ' ' ILE . . . . . 0.474 HD12 ' HG2' ' B' ' 321' ' ' GLN . 56.0 mt -62.05 -47.82 91.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.253 -0.43 . . . . 0.0 111.338 -179.871 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 325' ' ' TYR . . . . . 0.408 ' O ' ' HG ' ' B' ' 329' ' ' LEU . 18.0 t80 -59.35 -51.6 69.24 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.275 -0.42 . . . . 0.0 111.278 -179.51 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 326' ' ' LYS . . . . . . . . . . . . . 87.8 tttt -55.7 -50.41 70.38 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.37 -0.377 . . . . 0.0 111.28 -179.868 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 327' ' ' ALA . . . . . . . . . . . . . . . -52.75 -50.13 64.08 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.083 -179.998 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 328' ' ' PHE . . . . . . . . . . . . . 51.4 t80 -54.59 -43.72 72.37 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.481 179.893 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 329' ' ' LEU . . . . . 0.408 ' HG ' ' O ' ' B' ' 325' ' ' TYR . 86.4 mt -63.07 -36.32 83.18 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.862 -0.608 . . . . 0.0 110.865 179.635 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 330' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -65.09 -37.7 88.35 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.702 179.74 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 331' ' ' ILE . . . . . 0.41 HG22 HG22 ' B' ' 358' ' ' VAL . 72.9 mt -66.91 -52.24 46.41 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.12 179.818 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 332' ' ' LEU . . . . . 0.51 ' HB3' HG11 ' A' ' 369' ' ' VAL . 8.4 mp -64.45 -32.89 74.71 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.233 -0.439 . . . . 0.0 111.339 -179.86 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 333' ' ' HIS . . . . . . . . . . . . . 56.7 t-80 -66.02 -57.81 6.93 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.059 0.457 . . . . 0.0 110.032 179.38 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 334' ' ' THR . . . . . . . . . . . . . 10.8 m -60.1 -26.23 66.05 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.252 179.402 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 335' ' ' TYR . . . . . . . . . . . . . 77.4 t80 -65.98 -49.6 67.28 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.011 179.205 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 336' ' ' GLN . . . . . 0.41 HE21 HG23 ' A' ' 369' ' ' VAL . 47.6 mm-40 -62.53 -33.57 75.17 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.203 179.088 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 337' ' ' LYS . . . . . . . . . . . . . 37.2 ttpt -63.35 -58.98 5.33 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.986 -0.552 . . . . 0.0 111.251 179.682 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 338' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -63.97 -28.91 70.14 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.35 -0.386 . . . . 0.0 111.383 -179.535 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 339' ' ' GLN . . . . . . . . . . . . . 65.5 tt0 -68.16 -49.83 58.44 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.938 0.399 . . . . 0.0 110.573 179.885 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 340' ' ' ARG . . . . . . . . . . . . . 83.1 mtp180 -63.94 -51.72 63.09 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.74 179.781 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 341' ' ' ASN . . . . . . . . . . . . . 4.6 m-20 -52.32 -47.45 65.99 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.076 -0.511 . . . . 0.0 111.06 179.757 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 342' ' ' ALA . . . . . . . . . . . . . . . -67.84 -31.22 70.9 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.892 179.857 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 343' ' ' LYS . . . . . . . . . . . . . 87.3 tttt -75.9 -20.51 57.97 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.611 179.896 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 344' ' ' GLU . . . . . . . . . . . . . 18.5 mm-40 -84.25 -44.26 14.06 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.966 -0.561 . . . . 0.0 111.06 179.949 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 345' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.33 -0.241 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.982 179.929 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' B' B ' 351' ' ' PRO . . . . . . . . . . . . . 36.2 Cg_exo . . . . . 0 C--O 1.233 0.247 0 CA-C-O 120.775 0.239 . . . . 0.0 112.228 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' B' B ' 352' ' ' ALA . . . . . . . . . . . . . . . -111.97 -55.66 2.48 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.683 -179.612 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 353' ' ' LEU . . . . . . . . . . . . . 5.3 mp -105.99 111.04 23.51 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.902 0.382 . . . . 0.0 111.491 -179.542 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 354' ' ' THR . . . . . . . . . . . . . 60.9 p -95.94 -170.05 2.05 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.259 179.259 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 355' ' ' GLU . . . . . . . . . . . . . 41.2 mt-10 -62.03 -30.05 70.7 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 120.999 0.428 . . . . 0.0 110.38 179.659 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 356' ' ' GLN . . . . . . . . . . . . . 1.6 mp0 -72.9 -43.29 62.64 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.785 -0.643 . . . . 0.0 111.361 -179.889 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 357' ' ' GLU . . . . . . . . . . . . . 8.4 tp10 -55.98 -48.5 75.72 Favored 'General case' 0 C--O 1.233 0.194 0 CA-C-O 120.903 0.382 . . . . 0.0 110.839 -179.636 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 358' ' ' VAL . . . . . 0.492 ' O ' HG23 ' B' ' 362' ' ' VAL . 86.5 t -68.19 -59.0 4.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.019 -0.537 . . . . 0.0 111.559 -179.63 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 359' ' ' TYR . . . . . . . . . . . . . 40.2 t80 -52.43 -29.67 25.62 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.632 -0.258 . . . . 0.0 111.655 -179.01 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 360' ' ' ALA . . . . . . . . . . . . . . . -74.09 -60.68 2.15 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.847 0.356 . . . . 0.0 111.178 -179.943 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 361' ' ' GLN . . . . . . . . . . . . . 49.9 mt-30 -54.25 -36.96 64.15 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.466 179.842 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 362' ' ' VAL . . . . . 0.492 HG23 ' O ' ' B' ' 358' ' ' VAL . 87.9 t -72.06 -37.79 61.38 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-N 115.868 -0.605 . . . . 0.0 110.341 179.332 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 363' ' ' ALA . . . . . 0.741 ' HA ' HD21 ' B' ' 373' ' ' LEU . . . -57.86 -38.36 75.56 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.572 179.694 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 364' ' ' ARG . . . . . . . . . . . . . 63.3 mtm180 -90.73 -19.35 23.64 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.861 -0.609 . . . . 0.0 110.779 179.519 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 365' ' ' LEU . . . . . . . . . . . . . 24.4 tp -58.16 -37.76 75.32 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.049 -0.523 . . . . 0.0 111.511 -179.705 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 366' ' ' PHE . . . . . . . . . . . . . 75.5 m-85 -98.13 164.25 12.41 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.918 0.39 . . . . 0.0 111.425 -179.504 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 367' ' ' LYS . . . . . 0.422 ' C ' ' H ' ' B' ' 369' ' ' GLN . 65.7 mttm -96.06 87.71 4.64 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.951 -179.893 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 368' ' ' ASN . . . . . . . . . . . . . 2.4 m-20 62.05 -0.49 0.46 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.683 179.675 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 369' ' ' GLN . . . . . 0.422 ' H ' ' C ' ' B' ' 367' ' ' LYS . 8.5 tp60 -63.69 102.84 0.49 Allowed 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.827 0.346 . . . . 0.0 110.158 179.752 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 370' ' ' GLU . . . . . . . . . . . . . 46.3 tt0 -91.82 -25.56 18.94 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.132 -0.485 . . . . 0.0 111.823 -179.048 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 371' ' ' ASP . . . . . . . . . . . . . 19.0 m-20 -49.36 -63.51 1.08 Allowed 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.879 0.371 . . . . 0.0 110.812 -179.989 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 372' ' ' LEU . . . . . 0.446 ' H ' HD12 ' B' ' 372' ' ' LEU . 7.4 mp -55.44 -45.66 76.78 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.695 179.273 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 373' ' ' LEU . . . . . 0.741 HD21 ' HA ' ' B' ' 363' ' ' ALA . 1.2 mp -59.22 -27.13 65.46 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.74 -0.664 . . . . 0.0 111.459 -179.729 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 374' ' ' SER . . . . . . . . . . . . . 67.4 m -77.92 -57.84 3.58 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.84 0.352 . . . . 0.0 110.82 -179.83 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 375' ' ' GLU . . . . . 0.476 ' HB2' ' OH ' ' B' ' 310' ' ' TYR . 10.8 mm-40 -59.87 -28.67 67.74 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.077 -0.511 . . . . 0.0 110.309 179.807 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 376' ' ' PHE . . . . . 0.529 ' HA ' ' HB2' ' B' ' 379' ' ' PHE . 79.2 t80 -83.1 -33.44 26.35 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.144 179.3 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 377' ' ' GLY . . . . . . . . . . . . . . . -60.1 -43.16 98.58 Favored Glycine 0 N--CA 1.45 -0.417 0 C-N-CA 120.747 -0.739 . . . . 0.0 111.384 179.249 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 378' ' ' GLN . . . . . . . . . . . . . 25.2 mm-40 -79.53 -18.04 52.73 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.105 0.479 . . . . 0.0 109.988 179.075 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 379' ' ' PHE . . . . . 0.529 ' HB2' ' HA ' ' B' ' 376' ' ' PHE . 0.6 OUTLIER -63.78 -29.33 70.55 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.642 -0.708 . . . . 0.0 110.287 179.621 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' B' B ' 380' ' ' LEU . . . . . 0.417 HD23 ' SD ' ' A' ' 373' ' ' MET . 42.2 mt -62.93 153.0 81.95 Favored Pre-proline 0 C--N 1.33 -0.242 0 CA-C-N 115.715 -0.675 . . . . 0.0 110.989 -179.87 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 381' ' ' PRO . . . . . . . . . . . . . 55.0 Cg_endo . . . . . 0 C--N 1.347 0.474 0 C-N-CA 122.544 2.163 . . . . 0.0 112.301 179.97 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 366' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.234 0.269 0 CA-C-O 120.929 0.395 . . . . 0.0 110.735 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 367' ' ' VAL . . . . . . . . . . . . . 41.4 t -57.88 -30.2 37.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 115.797 -0.638 . . . . 0.0 110.648 179.688 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 368' ' ' TYR . . . . . . . . . . . . . 84.1 t80 -67.36 -37.11 82.71 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.099 -0.501 . . . . 0.0 110.464 179.578 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 369' ' ' VAL . . . . . . . . . . . . . 10.9 t -68.63 -56.57 11.82 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 115.87 -0.605 . . . . 0.0 110.788 179.704 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 370' ' ' LEU . . . . . 0.534 ' HB2' ' HB1' ' B' ' 307' ' ' ALA . 94.5 mt -58.21 -40.42 81.55 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.925 -0.58 . . . . 0.0 111.092 -179.854 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 371' ' ' SER . . . . . 0.534 ' HA ' ' HB3' ' B' ' 303' ' ' GLU . 84.1 p -60.97 -59.12 5.88 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.092 -179.913 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 372' ' ' SER . . . . . . . . . . . . . 47.1 t -54.54 -33.87 60.82 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.789 0.328 . . . . 0.0 111.201 -179.835 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 373' ' ' MET . . . . . . . . . . . . . 53.9 ttm -64.14 -48.31 76.54 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.515 -179.811 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 374' ' ' ALA . . . . . 0.574 ' HB3' ' HG3' ' B' ' 303' ' ' GLU . . . -87.05 -6.14 58.82 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.488 -0.324 . . . . 0.0 111.852 -179.519 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 375' ' ' ARG . . . . . 0.539 ' HB2' ' HG2' ' B' ' 303' ' ' GLU . 29.6 ttt180 -91.94 -31.17 15.74 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.874 0.369 . . . . 0.0 110.932 -179.861 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 376' ' ' GLN . . . . . . . . . . . . . 52.4 tt0 . . . . . 0 C--N 1.33 -0.246 0 CA-C-N 116.004 -0.544 . . . . 0.0 111.779 -179.31 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' B' B ' 302' ' ' VAL . . . . . 0.434 HG13 ' N ' ' B' ' 303' ' ' GLU . 2.5 p . . . . . 0 C--O 1.233 0.218 0 CA-C-O 120.814 0.34 . . . . 0.0 111.4 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 303' ' ' GLU . . . . . 0.574 ' HG3' ' HB3' ' A' ' 374' ' ' ALA . 2.4 mp0 -73.7 -43.75 58.41 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.259 -0.428 . . . . 0.0 112.134 -179.244 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 304' ' ' PHE . . . . . . . . . . . . . 54.6 m-85 -62.18 -39.92 94.29 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.712 0.292 . . . . 0.0 111.365 -179.589 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 305' ' ' ASN . . . . . . . . . . . . . 6.8 t30 -71.54 -47.31 55.91 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.48 -179.626 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 306' ' ' HIS . . . . . . . . . . . . . 18.5 t-160 -65.51 -40.76 93.38 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.792 0.33 . . . . 0.0 111.214 -179.559 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 307' ' ' ALA . . . . . 0.534 ' HB1' ' HB2' ' A' ' 370' ' ' LEU . . . -65.95 -51.8 55.36 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.685 -179.406 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 308' ' ' ILE . . . . . 0.426 ' O ' HD13 ' B' ' 308' ' ' ILE . 0.0 OUTLIER -58.93 -43.08 87.81 Favored 'Isoleucine or valine' 0 C--O 1.233 0.23 0 CA-C-O 120.724 0.297 . . . . 0.0 110.685 -179.827 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' B' B ' 309' ' ' ASN . . . . . . . . . . . . . 27.0 t-20 -67.32 -30.04 69.77 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.619 179.622 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 310' ' ' TYR . . . . . . . . . . . . . 56.8 t80 -66.11 -52.01 52.65 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.806 179.872 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 311' ' ' VAL . . . . . . . . . . . . . 47.3 t -61.53 -44.0 97.86 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.2 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.83 179.798 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 312' ' ' ASN . . . . . . . . . . . . . 23.5 t-20 -63.74 -33.8 76.47 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.817 179.777 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 313' ' ' LYS . . . . . . . . . . . . . 1.1 tmmt? -64.96 -50.7 65.37 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.895 -179.975 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 314' ' ' ILE . . . . . . . . . . . . . 66.4 mt -71.76 -25.2 23.94 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.264 -179.881 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 315' ' ' LYS . . . . . . . . . . . . . 1.5 tmmt? -71.73 -39.74 69.89 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.875 -179.884 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 316' ' ' ASN . . . . . . . . . . . . . 27.2 t-20 -80.67 -41.68 23.34 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.293 -179.882 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 317' ' ' ARG . . . . . . . . . . . . . 29.1 tpt180 -68.68 -61.89 1.62 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.04 -179.806 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 318' ' ' PHE . . . . . . . . . . . . . 76.4 m-85 -83.67 31.56 0.47 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.089 -179.938 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 319' ' ' GLN . . . . . . . . . . . . . 6.5 tp-100 -62.1 -20.63 64.25 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.264 -0.426 . . . . 0.0 110.646 179.779 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 320' ' ' GLY . . . . . . . . . . . . . . . -92.52 -13.33 57.2 Favored Glycine 0 C--N 1.33 0.204 0 C-N-CA 120.928 -0.653 . . . . 0.0 112.502 179.968 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 321' ' ' GLN . . . . . . . . . . . . . 15.9 mm100 -108.79 92.75 10.96 Favored Pre-proline 0 C--N 1.329 -0.292 0 CA-C-O 120.548 0.213 . . . . 0.0 110.637 179.819 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 322' ' ' PRO . . . . . . . . . . . . . 98.3 Cg_endo -78.97 -26.57 5.24 Favored 'Trans proline' 0 C--N 1.347 0.48 0 C-N-CA 122.537 2.158 . . . . 0.0 112.603 -179.792 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 323' ' ' ASP . . . . . . . . . . . . . 15.7 t70 -68.9 -54.9 12.96 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.123 -179.715 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 324' ' ' ILE . . . . . . . . . . . . . 80.2 mt -64.18 -43.74 97.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.37 -179.949 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 325' ' ' TYR . . . . . . . . . . . . . 16.3 t80 -60.4 -44.67 95.45 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.718 -179.975 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 326' ' ' LYS . . . . . 0.4 ' O ' ' HG2' ' B' ' 330' ' ' GLU . 63.8 tttp -63.29 -50.89 68.33 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.969 179.977 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 327' ' ' ALA . . . . . . . . . . . . . . . -51.86 -49.77 62.25 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.134 -179.951 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 328' ' ' PHE . . . . . . . . . . . . . 69.8 t80 -56.02 -52.92 62.51 Favored 'General case' 0 C--O 1.237 0.401 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.519 179.826 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 329' ' ' LEU . . . . . . . . . . . . . 89.9 mt -61.12 -24.19 66.07 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.815 -0.629 . . . . 0.0 110.754 179.8 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 330' ' ' GLU . . . . . 0.4 ' HG2' ' O ' ' B' ' 326' ' ' LYS . 16.3 mm-40 -75.92 -34.27 59.89 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.562 179.49 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 331' ' ' ILE . . . . . . . . . . . . . 80.9 mt -68.89 -44.2 81.84 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.207 0 CA-C-N 116.204 -0.453 . . . . 0.0 109.995 179.183 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 332' ' ' LEU . . . . . . . . . . . . . 45.7 mt -69.31 -39.32 78.33 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.802 -0.636 . . . . 0.0 111.007 179.684 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 333' ' ' HIS . . . . . . . . . . . . . 68.9 t60 -63.69 -51.61 64.29 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.762 179.96 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 334' ' ' THR . . . . . 0.454 ' HA ' ' HZ2' ' B' ' 337' ' ' LYS . 42.1 m -62.28 -35.58 79.46 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.732 179.793 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 335' ' ' TYR . . . . . . . . . . . . . 61.0 t80 -59.31 -62.36 1.94 Allowed 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.075 -0.512 . . . . 0.0 110.825 179.731 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 336' ' ' GLN . . . . . . . . . . . . . 26.0 tp60 -54.15 -42.93 70.14 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.121 -0.49 . . . . 0.0 111.391 -179.683 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 337' ' ' LYS . . . . . 0.454 ' HZ2' ' HA ' ' B' ' 334' ' ' THR . 6.4 ttpm? -53.83 -54.62 35.86 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.892 0.377 . . . . 0.0 111.005 -179.816 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 338' ' ' GLU . . . . . . . . . . . . . 41.6 mt-10 -62.76 -31.58 72.56 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.032 -179.8 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 339' ' ' GLN . . . . . . . . . . . . . 15.8 mm100 -64.99 -47.67 76.7 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.846 0.355 . . . . 0.0 110.546 179.55 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 340' ' ' ARG . . . . . . . . . . . . . 96.0 mtt180 -59.59 -51.39 70.03 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.269 179.38 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 341' ' ' ASN . . . . . . . . . . . . . 2.3 m-20 -59.51 -31.94 69.84 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.366 179.568 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 342' ' ' ALA . . . . . . . . . . . . . . . -70.68 -33.32 70.79 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.938 179.896 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 343' ' ' LYS . . . . . . . . . . . . . 61.3 mttp -79.03 -27.81 43.24 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.882 179.843 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 344' ' ' GLU . . . . . . . . . . . . . 19.9 mm-40 -74.99 -45.31 42.84 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.048 -179.924 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 345' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.33 -0.281 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.991 179.989 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' B' B ' 351' ' ' PRO . . . . . . . . . . . . . 51.6 Cg_exo . . . . . 0 C--O 1.232 0.191 0 CA-C-O 120.716 0.215 . . . . 0.0 112.218 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' B' B ' 352' ' ' ALA . . . . . 0.482 ' HB3' HD23 ' B' ' 353' ' ' LEU . . . -81.1 -61.4 1.97 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.564 -179.539 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 353' ' ' LEU . . . . . 0.5 ' HB3' ' HG2' ' B' ' 357' ' ' GLU . 0.2 OUTLIER -106.68 131.6 53.63 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 121.012 0.434 . . . . 0.0 111.414 -179.588 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' B' B ' 354' ' ' THR . . . . . . . . . . . . . 65.2 p -113.84 -160.84 0.74 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.827 -0.624 . . . . 0.0 110.662 179.868 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 355' ' ' GLU . . . . . . . . . . . . . 41.5 mt-10 -57.17 -28.02 62.43 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.412 -0.358 . . . . 0.0 110.876 179.755 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 356' ' ' GLN . . . . . . . . . . . . . 23.6 tm0? -69.86 -50.01 46.82 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.044 -0.525 . . . . 0.0 111.008 -179.77 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 357' ' ' GLU . . . . . 0.5 ' HG2' ' HB3' ' B' ' 353' ' ' LEU . 7.1 tp10 -64.43 -36.97 85.91 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.484 -0.325 . . . . 0.0 110.979 -179.673 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 358' ' ' VAL . . . . . 0.508 ' O ' HG23 ' B' ' 362' ' ' VAL . 48.7 t -64.12 -59.85 3.63 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.981 179.973 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 359' ' ' TYR . . . . . . . . . . . . . 37.3 t80 -59.59 -30.1 68.43 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.474 -0.33 . . . . 0.0 111.331 -179.534 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 360' ' ' ALA . . . . . . . . . . . . . . . -69.75 -60.49 2.28 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.69 0.281 . . . . 0.0 111.324 -179.646 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 361' ' ' GLN . . . . . . . . . . . . . 76.8 mt-30 -56.19 -44.88 79.86 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.235 -0.438 . . . . 0.0 110.903 179.99 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 362' ' ' VAL . . . . . 0.508 HG23 ' O ' ' B' ' 358' ' ' VAL . 64.2 t -64.63 -35.39 74.62 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.716 179.759 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 363' ' ' ALA . . . . . 0.61 ' HA ' HD11 ' B' ' 373' ' ' LEU . . . -61.69 -42.83 99.46 Favored 'General case' 0 CA--C 1.521 -0.171 0 CA-C-O 120.955 0.407 . . . . 0.0 110.263 179.327 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 364' ' ' ARG . . . . . . . . . . . . . 68.2 ttt180 -81.55 -18.23 45.65 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.877 -0.601 . . . . 0.0 110.201 179.42 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 365' ' ' LEU . . . . . 0.402 ' HB2' ' HA ' ' B' ' 362' ' ' VAL . 8.1 tp -60.96 -25.52 66.88 Favored 'General case' 0 C--O 1.232 0.164 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.381 179.659 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 366' ' ' PHE . . . . . . . . . . . . . 60.4 m-85 -125.97 162.21 25.75 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.142 179.546 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 367' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -115.61 -87.8 0.59 Allowed 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 120.753 0.311 . . . . 0.0 111.596 -179.408 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 368' ' ' ASN . . . . . 0.559 HD22 ' N ' ' B' ' 368' ' ' ASN . 0.8 OUTLIER -79.74 -0.95 36.42 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.443 -0.344 . . . . 0.0 111.276 -179.513 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' B' B ' 369' ' ' GLN . . . . . . . . . . . . . 46.9 mt-30 -98.44 84.24 3.17 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.393 -0.367 . . . . 0.0 111.218 -179.896 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 370' ' ' GLU . . . . . . . . . . . . . 44.7 mt-10 -93.9 -6.01 46.6 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.759 179.671 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 371' ' ' ASP . . . . . . . . . . . . . 19.9 t70 -57.71 -62.03 2.09 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.004 -179.812 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 372' ' ' LEU . . . . . 0.564 HD12 ' N ' ' B' ' 373' ' ' LEU . 0.3 OUTLIER -64.32 -22.51 66.97 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.257 -0.428 . . . . 0.0 111.114 179.87 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' B' B ' 373' ' ' LEU . . . . . 0.61 HD11 ' HA ' ' B' ' 363' ' ' ALA . 5.3 tp -71.53 -38.12 71.11 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.535 -179.793 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 374' ' ' SER . . . . . . . . . . . . . 48.9 m -73.66 -48.27 33.59 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.08 -0.509 . . . . 0.0 109.767 179.074 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 375' ' ' GLU . . . . . . . . . . . . . 8.5 tp10 -55.58 -38.52 69.48 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.677 -0.692 . . . . 0.0 109.813 179.133 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 376' ' ' PHE . . . . . 0.444 ' O ' ' HB2' ' B' ' 379' ' ' PHE . 76.0 t80 -75.2 -32.73 61.29 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 115.861 -0.609 . . . . 0.0 109.903 179.15 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 377' ' ' GLY . . . . . . . . . . . . . . . -60.11 -33.11 78.18 Favored Glycine 0 N--CA 1.449 -0.486 0 C-N-CA 120.606 -0.807 . . . . 0.0 111.259 179.054 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 378' ' ' GLN . . . . . . . . . . . . . 26.8 mm-40 -67.98 -31.92 71.96 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.751 0.31 . . . . 0.0 110.881 179.318 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 379' ' ' PHE . . . . . 0.444 ' HB2' ' O ' ' B' ' 376' ' ' PHE . 15.1 m-85 -56.57 -41.13 76.39 Favored 'General case' 0 C--N 1.334 -0.105 0 CA-C-N 116.319 -0.4 . . . . 0.0 110.943 179.71 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 380' ' ' LEU . . . . . . . . . . . . . 96.0 mt -56.38 131.1 76.16 Favored Pre-proline 0 C--N 1.329 -0.302 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.633 179.824 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 381' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_exo . . . . . 0 C--N 1.347 0.473 0 C-N-CA 122.355 2.037 . . . . 0.0 112.337 -179.955 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 366' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.232 0.146 0 CA-C-O 121.013 0.435 . . . . 0.0 110.686 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 367' ' ' VAL . . . . . . . . . . . . . 61.8 t -53.7 -31.23 19.71 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 115.706 -0.679 . . . . 0.0 111.452 -179.885 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 368' ' ' TYR . . . . . . . . . . . . . 65.8 m-85 -60.39 -50.4 73.75 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.758 0.313 . . . . 0.0 111.32 -179.929 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 369' ' ' VAL . . . . . 0.643 HG13 ' HG2' ' B' ' 336' ' ' GLN . 24.0 t -67.93 -52.35 40.27 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.568 -179.534 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 370' ' ' LEU . . . . . 0.547 HD13 ' HA ' ' B' ' 307' ' ' ALA . 86.9 mt -55.93 -46.51 78.45 Favored 'General case' 0 C--O 1.235 0.341 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.215 -179.808 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 371' ' ' SER . . . . . . . . . . . . . 45.8 t -60.04 -59.42 5.45 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.089 -179.949 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 372' ' ' SER . . . . . . . . . . . . . 50.6 m -51.06 -35.02 32.48 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.459 -0.337 . . . . 0.0 111.468 -179.616 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 373' ' ' MET . . . . . . . . . . . . . 54.1 tpp -65.0 -56.18 14.63 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.419 -0.355 . . . . 0.0 111.599 -179.441 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 374' ' ' ALA . . . . . 0.52 ' HB3' ' OE1' ' B' ' 303' ' ' GLU . . . -80.96 -6.15 58.38 Favored 'General case' 0 C--N 1.33 -0.267 0 N-CA-C 112.256 0.465 . . . . 0.0 112.256 -178.885 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 375' ' ' ARG . . . . . . . . . . . . . 32.7 tpt180 -96.65 -27.31 14.85 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 120.611 0.243 . . . . 0.0 111.263 -179.688 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 376' ' ' GLN . . . . . . . . . . . . . 7.5 mm100 . . . . . 0 C--N 1.329 -0.285 0 CA-C-N 116.466 -0.334 . . . . 0.0 111.435 -179.961 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' B' B ' 302' ' ' VAL . . . . . . . . . . . . . 7.3 p . . . . . 0 C--O 1.233 0.196 0 CA-C-O 120.793 0.33 . . . . 0.0 111.296 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' B' B ' 303' ' ' GLU . . . . . 0.52 ' OE1' ' HB3' ' A' ' 374' ' ' ALA . 55.8 mm-40 -70.33 -45.58 65.9 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.178 -0.464 . . . . 0.0 111.41 -179.44 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 304' ' ' PHE . . . . . . . . . . . . . 89.7 m-85 -64.35 -50.24 68.52 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.098 -179.7 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 305' ' ' ASN . . . . . . . . . . . . . 27.7 t-20 -58.18 -54.47 46.58 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.436 -179.613 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 306' ' ' HIS . . . . . . . . . . . . . 9.8 m-70 -59.48 -61.26 2.76 Favored 'General case' 0 C--N 1.331 -0.234 0 N-CA-C 112.012 0.375 . . . . 0.0 112.012 -179.327 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 307' ' ' ALA . . . . . 0.547 ' HA ' HD13 ' A' ' 370' ' ' LEU . . . -52.7 -60.52 3.15 Favored 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 112.492 0.553 . . . . 0.0 112.492 -178.798 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 308' ' ' ILE . . . . . . . . . . . . . 90.9 mt -51.55 -54.28 12.9 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.218 0 N-CA-C 111.647 0.24 . . . . 0.0 111.647 -179.26 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 309' ' ' ASN . . . . . 0.578 ' N ' HD22 ' B' ' 309' ' ' ASN . 0.8 OUTLIER -62.52 -24.07 67.3 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.456 -0.338 . . . . 0.0 111.09 -179.744 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' B' B ' 310' ' ' TYR . . . . . . . . . . . . . 34.3 t80 -69.3 -58.92 3.4 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.424 -0.353 . . . . 0.0 111.093 -179.693 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 311' ' ' VAL . . . . . 0.431 ' O ' ' HG3' ' B' ' 315' ' ' LYS . 27.1 t -58.94 -44.83 91.84 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.117 0 CA-C-O 120.816 0.341 . . . . 0.0 110.514 179.9 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 312' ' ' ASN . . . . . . . . . . . . . 2.9 t-20 -57.96 -41.59 83.19 Favored 'General case' 0 C--O 1.232 0.179 0 CA-C-O 121.005 0.431 . . . . 0.0 110.631 179.641 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 313' ' ' LYS . . . . . . . . . . . . . 37.4 tttt -59.06 -60.01 4.55 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.771 -0.649 . . . . 0.0 111.123 179.703 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 314' ' ' ILE . . . . . . . . . . . . . 19.9 mt -59.61 -27.47 37.68 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 115.778 -0.646 . . . . 0.0 111.708 -179.04 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 315' ' ' LYS . . . . . 0.481 ' HZ2' ' HB2' ' B' ' 315' ' ' LYS . 8.7 mtmp? -71.59 -40.4 69.9 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.805 0.335 . . . . 0.0 110.805 179.681 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 316' ' ' ASN . . . . . . . . . . . . . 58.8 t30 -84.75 -12.88 52.81 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.772 179.912 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 317' ' ' ARG . . . . . 0.452 HH21 HE22 ' B' ' 369' ' ' GLN . 29.8 tpt180 -90.3 -66.63 0.91 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.798 179.814 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 318' ' ' PHE . . . . . . . . . . . . . 96.7 m-85 -88.28 39.68 0.92 Allowed 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.788 179.862 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 319' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -61.13 -9.17 4.23 Favored 'General case' 0 N--CA 1.45 -0.467 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.532 -179.785 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 320' ' ' GLY . . . . . . . . . . . . . . . -96.23 -40.25 4.04 Favored Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.83 -0.7 . . . . 0.0 112.901 179.968 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 321' ' ' GLN . . . . . . . . . . . . . 6.2 tp-100 -105.88 98.08 17.19 Favored Pre-proline 0 C--N 1.33 -0.242 0 CA-C-O 120.418 0.151 . . . . 0.0 110.925 -179.82 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 322' ' ' PRO . . . . . . . . . . . . . 93.2 Cg_endo -80.43 -13.36 12.27 Favored 'Trans proline' 0 C--N 1.348 0.552 0 C-N-CA 122.472 2.115 . . . . 0.0 112.533 179.913 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 323' ' ' ASP . . . . . . . . . . . . . 14.7 t70 -65.87 -55.11 18.73 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.007 179.992 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 324' ' ' ILE . . . . . . . . . . . . . 61.1 mt -63.32 -37.93 80.81 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.936 179.899 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 325' ' ' TYR . . . . . 0.415 ' O ' HD13 ' B' ' 329' ' ' LEU . 55.7 t80 -60.21 -58.39 8.71 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.657 179.766 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 326' ' ' LYS . . . . . 0.407 ' HG2' ' OE1' ' B' ' 330' ' ' GLU . 38.2 ttmt -58.89 -40.76 85.39 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.835 -0.62 . . . . 0.0 110.993 179.994 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 327' ' ' ALA . . . . . . . . . . . . . . . -55.47 -50.48 69.76 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-O 120.891 0.376 . . . . 0.0 110.991 -179.917 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 328' ' ' PHE . . . . . . . . . . . . . 24.4 t80 -57.42 -57.46 12.56 Favored 'General case' 0 C--O 1.239 0.504 0 CA-C-O 121.334 0.587 . . . . 0.0 110.189 179.637 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 329' ' ' LEU . . . . . 0.415 HD13 ' O ' ' B' ' 325' ' ' TYR . 10.5 mp -59.13 -20.31 52.55 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.523 -0.762 . . . . 0.0 110.904 -179.989 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 330' ' ' GLU . . . . . 0.407 ' OE1' ' HG2' ' B' ' 326' ' ' LYS . 21.8 mt-10 -77.84 -35.68 50.85 Favored 'General case' 0 C--N 1.332 -0.158 0 N-CA-C 109.829 -0.434 . . . . 0.0 109.829 178.825 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 331' ' ' ILE . . . . . . . . . . . . . 96.8 mt -64.93 -44.25 96.16 Favored 'Isoleucine or valine' 0 C--O 1.233 0.189 0 N-CA-C 109.312 -0.625 . . . . 0.0 109.312 178.524 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 332' ' ' LEU . . . . . 0.526 ' HB3' HG11 ' A' ' 369' ' ' VAL . 8.9 mp -68.62 -41.03 80.06 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.621 -0.718 . . . . 0.0 110.783 179.225 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 333' ' ' HIS . . . . . . . . . . . . . 42.5 t-80 -59.68 -53.93 52.3 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.309 179.752 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 334' ' ' THR . . . . . . . . . . . . . 93.1 m -60.92 -33.16 72.72 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.277 179.143 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 335' ' ' TYR . . . . . 0.441 ' HB3' ' O ' ' B' ' 332' ' ' LEU . 74.2 t80 -55.65 -65.35 0.61 Allowed 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.646 179.463 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 336' ' ' GLN . . . . . 0.643 ' HG2' HG13 ' A' ' 369' ' ' VAL . 63.9 mm-40 -65.18 -22.3 66.88 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.36 -0.382 . . . . 0.0 111.018 179.846 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 337' ' ' LYS . . . . . . . . . . . . . 61.0 tttp -61.32 -65.67 0.66 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.382 -0.372 . . . . 0.0 110.424 179.695 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 338' ' ' GLU . . . . . . . . . . . . . 42.9 mt-10 -63.51 -33.88 76.55 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.53 179.53 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 339' ' ' GLN . . . . . . . . . . . . . 7.7 tp60 -57.38 -53.91 52.75 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.532 179.609 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 340' ' ' ARG . . . . . . . . . . . . . 99.7 mtt180 -59.28 -50.87 72.33 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.372 179.484 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 341' ' ' ASN . . . . . . . . . . . . . 13.8 m120 -56.09 -26.82 51.15 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.861 179.637 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 342' ' ' ALA . . . . . . . . . . . . . . . -74.44 -46.7 38.23 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.056 179.948 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 343' ' ' LYS . . . . . . . . . . . . . 14.2 mptt -76.37 -12.63 60.09 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.068 179.738 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 344' ' ' GLU . . . . . . . . . . . . . 23.2 mm-40 -89.08 -40.92 12.61 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.925 179.742 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 345' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.331 -0.215 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.936 179.937 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' B' B ' 351' ' ' PRO . . . . . . . . . . . . . 26.3 Cg_exo . . . . . 0 C--O 1.232 0.193 0 CA-C-O 120.807 0.253 . . . . 0.0 112.334 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' B' B ' 352' ' ' ALA . . . . . . . . . . . . . . . -104.38 -71.11 0.75 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.486 -179.911 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 353' ' ' LEU . . . . . 0.571 ' HB3' ' HG2' ' B' ' 357' ' ' GLU . 0.3 OUTLIER -92.6 145.7 24.23 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 121.464 0.649 . . . . 0.0 112.398 -179.392 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' B' B ' 354' ' ' THR . . . . . . . . . . . . . 81.4 p -115.14 -166.65 1.14 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.447 -0.797 . . . . 0.0 110.333 179.34 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 355' ' ' GLU . . . . . . . . . . . . . 37.5 mt-10 -59.89 -33.09 71.38 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 121.155 0.503 . . . . 0.0 110.271 179.418 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 356' ' ' GLN . . . . . . . . . . . . . 26.2 mp0 -70.17 -44.81 67.99 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.695 -0.684 . . . . 0.0 111.176 -179.78 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 357' ' ' GLU . . . . . 0.571 ' HG2' ' HB3' ' B' ' 353' ' ' LEU . 6.5 tp10 -61.68 -44.0 97.78 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-O 120.706 0.289 . . . . 0.0 110.534 -179.984 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 358' ' ' VAL . . . . . . . . . . . . . 87.0 t -59.76 -54.57 32.79 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.633 179.499 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 359' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -60.99 -28.03 68.73 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.864 -179.869 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 360' ' ' ALA . . . . . . . . . . . . . . . -72.4 -60.98 1.96 Allowed 'General case' 0 C--O 1.233 0.22 0 CA-C-N 116.41 -0.359 . . . . 0.0 111.273 -179.767 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 361' ' ' GLN . . . . . 0.41 ' O ' ' HB2' ' B' ' 365' ' ' LEU . 47.3 mt-30 -58.96 -34.0 71.28 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.438 179.855 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 362' ' ' VAL . . . . . . . . . . . . . 11.5 t -69.99 -40.16 78.26 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 115.826 -0.625 . . . . 0.0 110.785 179.577 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 363' ' ' ALA . . . . . 0.587 ' HA ' HD21 ' B' ' 373' ' ' LEU . . . -62.14 -38.73 90.09 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.39 179.488 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 364' ' ' ARG . . . . . . . . . . . . . 64.9 ttt180 -83.63 -19.35 35.59 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.252 179.141 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 365' ' ' LEU . . . . . 0.41 ' HB2' ' O ' ' B' ' 361' ' ' GLN . 13.2 tp -58.89 -34.62 71.87 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.853 -179.959 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 366' ' ' PHE . . . . . 0.49 ' HB3' ' HB2' ' B' ' 369' ' ' GLN . 59.7 m-85 -117.25 164.66 14.48 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.732 179.983 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 367' ' ' LYS . . . . . . . . . . . . . 60.9 mttp -116.54 -75.15 0.58 Allowed 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.931 179.915 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 368' ' ' ASN . . . . . . . . . . . . . 15.9 m120 -87.48 -3.98 59.0 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.78 -179.956 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 369' ' ' GLN . . . . . 0.49 ' HB2' ' HB3' ' B' ' 366' ' ' PHE . 17.7 mm-40 -97.3 83.01 3.22 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.025 -179.867 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 370' ' ' GLU . . . . . . . . . . . . . 40.2 tt0 -93.41 -15.61 25.47 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.629 179.648 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 371' ' ' ASP . . . . . . . . . . . . . 7.3 m-20 -55.36 -39.13 69.71 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.94 -0.573 . . . . 0.0 111.122 -179.9 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 372' ' ' LEU . . . . . 0.405 ' N ' HD12 ' B' ' 372' ' ' LEU . 6.1 mp -71.3 -38.88 71.73 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.772 179.844 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 373' ' ' LEU . . . . . 0.587 HD21 ' HA ' ' B' ' 363' ' ' ALA . 3.0 mp -56.74 -50.52 71.99 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.997 -0.547 . . . . 0.0 111.028 179.885 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 374' ' ' SER . . . . . . . . . . . . . 41.7 t -69.6 -48.0 61.58 Favored 'General case' 0 C--O 1.235 0.329 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.616 179.651 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 375' ' ' GLU . . . . . 0.427 ' O ' ' HG2' ' B' ' 378' ' ' GLN . 40.9 tt0 -54.67 -29.63 53.29 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 115.857 -0.611 . . . . 0.0 110.108 179.642 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 376' ' ' PHE . . . . . 0.446 ' O ' ' HB2' ' B' ' 379' ' ' PHE . 90.4 t80 -87.18 -27.68 22.88 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.934 -0.576 . . . . 0.0 110.004 178.71 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 377' ' ' GLY . . . . . . . . . . . . . . . -61.41 -38.67 96.12 Favored Glycine 0 N--CA 1.45 -0.376 0 C-N-CA 120.884 -0.674 . . . . 0.0 112.342 179.749 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 378' ' ' GLN . . . . . 0.427 ' HG2' ' O ' ' B' ' 375' ' ' GLU . 13.4 pt20 -63.31 -26.6 68.84 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.524 0.202 . . . . 0.0 111.053 179.731 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 379' ' ' PHE . . . . . 0.446 ' HB2' ' O ' ' B' ' 376' ' ' PHE . 29.3 m-85 -62.02 -33.96 75.32 Favored 'General case' 0 C--N 1.333 -0.122 0 CA-C-N 116.607 -0.269 . . . . 0.0 110.855 179.681 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 380' ' ' LEU . . . . . . . . . . . . . 79.3 mt -53.95 133.77 58.04 Favored Pre-proline 0 C--N 1.33 -0.26 0 CA-C-N 116.334 -0.393 . . . . 0.0 110.328 179.938 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 381' ' ' PRO . . . . . . . . . . . . . 64.1 Cg_exo . . . . . 0 C--N 1.347 0.483 0 C-N-CA 122.434 2.089 . . . . 0.0 112.353 -179.596 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 366' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.234 0.289 0 CA-C-O 121.095 0.474 . . . . 0.0 110.538 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 367' ' ' VAL . . . . . 0.403 HG13 ' HB3' ' B' ' 307' ' ' ALA . 18.4 t -57.97 -28.38 33.5 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 115.707 -0.679 . . . . 0.0 110.541 179.521 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 368' ' ' TYR . . . . . . . . . . . . . 46.1 t80 -70.16 -33.95 72.41 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.452 179.747 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 369' ' ' VAL . . . . . 0.558 HG22 ' HB2' ' B' ' 336' ' ' GLN . 20.7 t -71.48 -52.8 23.75 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.784 179.795 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 370' ' ' LEU . . . . . 0.43 HD13 ' HA ' ' B' ' 307' ' ' ALA . 87.7 mt -62.74 -41.2 99.07 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.831 -0.622 . . . . 0.0 111.183 -179.848 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 371' ' ' SER . . . . . . . . . . . . . 84.3 p -62.81 -55.78 23.29 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.768 179.901 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 372' ' ' SER . . . . . . . . . . . . . 69.1 m -53.03 -39.65 63.34 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.921 179.998 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 373' ' ' MET . . . . . . . . . . . . . 55.3 ttm -62.42 -43.07 99.7 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.768 179.779 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 374' ' ' ALA . . . . . . . . . . . . . . . -83.18 -8.44 59.49 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.557 -179.972 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 375' ' ' ARG . . . . . 0.567 ' HA ' ' HE ' ' A' ' 375' ' ' ARG . 4.1 mmp_? -102.62 -13.73 17.01 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.491 -0.322 . . . . 0.0 111.174 -179.854 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 376' ' ' GLN . . . . . 0.451 ' HB3' ' HG3' ' B' ' 381' ' ' PRO . 44.4 tt0 . . . . . 0 C--N 1.329 -0.293 0 CA-C-N 116.321 -0.4 . . . . 0.0 110.727 -179.956 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 302' ' ' VAL . . . . . . . . . . . . . 28.5 m . . . . . 0 C--O 1.233 0.187 0 CA-C-O 120.913 0.387 . . . . 0.0 110.95 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' B' B ' 303' ' ' GLU . . . . . . . . . . . . . 40.5 mt-10 -55.6 -82.88 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.75 -0.659 . . . . 0.0 111.877 -179.212 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 304' ' ' PHE . . . . . . . . . . . . . 79.6 m-85 -57.56 -39.71 77.33 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.788 -179.067 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 305' ' ' ASN . . . . . . . . . . . . . 22.5 t-20 -53.68 -69.34 0.12 Allowed 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 111.86 0.318 . . . . 0.0 111.86 -179.1 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 306' ' ' HIS . . . . . . . . . . . . . 13.4 m-70 -61.94 -53.97 48.32 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.185 -0.461 . . . . 0.0 112.243 -178.697 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 307' ' ' ALA . . . . . 0.43 ' HA ' HD13 ' A' ' 370' ' ' LEU . . . -52.3 -61.96 1.94 Allowed 'General case' 0 C--N 1.33 -0.242 0 N-CA-C 112.372 0.508 . . . . 0.0 112.372 -178.904 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 308' ' ' ILE . . . . . . . . . . . . . 86.1 mt -55.4 -54.54 24.1 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.231 0 N-CA-C 111.809 0.3 . . . . 0.0 111.809 -179.346 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 309' ' ' ASN . . . . . . . . . . . . . 39.2 t-20 -54.05 -29.91 45.92 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-O 120.899 0.38 . . . . 0.0 111.042 -179.554 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 310' ' ' TYR . . . . . 0.456 ' O ' ' HG3' ' B' ' 313' ' ' LYS . 8.6 t80 -70.86 -61.77 1.64 Allowed 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.073 -179.729 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 311' ' ' VAL . . . . . . . . . . . . . 38.4 t -59.09 -22.09 21.17 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-O 120.922 0.392 . . . . 0.0 110.656 179.875 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 312' ' ' ASN . . . . . . . . . . . . . 41.1 t30 -73.53 -57.38 4.04 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.534 -179.893 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 313' ' ' LYS . . . . . 0.456 ' HG3' ' O ' ' B' ' 310' ' ' TYR . 0.0 OUTLIER -62.46 -27.98 69.49 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 116.323 -0.399 . . . . 0.0 111.327 -179.55 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' B' B ' 314' ' ' ILE . . . . . . . . . . . . . 92.8 mt -77.43 -44.98 29.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.497 -0.32 . . . . 0.0 111.177 179.737 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 315' ' ' LYS . . . . . . . . . . . . . 27.4 ttpp -69.25 -24.74 64.03 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.223 -179.65 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 316' ' ' ASN . . . . . . . . . . . . . 6.7 t30 -85.8 -57.59 2.99 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.321 -0.399 . . . . 0.0 111.247 -179.694 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 317' ' ' ARG . . . . . . . . . . . . . 21.4 tpp180 -65.33 -59.56 3.91 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.058 -179.801 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 318' ' ' PHE . . . . . . . . . . . . . 90.3 m-85 -83.49 40.26 0.71 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.213 -0.448 . . . . 0.0 110.853 -179.89 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 319' ' ' GLN . . . . . . . . . . . . . 17.7 tt0 -71.76 -7.38 47.82 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.042 -0.527 . . . . 0.0 110.884 -179.864 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 320' ' ' GLY . . . . . . . . . . . . . . . -107.23 1.14 35.1 Favored Glycine 0 N--CA 1.452 -0.26 0 C-N-CA 120.658 -0.782 . . . . 0.0 112.83 -179.758 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 321' ' ' GLN . . . . . . . . . . . . . 27.7 mm-40 -112.5 88.49 11.13 Favored Pre-proline 0 C--N 1.33 -0.261 0 CA-C-O 120.491 0.186 . . . . 0.0 110.89 179.969 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 322' ' ' PRO . . . . . . . . . . . . . 73.9 Cg_endo -74.15 -29.46 9.78 Favored 'Trans proline' 0 C--N 1.347 0.475 0 C-N-CA 122.625 2.217 . . . . 0.0 112.654 -179.815 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 323' ' ' ASP . . . . . . . . . . . . . 13.8 t70 -68.87 -51.02 44.78 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.332 -0.395 . . . . 0.0 111.084 -179.647 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 324' ' ' ILE . . . . . . . . . . . . . 73.3 mt -68.23 -44.16 84.22 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.16 179.943 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 325' ' ' TYR . . . . . . . . . . . . . 35.3 t80 -58.04 -53.44 58.23 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.855 -179.826 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 326' ' ' LYS . . . . . 0.416 ' O ' ' HG3' ' B' ' 330' ' ' GLU . 86.1 tttt -60.09 -58.44 8.54 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.372 -179.865 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 327' ' ' ALA . . . . . 0.425 ' HB3' HD11 ' B' ' 365' ' ' LEU . . . -45.69 -53.07 9.9 Favored 'General case' 0 C--O 1.234 0.248 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.592 -179.654 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 328' ' ' PHE . . . . . . . . . . . . . 52.2 t80 -54.01 -53.52 51.84 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.146 0.498 . . . . 0.0 110.649 179.947 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 329' ' ' LEU . . . . . . . . . . . . . 84.6 mt -60.5 -24.38 65.26 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.712 -0.676 . . . . 0.0 110.984 179.891 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 330' ' ' GLU . . . . . 0.416 ' HG3' ' O ' ' B' ' 326' ' ' LYS . 48.0 mt-10 -76.17 -33.38 59.35 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.569 179.587 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 331' ' ' ILE . . . . . 0.432 HG22 HG22 ' B' ' 358' ' ' VAL . 76.8 mt -70.77 -44.53 76.2 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.222 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.275 179.378 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 332' ' ' LEU . . . . . . . . . . . . . 30.1 mt -69.34 -39.91 77.85 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.987 179.569 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 333' ' ' HIS . . . . . . . . . . . . . 53.5 t-80 -62.84 -54.04 44.87 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.977 0.418 . . . . 0.0 110.378 179.641 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 334' ' ' THR . . . . . . . . . . . . . 70.7 m -60.0 -33.69 72.32 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.361 179.545 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 335' ' ' TYR . . . . . 0.408 ' O ' ' HG2' ' B' ' 339' ' ' GLN . 74.7 t80 -61.35 -48.18 82.49 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.664 179.518 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 336' ' ' GLN . . . . . 0.558 ' HB2' HG22 ' A' ' 369' ' ' VAL . 20.6 tt0 -60.75 -46.5 90.21 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.742 179.727 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 337' ' ' LYS . . . . . . . . . . . . . 41.0 ttmt -57.34 -43.08 83.12 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.031 -0.531 . . . . 0.0 111.008 179.985 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 338' ' ' GLU . . . . . . . . . . . . . 29.8 mm-40 -68.04 -36.84 80.57 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.378 -179.664 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 339' ' ' GLN . . . . . 0.408 ' HG2' ' O ' ' B' ' 335' ' ' TYR . 27.0 mm-40 -66.41 -44.33 83.26 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.744 0.307 . . . . 0.0 110.837 179.949 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 340' ' ' ARG . . . . . . . . . . . . . 99.7 mtt180 -62.76 -54.11 44.02 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.738 179.895 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 341' ' ' ASN . . . . . . . . . . . . . 2.7 m-20 -57.52 -44.95 85.49 Favored 'General case' 0 C--O 1.234 0.249 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.947 179.865 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 342' ' ' ALA . . . . . . . . . . . . . . . -63.8 -30.22 71.33 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.846 179.881 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 343' ' ' LYS . . . . . . . . . . . . . 26.8 ttpp -76.1 -31.29 58.63 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.64 179.756 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 344' ' ' GLU . . . . . . . . . . . . . 22.7 mm-40 -69.63 -55.24 10.59 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.03 -0.532 . . . . 0.0 111.076 179.939 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 345' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.33 -0.258 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.814 179.997 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' B' B ' 351' ' ' PRO . . . . . . . . . . . . . 52.7 Cg_exo . . . . . 0 C--O 1.231 0.14 0 CA-C-O 120.821 0.259 . . . . 0.0 112.262 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' B' B ' 352' ' ' ALA . . . . . . . . . . . . . . . -93.48 -23.05 18.51 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.163 -179.82 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 353' ' ' LEU . . . . . 0.546 ' HB3' ' HG2' ' B' ' 357' ' ' GLU . 0.2 OUTLIER -159.15 140.31 12.9 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 121.229 0.538 . . . . 0.0 111.743 179.91 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' B' B ' 354' ' ' THR . . . . . . . . . . . . . 60.4 p -114.63 -167.09 1.17 Allowed 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.754 -0.657 . . . . 0.0 110.744 179.733 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 355' ' ' GLU . . . . . 0.4 ' OE1' ' HD2' ' B' ' 381' ' ' PRO . 42.7 mt-10 -56.8 -27.62 60.15 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.957 0.408 . . . . 0.0 110.521 179.547 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 356' ' ' GLN . . . . . . . . . . . . . 87.8 mt-30 -70.55 -49.53 47.08 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.814 -0.63 . . . . 0.0 111.115 -179.828 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 357' ' ' GLU . . . . . 0.546 ' HG2' ' HB3' ' B' ' 353' ' ' LEU . 7.0 tp10 -62.7 -44.06 97.21 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.103 -179.634 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 358' ' ' VAL . . . . . 0.432 HG22 HG22 ' B' ' 331' ' ' ILE . 95.1 t -62.32 -58.08 9.17 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.351 -0.386 . . . . 0.0 111.29 -179.911 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 359' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -58.81 -31.55 68.56 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.523 -179.246 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 360' ' ' ALA . . . . . . . . . . . . . . . -72.16 -60.9 2.0 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.729 0.299 . . . . 0.0 111.252 -179.811 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 361' ' ' GLN . . . . . . . . . . . . . 97.6 mt-30 -55.37 -35.7 65.55 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 121.045 0.45 . . . . 0.0 110.348 179.555 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 362' ' ' VAL . . . . . . . . . . . . . 14.4 t -70.82 -36.85 66.24 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 CA-C-N 115.734 -0.666 . . . . 0.0 110.485 179.316 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 363' ' ' ALA . . . . . 0.698 ' HA ' HD21 ' B' ' 373' ' ' LEU . . . -63.13 -38.33 90.75 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.735 179.903 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 364' ' ' ARG . . . . . . . . . . . . . 36.1 ttt180 -88.71 -18.14 28.48 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.793 179.73 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 365' ' ' LEU . . . . . 0.425 HD11 ' HB3' ' B' ' 327' ' ' ALA . 20.7 tp -56.22 -64.86 0.72 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.019 -0.537 . . . . 0.0 111.011 -179.861 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 366' ' ' PHE . . . . . . . . . . . . . 74.0 m-85 -71.56 167.83 18.89 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.024 -0.535 . . . . 0.0 111.096 -179.675 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 367' ' ' LYS . . . . . . . . . . . . . 35.1 mmtp -82.18 75.32 9.11 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.955 -179.796 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 368' ' ' ASN . . . . . . . . . . . . . 85.3 m-20 58.92 10.42 1.54 Allowed 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.11 -0.496 . . . . 0.0 111.356 179.967 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 369' ' ' GLN . . . . . . . . . . . . . 83.0 mm-40 -61.02 113.25 2.44 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.785 0.326 . . . . 0.0 110.852 179.979 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 370' ' ' GLU . . . . . . . . . . . . . 9.7 tp10 -91.25 -26.77 18.84 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.218 -0.447 . . . . 0.0 110.862 179.916 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 371' ' ' ASP . . . . . . . . . . . . . 18.0 t70 -56.6 -54.6 44.12 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.69 179.91 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 372' ' ' LEU . . . . . 0.461 ' H ' HD12 ' B' ' 372' ' ' LEU . 6.4 mp -65.17 -43.26 92.29 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.777 179.81 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 373' ' ' LEU . . . . . 0.698 HD21 ' HA ' ' B' ' 363' ' ' ALA . 2.1 mp -56.69 -34.53 67.49 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.926 179.789 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 374' ' ' SER . . . . . . . . . . . . . 59.7 m -75.97 -56.25 4.84 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.627 -179.948 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 375' ' ' GLU . . . . . . . . . . . . . 10.1 mm-40 -50.9 -33.53 24.58 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.599 179.647 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 376' ' ' PHE . . . . . 0.418 ' HB2' ' OH ' ' B' ' 310' ' ' TYR . 79.4 t80 -80.76 -38.77 28.02 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.426 179.55 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 377' ' ' GLY . . . . . . . . . . . . . . . -58.61 -28.61 62.84 Favored Glycine 0 N--CA 1.448 -0.519 0 C-N-CA 120.653 -0.784 . . . . 0.0 111.928 179.583 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 378' ' ' GLN . . . . . . . . . . . . . 50.3 mt-30 -61.31 -35.62 77.88 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.729 0.299 . . . . 0.0 110.807 179.603 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 379' ' ' PHE . . . . . . . . . . . . . 68.2 m-85 -58.96 -40.38 84.56 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.772 179.766 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 380' ' ' LEU . . . . . . . . . . . . . 48.7 mt -51.32 131.92 33.24 Favored Pre-proline 0 C--N 1.331 -0.221 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.441 179.907 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 381' ' ' PRO . . . . . 0.451 ' HG3' ' HB3' ' A' ' 376' ' ' GLN . 76.3 Cg_exo . . . . . 0 C--N 1.348 0.529 0 C-N-CA 122.235 1.956 . . . . 0.0 112.234 -179.806 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 358' ' ' ASP . . . . . . . . . . . . . 17.5 t70 . . . . . 0 N--CA 1.487 1.385 0 CA-C-O 120.796 0.331 . . . . 0.0 111.094 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 359' ' ' PHE . . . . . . . . . . . . . 88.8 t80 -138.47 138.61 38.26 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.088 -179.82 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 360' ' ' THR . . . . . . . . . . . . . 69.4 p -133.67 104.69 11.91 Favored Pre-proline 0 C--N 1.33 -0.252 0 CA-C-N 115.967 -0.561 . . . . 0.0 110.69 179.686 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 361' ' ' PRO . . . . . . . . . . . . . 28.0 Cg_endo -62.18 -170.34 0.08 OUTLIER 'Trans proline' 0 C--N 1.349 0.562 0 C-N-CA 122.449 2.099 . . . . 0.0 112.534 -179.704 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 362' ' ' MET . . . . . . . . . . . . . 26.4 ttt -66.7 -11.18 53.18 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.813 179.979 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 363' ' ' ASP . . . . . . . . . . . . . 18.6 m-20 62.3 21.93 12.84 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.014 -179.908 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 364' ' ' SER . . . . . . . . . . . . . 48.1 t -128.38 -83.89 0.58 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.001 179.994 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 365' ' ' SER . . . . . . . . . . . . . 69.9 m -161.1 19.28 0.12 Allowed 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.985 -179.697 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 366' ' ' ALA . . . . . . . . . . . . . . . -56.16 -40.59 74.1 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.307 -179.924 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 367' ' ' VAL . . . . . . . . . . . . . 16.4 m -62.63 -26.39 40.52 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.152 179.831 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 368' ' ' TYR . . . . . . . . . . . . . 42.6 t80 -73.36 -54.92 7.15 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.251 -0.432 . . . . 0.0 111.169 -179.825 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 369' ' ' VAL . . . . . 0.515 HG13 HD22 ' A' ' 370' ' ' LEU . 7.7 p -57.99 -42.22 82.13 Favored 'Isoleucine or valine' 0 C--O 1.232 0.169 0 CA-C-O 120.782 0.325 . . . . 0.0 110.799 -179.992 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 370' ' ' LEU . . . . . 0.515 HD22 HG13 ' A' ' 369' ' ' VAL . 2.7 mm? -63.16 -46.38 87.45 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 121.011 0.434 . . . . 0.0 110.124 179.093 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 371' ' ' SER . . . . . . . . . . . . . 30.6 t -64.78 -24.21 67.48 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 115.843 -0.617 . . . . 0.0 110.641 179.36 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 372' ' ' SER . . . . . . . . . . . . . 46.6 t -72.59 -50.37 25.87 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.678 -179.972 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 373' ' ' MET . . . . . . . . . . . . . 66.4 mtt -62.02 -41.08 97.7 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.75 179.652 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 374' ' ' ALA . . . . . . . . . . . . . . . -65.71 -55.77 15.59 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.089 -0.505 . . . . 0.0 112.021 -179.329 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 375' ' ' ARG . . . . . . . . . . . . . 25.3 mmm180 -60.08 -44.6 94.65 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.506 -0.315 . . . . 0.0 111.668 -179.509 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 376' ' ' GLN . . . . . . . . . . . . . 24.2 mm-40 -66.89 -10.06 44.51 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.431 -0.35 . . . . 0.0 111.812 -179.407 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 377' ' ' ARG . . . . . 0.544 ' HA ' ' HA ' ' B' ' 381' ' ' PRO . 79.7 ttt180 -67.9 123.82 21.63 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.681 0.277 . . . . 0.0 110.646 179.977 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 378' ' ' ARG . . . . . . . . . . . . . 28.5 tpt180 61.69 10.56 3.44 Favored 'General case' 0 CA--C 1.531 0.234 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.839 -179.933 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 379' ' ' ALA . . . . . . . . . . . . . . . -98.51 161.72 13.53 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.149 180.0 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 380' ' ' SER . . . . . . . . . . . . . 47.4 t . . . . . 0 C--O 1.249 1.05 0 CA-C-O 118.207 -0.902 . . . . 0.0 111.024 179.968 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' B' B ' 295' ' ' SER . . . . . . . . . . . . . 47.3 t . . . . . 0 N--CA 1.486 1.364 0 CA-C-O 120.787 0.327 . . . . 0.0 110.914 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' B' B ' 296' ' ' LEU . . . . . 0.474 HD22 ' N ' ' B' ' 296' ' ' LEU . 3.2 mm? -102.79 178.26 4.62 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.719 179.96 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 297' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -112.89 -178.69 3.45 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.033 179.924 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 298' ' ' ASN . . . . . . . . . . . . . 37.1 m-80 -145.07 -20.11 0.5 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.922 -179.946 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 299' ' ' ASN . . . . . . . . . . . . . 7.6 t30 -89.78 125.73 35.41 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.963 -179.871 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 300' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 57.25 72.9 0.85 Allowed Pre-proline 0 C--N 1.331 -0.236 0 CA-C-N 115.971 -0.559 . . . . 0.0 111.079 179.825 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 301' ' ' PRO . . . . . 0.501 ' HB2' ' HB2' ' B' ' 304' ' ' PHE . 92.1 Cg_endo -80.33 117.84 3.52 Favored 'Trans proline' 0 C--N 1.347 0.48 0 C-N-CA 122.52 2.147 . . . . 0.0 111.987 179.453 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 302' ' ' VAL . . . . . 0.59 HG23 ' H ' ' B' ' 303' ' ' GLU . 5.1 m -91.98 -59.23 3.08 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.819 -179.456 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 303' ' ' GLU . . . . . 0.59 ' H ' HG23 ' B' ' 302' ' ' VAL . 10.6 pt-20 -57.33 -39.63 76.29 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 111.761 0.282 . . . . 0.0 111.761 -179.152 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 304' ' ' PHE . . . . . 0.501 ' HB2' ' HB2' ' B' ' 301' ' ' PRO . 81.5 m-85 -60.22 -77.08 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 112.048 0.388 . . . . 0.0 112.048 -179.217 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 305' ' ' ASN . . . . . . . . . . . . . 37.5 t30 -50.47 -45.36 56.12 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 112.779 0.659 . . . . 0.0 112.779 -178.596 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 306' ' ' HIS . . . . . 0.426 ' HB2' ' O ' ' B' ' 302' ' ' VAL . 0.4 OUTLIER -64.39 -64.87 0.77 Allowed 'General case' 0 C--N 1.33 -0.27 0 N-CA-C 112.315 0.487 . . . . 0.0 112.315 -178.418 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 307' ' ' ALA . . . . . . . . . . . . . . . -54.88 -48.69 72.67 Favored 'General case' 0 N--CA 1.464 0.27 0 N-CA-C 112.183 0.438 . . . . 0.0 112.183 -178.929 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 308' ' ' ILE . . . . . . . . . . . . . 97.6 mt -55.66 -54.19 28.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-O 120.707 0.289 . . . . 0.0 111.097 -179.889 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 309' ' ' ASN . . . . . 0.526 ' N ' HD22 ' B' ' 309' ' ' ASN . 0.9 OUTLIER -63.45 -22.34 66.83 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.436 -0.347 . . . . 0.0 110.99 179.985 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 310' ' ' TYR . . . . . 0.445 ' HA ' ' HE2' ' B' ' 313' ' ' LYS . 64.0 t80 -70.4 -61.11 1.9 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.218 -0.447 . . . . 0.0 110.826 179.887 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 311' ' ' VAL . . . . . . . . . . . . . 50.6 t -62.37 -28.39 44.55 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.771 179.823 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 312' ' ' ASN . . . . . . . . . . . . . 26.8 t-20 -69.18 -55.32 10.98 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.379 -179.873 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 313' ' ' LYS . . . . . 0.564 ' HG3' ' N ' ' B' ' 314' ' ' ILE . 40.5 pttt -58.18 -43.61 87.61 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.377 -0.374 . . . . 0.0 111.345 -179.542 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 314' ' ' ILE . . . . . 0.564 ' N ' ' HG3' ' B' ' 313' ' ' LYS . 96.0 mt -68.66 -34.97 67.86 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.437 -0.347 . . . . 0.0 111.368 -179.473 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 315' ' ' LYS . . . . . . . . . . . . . 22.4 ttmm -66.65 -37.17 84.24 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.822 0.344 . . . . 0.0 110.711 179.648 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 316' ' ' ASN . . . . . . . . . . . . . 25.4 t-20 -83.61 -21.45 32.54 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.978 -179.836 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 317' ' ' ARG . . . . . . . . . . . . . 21.9 tpt180 -75.92 -65.84 0.86 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.994 -179.998 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 318' ' ' PHE . . . . . . . . . . . . . 99.1 m-85 -91.24 35.66 0.93 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.933 179.991 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 319' ' ' GLN . . . . . . . . . . . . . 19.1 pt20 -58.34 -18.27 26.2 Favored 'General case' 0 N--CA 1.449 -0.519 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.17 179.905 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 320' ' ' GLY . . . . . . . . . . . . . . . -96.03 -22.66 19.61 Favored Glycine 0 N--CA 1.451 -0.347 0 C-N-CA 120.805 -0.712 . . . . 0.0 112.58 179.937 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 321' ' ' GLN . . . . . 0.662 HE21 ' HB2' ' B' ' 323' ' ' ASP . 48.8 tp60 -109.0 96.2 19.85 Favored Pre-proline 0 C--N 1.33 -0.26 0 CA-C-O 120.465 0.174 . . . . 0.0 110.825 -179.946 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 322' ' ' PRO . . . . . . . . . . . . . 87.8 Cg_endo -81.76 -12.25 11.11 Favored 'Trans proline' 0 C--N 1.348 0.511 0 C-N-CA 122.625 2.217 . . . . 0.0 112.847 -179.735 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 323' ' ' ASP . . . . . 0.662 ' HB2' HE21 ' B' ' 321' ' ' GLN . 9.6 m-20 -70.29 -55.69 8.59 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.517 -0.311 . . . . 0.0 111.168 -179.788 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 324' ' ' ILE . . . . . . . . . . . . . 58.8 mt -65.46 -37.37 79.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.277 -0.42 . . . . 0.0 111.065 -179.774 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 325' ' ' TYR . . . . . . . . . . . . . 28.1 t80 -64.05 -50.09 69.78 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.592 179.971 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 326' ' ' LYS . . . . . . . . . . . . . 38.9 ttmt -61.04 -38.66 86.94 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.035 -0.529 . . . . 0.0 110.692 179.613 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 327' ' ' ALA . . . . . 0.405 ' HB3' HD21 ' B' ' 365' ' ' LEU . . . -58.87 -54.96 41.24 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.916 179.905 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 328' ' ' PHE . . . . . . . . . . . . . 90.0 t80 -53.59 -49.96 66.65 Favored 'General case' 0 C--O 1.235 0.29 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.613 179.726 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 329' ' ' LEU . . . . . . . . . . . . . 96.4 mt -58.0 -35.53 71.36 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.96 179.892 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 330' ' ' GLU . . . . . . . . . . . . . 41.7 mt-10 -67.83 -34.84 77.52 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.617 179.652 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 331' ' ' ILE . . . . . . . . . . . . . 74.2 mt -65.65 -49.77 75.62 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.197 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.751 179.565 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 332' ' ' LEU . . . . . 0.467 ' HB3' HG11 ' A' ' 369' ' ' VAL . 5.2 mp -67.22 -30.56 70.51 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.359 -0.382 . . . . 0.0 111.104 179.939 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 333' ' ' HIS . . . . . . . . . . . . . 49.7 t-80 -65.26 -55.7 16.94 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.872 0.368 . . . . 0.0 110.279 179.565 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 334' ' ' THR . . . . . . . . . . . . . 77.6 m -63.18 -36.52 83.9 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.337 179.486 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 335' ' ' TYR . . . . . . . . . . . . . 87.9 t80 -66.92 -33.21 75.1 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.311 179.435 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 336' ' ' GLN . . . . . . . . . . . . . 8.1 tt0 -68.58 -49.7 57.38 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.84 -0.618 . . . . 0.0 110.66 179.815 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 337' ' ' LYS . . . . . 0.524 ' O ' ' HG2' ' B' ' 340' ' ' ARG . 39.1 ttpt -62.83 -36.89 84.69 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.068 179.955 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 338' ' ' GLU . . . . . . . . . . . . . 18.9 mm-40 -71.15 -32.53 69.07 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.974 0.416 . . . . 0.0 110.238 179.345 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 339' ' ' GLN . . . . . . . . . . . . . 58.4 tt0 -72.24 -43.3 64.59 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.798 -0.637 . . . . 0.0 110.736 179.512 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 340' ' ' ARG . . . . . 0.569 ' HG3' ' N ' ' B' ' 341' ' ' ASN . 36.3 ptt180 -63.74 -53.64 47.84 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 121.015 0.436 . . . . 0.0 110.772 179.933 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 341' ' ' ASN . . . . . 0.569 ' N ' ' HG3' ' B' ' 340' ' ' ARG . 51.1 t-20 -55.8 -51.98 65.58 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.677 -0.692 . . . . 0.0 110.837 179.502 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 342' ' ' ALA . . . . . . . . . . . . . . . -58.73 -32.76 69.51 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.015 179.897 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 343' ' ' LYS . . . . . . . . . . . . . 62.5 tttm -70.53 -38.28 74.19 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.948 179.882 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 344' ' ' GLU . . . . . . . . . . . . . 20.8 mm-40 -78.29 -22.75 47.76 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.056 -179.899 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 345' ' ' ALA . . . . . . . . . . . . . . . -76.66 -41.12 46.79 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.095 -179.967 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 346' ' ' GLY . . . . . . . . . . . . . . . 116.44 -69.08 0.28 Allowed Glycine 0 N--CA 1.451 -0.331 0 C-N-CA 120.761 -0.733 . . . . 0.0 112.504 -179.98 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 347' ' ' GLY . . . . . . . . . . . . . . . -172.34 -13.77 0.02 OUTLIER Glycine 0 N--CA 1.452 -0.293 0 C-N-CA 120.712 -0.756 . . . . 0.0 112.662 179.974 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 348' ' ' ASN . . . . . . . . . . . . . 2.0 m-20 -77.35 -0.72 26.71 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.852 0.358 . . . . 0.0 110.822 179.931 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 349' ' ' TYR . . . . . . . . . . . . . 60.0 t80 -95.29 150.36 20.34 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.807 -179.937 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 350' ' ' THR . . . . . . . . . . . . . 81.7 m -112.29 95.02 29.03 Favored Pre-proline 0 C--N 1.329 -0.303 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.981 179.981 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 351' ' ' PRO . . . . . . . . . . . . . 50.1 Cg_exo -54.35 133.89 58.4 Favored 'Trans proline' 0 C--N 1.348 0.512 0 C-N-CA 122.556 2.17 . . . . 0.0 112.529 179.928 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 352' ' ' ALA . . . . . . . . . . . . . . . -68.83 -54.34 16.31 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.838 179.838 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 353' ' ' LEU . . . . . 0.446 ' HG ' ' HG2' ' B' ' 357' ' ' GLU . 7.7 mp -107.42 131.23 54.5 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.989 -0.55 . . . . 0.0 111.068 179.972 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 354' ' ' THR . . . . . 0.401 ' H ' ' HB2' ' B' ' 357' ' ' GLU . 71.2 p -113.64 -177.39 3.12 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.64 179.601 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 355' ' ' GLU . . . . . . . . . . . . . 48.0 mt-10 -56.53 -35.79 68.48 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.953 0.406 . . . . 0.0 110.669 179.823 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 356' ' ' GLN . . . . . . . . . . . . . 15.4 mm100 -74.28 -34.2 63.47 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.824 -0.625 . . . . 0.0 111.217 -179.907 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 357' ' ' GLU . . . . . 0.446 ' HG2' ' HG ' ' B' ' 353' ' ' LEU . 5.2 tp10 -63.71 -47.81 79.62 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.865 0.365 . . . . 0.0 110.513 -179.966 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 358' ' ' VAL . . . . . 0.485 ' O ' HG23 ' B' ' 362' ' ' VAL . 93.7 t -67.52 -55.31 17.66 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.334 -179.933 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 359' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER -53.34 -37.81 62.68 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.575 0.226 . . . . 0.0 111.29 -179.332 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 360' ' ' ALA . . . . . . . . . . . . . . . -67.12 -60.8 2.31 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.589 -0.278 . . . . 0.0 111.396 -179.784 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 361' ' ' GLN . . . . . . . . . . . . . 97.2 mt-30 -52.96 -45.44 67.76 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.341 -0.39 . . . . 0.0 110.81 179.918 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 362' ' ' VAL . . . . . 0.485 HG23 ' O ' ' B' ' 358' ' ' VAL . 99.1 t -62.02 -38.75 81.55 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.224 -0.443 . . . . 0.0 110.386 179.371 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 363' ' ' ALA . . . . . . . . . . . . . . . -65.97 -28.05 68.61 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.503 179.484 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 364' ' ' ARG . . . . . . . . . . . . . 61.1 ttp180 -84.63 -26.98 27.47 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.905 -0.588 . . . . 0.0 110.544 179.5 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 365' ' ' LEU . . . . . 0.405 HD21 ' HB3' ' B' ' 327' ' ' ALA . 1.2 mp -61.99 -37.43 84.78 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.022 -0.536 . . . . 0.0 110.675 179.758 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 366' ' ' PHE . . . . . . . . . . . . . 20.2 m-85 -117.09 156.91 26.77 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.922 -179.622 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 367' ' ' LYS . . . . . . . . . . . . . 63.4 tttp -123.36 -73.83 0.63 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.736 179.885 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 368' ' ' ASN . . . . . . . . . . . . . 27.7 t-20 -72.69 -18.05 61.58 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.554 179.789 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 369' ' ' GLN . . . . . . . . . . . . . 23.7 mp0 -94.71 86.99 4.9 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.846 179.937 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 370' ' ' GLU . . . . . . . . . . . . . 42.8 tt0 -93.69 -14.75 26.0 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.609 179.89 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 371' ' ' ASP . . . . . . . . . . . . . 18.5 t70 -55.69 -37.73 68.73 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.914 -0.585 . . . . 0.0 110.864 179.899 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 372' ' ' LEU . . . . . 0.4 ' H ' HD12 ' B' ' 372' ' ' LEU . 6.4 mp -67.06 -38.63 86.13 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.117 179.891 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 373' ' ' LEU . . . . . . . . . . . . . 27.3 mt -64.31 -44.27 92.1 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.404 -0.362 . . . . 0.0 110.926 -179.777 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 374' ' ' SER . . . . . . . . . . . . . 59.2 m -65.79 -55.0 19.5 Favored 'General case' 0 C--O 1.236 0.352 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.507 179.649 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 375' ' ' GLU . . . . . 0.447 ' HG3' ' NZ ' ' B' ' 313' ' ' LYS . 20.6 mm-40 -52.78 -38.55 61.25 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.993 -0.548 . . . . 0.0 110.075 179.409 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 376' ' ' PHE . . . . . . . . . . . . . 91.0 t80 -66.42 -41.67 88.89 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.026 179.268 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 377' ' ' GLY . . . . . . . . . . . . . . . -55.62 -35.84 63.25 Favored Glycine 0 N--CA 1.448 -0.503 0 C-N-CA 120.621 -0.8 . . . . 0.0 111.269 179.103 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 378' ' ' GLN . . . . . . . . . . . . . 18.8 mm-40 -56.99 -34.84 68.52 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.928 0.394 . . . . 0.0 110.421 179.01 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 379' ' ' PHE . . . . . . . . . . . . . 89.6 m-85 -74.31 -38.49 63.31 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.031 -0.532 . . . . 0.0 110.712 179.566 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 380' ' ' LEU . . . . . . . . . . . . . 10.9 tp -45.31 115.0 2.45 Favored Pre-proline 0 C--N 1.331 -0.231 0 CA-C-N 115.861 -0.609 . . . . 0.0 111.037 -179.475 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 381' ' ' PRO . . . . . 0.544 ' HA ' ' HA ' ' A' ' 377' ' ' ARG . 99.1 Cg_exo -45.05 124.7 6.16 Favored 'Trans proline' 0 C--N 1.35 0.645 0 C-N-CA 122.704 2.269 . . . . 0.0 112.628 -179.777 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 382' ' ' ASP . . . . . 0.521 ' H ' ' HA ' ' A' ' 377' ' ' ARG . 14.4 t70 -88.1 136.85 32.78 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.359 -0.382 . . . . 0.0 111.029 -179.967 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 383' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.1 0 CA-C-O 118.227 -0.892 . . . . 0.0 111.025 179.87 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 358' ' ' ASP . . . . . . . . . . . . . 5.0 p-10 . . . . . 0 N--CA 1.485 1.308 0 CA-C-O 120.71 0.291 . . . . 0.0 110.94 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 359' ' ' PHE . . . . . . . . . . . . . 24.8 p90 -136.08 172.36 13.13 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.956 -179.832 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 360' ' ' THR . . . . . . . . . . . . . 39.7 m -142.54 100.79 5.61 Favored Pre-proline 0 C--N 1.33 -0.241 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.974 179.945 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 361' ' ' PRO . . . . . . . . . . . . . 60.4 Cg_endo -72.78 -164.51 0.19 Allowed 'Trans proline' 0 C--N 1.349 0.58 0 C-N-CA 122.371 2.048 . . . . 0.0 112.128 179.912 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 362' ' ' MET . . . . . 0.472 ' SD ' HD13 ' B' ' 329' ' ' LEU . 12.1 tpt -54.34 -69.16 0.13 Allowed 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.584 179.686 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 363' ' ' ASP . . . . . 0.425 ' OD2' ' HG3' ' A' ' 362' ' ' MET . 4.0 p30 -167.79 -53.06 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.721 179.33 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 364' ' ' SER . . . . . 0.419 ' H ' ' H ' ' A' ' 365' ' ' SER . 47.7 t 177.14 6.39 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.088 -0.506 . . . . 0.0 110.599 179.993 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 365' ' ' SER . . . . . 0.526 ' HB2' ' NE2' ' B' ' 336' ' ' GLN . 81.1 p -112.92 -21.01 11.35 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.501 -179.53 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 366' ' ' ALA . . . . . . . . . . . . . . . -58.38 -47.44 83.82 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.915 0.388 . . . . 0.0 110.993 179.898 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 367' ' ' VAL . . . . . . . . . . . . . 14.8 t -65.49 -22.09 30.34 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.868 -179.89 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 368' ' ' TYR . . . . . . . . . . . . . 61.5 t80 -65.14 -53.55 43.39 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.025 179.993 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 369' ' ' VAL . . . . . 0.4 HG23 ' N ' ' A' ' 370' ' ' LEU . 17.4 m -70.96 -45.23 74.03 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-N 116.457 -0.338 . . . . 0.0 111.093 179.881 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 370' ' ' LEU . . . . . 0.4 ' N ' HG23 ' A' ' 369' ' ' VAL . 98.9 mt -56.43 -37.97 70.94 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.386 -0.37 . . . . 0.0 110.739 179.762 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 371' ' ' SER . . . . . . . . . . . . . 83.1 p -70.51 -60.66 2.13 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.148 -179.994 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 372' ' ' SER . . . . . . . . . . . . . 79.3 p -52.56 -33.22 44.85 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.508 -0.315 . . . . 0.0 111.814 -179.28 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 373' ' ' MET . . . . . . . . . . . . . 95.8 mtp -74.4 -45.89 43.82 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 111.701 0.26 . . . . 0.0 111.701 -179.318 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 374' ' ' ALA . . . . . . . . . . . . . . . -84.48 -6.58 59.39 Favored 'General case' 0 C--N 1.331 -0.234 0 N-CA-C 112.339 0.496 . . . . 0.0 112.339 -179.217 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 375' ' ' ARG . . . . . 0.471 ' HA ' ' HE ' ' A' ' 375' ' ' ARG . 2.6 mmp_? -106.32 -27.51 10.95 Favored 'General case' 0 C--N 1.33 -0.276 0 N-CA-C 111.64 0.237 . . . . 0.0 111.64 -179.296 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 376' ' ' GLN . . . . . . . . . . . . . 27.6 tt0 -54.42 -85.38 0.01 OUTLIER 'General case' 0 C--N 1.333 -0.14 0 CA-C-O 120.702 0.287 . . . . 0.0 111.065 -179.8 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 377' ' ' ARG . . . . . 0.63 ' H ' ' HB3' ' B' ' 381' ' ' PRO . 81.5 mtp180 50.94 -158.66 0.09 Allowed 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.998 179.842 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 378' ' ' ARG . . . . . . . . . . . . . 78.5 ttt180 -60.85 -57.05 14.29 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.016 179.97 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 379' ' ' ALA . . . . . . . . . . . . . . . 60.42 -87.5 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.216 -179.817 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 380' ' ' SER . . . . . . . . . . . . . 43.6 t . . . . . 0 C--O 1.25 1.102 0 CA-C-O 118.31 -0.852 . . . . 0.0 111.111 179.897 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' B' B ' 295' ' ' SER . . . . . . . . . . . . . 64.9 m . . . . . 0 N--CA 1.486 1.346 0 CA-C-O 120.757 0.313 . . . . 0.0 110.85 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' B' B ' 296' ' ' LEU . . . . . 0.466 HD22 ' N ' ' B' ' 296' ' ' LEU . 3.3 mm? -94.41 -25.46 16.92 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.995 -179.789 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 297' ' ' GLN . . . . . . . . . . . . . 13.9 pt20 -162.48 9.82 0.06 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.023 179.871 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 298' ' ' ASN . . . . . . . . . . . . . 68.3 m-20 -95.59 134.48 38.42 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.003 179.926 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 299' ' ' ASN . . . . . . . . . . . . . 19.1 m120 60.21 102.27 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.092 -0.504 . . . . 0.0 111.068 179.977 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 300' ' ' GLN . . . . . . . . . . . . . 11.8 pt20 -99.52 151.61 37.51 Favored Pre-proline 0 C--N 1.33 -0.252 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.95 -179.998 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 301' ' ' PRO . . . . . . . . . . . . . 57.7 Cg_endo -70.71 119.38 6.28 Favored 'Trans proline' 0 C--N 1.348 0.524 0 C-N-CA 122.395 2.063 . . . . 0.0 112.296 -179.925 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 302' ' ' VAL . . . . . . . . . . . . . 22.1 m -89.39 -36.8 9.1 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-O 121.06 0.457 . . . . 0.0 111.29 -179.948 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 303' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -56.7 -68.76 0.19 Allowed 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.665 -0.698 . . . . 0.0 111.805 -178.859 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 304' ' ' PHE . . . . . 0.57 ' HA ' HD13 ' B' ' 308' ' ' ILE . 77.5 t80 -50.0 -63.58 1.07 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.867 -179.257 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 305' ' ' ASN . . . . . . . . . . . . . 53.9 t30 -46.57 -63.58 0.98 Allowed 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 112.355 0.502 . . . . 0.0 112.355 -178.803 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 306' ' ' HIS . . . . . . . . . . . . . 12.7 m-70 -55.23 -68.71 0.17 Allowed 'General case' 0 C--N 1.33 -0.266 0 N-CA-C 112.765 0.654 . . . . 0.0 112.765 -178.661 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 307' ' ' ALA . . . . . . . . . . . . . . . -48.68 -61.97 1.75 Allowed 'General case' 0 CA--C 1.532 0.254 0 N-CA-C 112.903 0.705 . . . . 0.0 112.903 -178.304 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 308' ' ' ILE . . . . . 0.57 HD13 ' HA ' ' B' ' 304' ' ' PHE . 1.8 mp -52.48 -61.22 0.82 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 N-CA-C 112.221 0.452 . . . . 0.0 112.221 -179.04 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 309' ' ' ASN . . . . . . . . . . . . . 3.2 t-20 -55.4 -27.24 46.47 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.725 0.298 . . . . 0.0 111.518 -179.256 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 310' ' ' TYR . . . . . . . . . . . . . 82.3 t80 -68.02 -57.25 6.46 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.369 -0.378 . . . . 0.0 111.225 -179.726 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 311' ' ' VAL . . . . . . . . . . . . . 27.8 t -58.17 -44.77 88.38 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.163 0 CA-C-N 116.367 -0.379 . . . . 0.0 110.705 -179.969 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 312' ' ' ASN . . . . . . . . . . . . . 2.7 t-20 -61.65 -37.15 82.96 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.13 -0.487 . . . . 0.0 110.628 179.722 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 313' ' ' LYS . . . . . . . . . . . . . 28.0 tttp -60.11 -57.11 14.25 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.963 179.827 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 314' ' ' ILE . . . . . . . . . . . . . 58.7 mt -67.51 -23.37 29.81 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.412 -179.619 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 315' ' ' LYS . . . . . . . . . . . . . 1.3 tmmt? -73.24 -36.58 66.45 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.318 -0.401 . . . . 0.0 111.142 -179.727 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 316' ' ' ASN . . . . . . . . . . . . . 24.0 t-20 -86.59 -43.19 12.87 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.412 -0.358 . . . . 0.0 111.469 -179.547 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 317' ' ' ARG . . . . . 0.43 ' HA ' ' HE ' ' B' ' 317' ' ' ARG . 5.7 tpm_? -64.02 -65.82 0.63 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.383 -0.371 . . . . 0.0 111.188 -179.779 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 318' ' ' PHE . . . . . . . . . . . . . 68.1 m-85 -81.62 31.59 0.35 Allowed 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.433 -179.639 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 319' ' ' GLN . . . . . . . . . . . . . 50.1 tt0 -68.69 -15.6 63.57 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.7 179.886 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 320' ' ' GLY . . . . . . . . . . . . . . . -74.53 -48.25 13.98 Favored Glycine 0 N--CA 1.452 -0.297 0 C-N-CA 120.888 -0.672 . . . . 0.0 112.604 179.964 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 321' ' ' GLN . . . . . . . . . . . . . 20.3 tp60 -100.92 100.94 14.06 Favored Pre-proline 0 C--N 1.33 -0.242 0 CA-C-N 116.579 0.19 . . . . 0.0 110.754 179.878 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 322' ' ' PRO . . . . . . . . . . . . . 33.6 Cg_endo -64.58 -24.71 62.83 Favored 'Trans proline' 0 C--N 1.349 0.6 0 C-N-CA 122.495 2.13 . . . . 0.0 112.525 -179.914 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 323' ' ' ASP . . . . . . . . . . . . . 8.0 m-20 -62.79 -37.07 85.23 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.059 -179.741 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 324' ' ' ILE . . . . . . . . . . . . . 48.8 mm -68.85 -61.0 1.87 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.374 -0.376 . . . . 0.0 111.039 -179.882 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 325' ' ' TYR . . . . . . . . . . . . . 23.2 t80 -51.75 -51.86 53.08 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.911 -0.586 . . . . 0.0 111.013 -179.938 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 326' ' ' LYS . . . . . . . . . . . . . 63.0 tttm -58.3 -46.02 86.89 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.145 -179.844 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 327' ' ' ALA . . . . . . . . . . . . . . . -52.23 -55.28 22.26 Favored 'General case' 0 C--O 1.233 0.237 0 CA-C-O 120.875 0.369 . . . . 0.0 111.078 -179.986 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 328' ' ' PHE . . . . . . . . . . . . . 60.6 t80 -54.05 -45.17 71.59 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.473 179.77 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 329' ' ' LEU . . . . . 0.472 HD13 ' SD ' ' A' ' 362' ' ' MET . 73.4 mt -59.44 -35.16 73.51 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.737 179.569 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 330' ' ' GLU . . . . . . . . . . . . . 47.1 mt-10 -67.69 -37.1 81.82 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.446 179.653 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 331' ' ' ILE . . . . . . . . . . . . . 70.8 mt -63.69 -53.5 43.97 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.596 179.376 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 332' ' ' LEU . . . . . . . . . . . . . 8.4 mp -63.02 -35.42 80.17 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.838 179.732 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 333' ' ' HIS . . . . . . . . . . . . . 45.6 t60 -62.27 -52.9 61.89 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.905 0.384 . . . . 0.0 110.005 179.442 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 334' ' ' THR . . . . . 0.43 HG22 HD13 ' B' ' 353' ' ' LEU . 58.8 m -60.1 -32.07 70.64 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.984 -0.553 . . . . 0.0 109.886 179.004 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 335' ' ' TYR . . . . . . . . . . . . . 57.3 t80 -63.88 -38.66 91.9 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.641 -0.709 . . . . 0.0 109.879 179.273 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 336' ' ' GLN . . . . . 0.526 ' NE2' ' HB2' ' A' ' 365' ' ' SER . 3.4 tt0 -66.35 -48.99 68.44 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.689 -0.687 . . . . 0.0 110.42 179.529 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 337' ' ' LYS . . . . . . . . . . . . . 38.6 ttpt -56.09 -50.62 70.52 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.807 -0.633 . . . . 0.0 111.018 179.987 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 338' ' ' GLU . . . . . . . . . . . . . 38.3 mm-40 -63.36 -35.67 81.16 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.139 -179.819 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 339' ' ' GLN . . . . . . . . . . . . . 23.3 tp60 -65.38 -45.65 83.22 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.719 179.936 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 340' ' ' ARG . . . . . . . . . . . . . 80.3 mtp180 -60.84 -50.53 73.07 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.604 179.705 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 341' ' ' ASN . . . . . . . . . . . . . 81.8 m-20 -54.9 -44.13 73.86 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.7 179.685 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 342' ' ' ALA . . . . . . . . . . . . . . . -64.76 -33.04 75.04 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.815 179.704 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 343' ' ' LYS . . . . . . . . . . . . . 39.5 ttpt -71.52 -40.07 70.33 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.862 179.799 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 344' ' ' GLU . . . . . . . . . . . . . 13.3 mm-40 -69.29 -33.56 73.38 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.906 179.993 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 345' ' ' ALA . . . . . . . . . . . . . . . -67.16 -32.67 73.92 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.165 -0.471 . . . . 0.0 111.021 179.922 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 346' ' ' GLY . . . . . . . . . . . . . . . 127.16 -46.06 1.11 Allowed Glycine 0 N--CA 1.451 -0.328 0 C-N-CA 120.788 -0.72 . . . . 0.0 112.514 179.988 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 347' ' ' GLY . . . . . . . . . . . . . . . 154.62 -25.65 0.66 Allowed Glycine 0 N--CA 1.452 -0.289 0 C-N-CA 120.806 -0.711 . . . . 0.0 112.448 -179.898 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 348' ' ' ASN . . . . . . . . . . . . . 26.5 t-20 -67.01 -21.92 65.92 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.713 0.292 . . . . 0.0 110.935 179.946 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 349' ' ' TYR . . . . . . . . . . . . . 63.1 t80 -63.52 147.19 52.04 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.779 -179.976 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 350' ' ' THR . . . . . . . . . . . . . 65.6 m -108.16 100.62 37.74 Favored Pre-proline 0 C--N 1.33 -0.257 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.03 -179.992 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 351' ' ' PRO . . . . . . . . . . . . . 57.7 Cg_exo -52.13 131.03 37.64 Favored 'Trans proline' 0 C--N 1.349 0.557 0 C-N-CA 122.42 2.08 . . . . 0.0 112.258 179.809 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 352' ' ' ALA . . . . . . . . . . . . . . . -59.78 -44.05 94.09 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.256 -179.796 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 353' ' ' LEU . . . . . 0.434 ' HG ' ' HG2' ' B' ' 357' ' ' GLU . 6.3 mp -112.02 120.16 40.92 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 120.998 0.428 . . . . 0.0 111.28 179.879 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 354' ' ' THR . . . . . . . . . . . . . 56.2 p -113.06 -164.18 0.9 Allowed 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.802 -0.635 . . . . 0.0 110.369 179.422 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 355' ' ' GLU . . . . . 0.402 ' H ' ' CD ' ' B' ' 355' ' ' GLU . 2.0 mp0 -61.29 -38.09 85.53 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 121.025 0.441 . . . . 0.0 110.368 179.681 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 356' ' ' GLN . . . . . . . . . . . . . 24.5 mt-30 -72.75 -40.91 65.65 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 115.868 -0.605 . . . . 0.0 111.317 -179.852 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 357' ' ' GLU . . . . . 0.434 ' HG2' ' HG ' ' B' ' 353' ' ' LEU . 4.8 tp10 -59.49 -53.1 62.02 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-O 120.785 0.326 . . . . 0.0 110.702 -179.793 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 358' ' ' VAL . . . . . 0.514 ' O ' HG23 ' B' ' 362' ' ' VAL . 49.9 t -61.82 -54.87 28.81 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.205 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.973 179.928 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 359' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER -52.28 -37.25 55.06 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.566 -0.288 . . . . 0.0 110.938 -179.524 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 360' ' ' ALA . . . . . . . . . . . . . . . -65.08 -58.64 5.53 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.43 -0.35 . . . . 0.0 111.411 -179.826 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 361' ' ' GLN . . . . . . . . . . . . . 47.8 mt-30 -55.83 -38.71 70.38 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.897 -179.889 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 362' ' ' VAL . . . . . 0.514 HG23 ' O ' ' B' ' 358' ' ' VAL . 60.4 t -71.01 -34.01 53.82 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.291 179.581 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 363' ' ' ALA . . . . . 0.547 ' HA ' HD21 ' B' ' 373' ' ' LEU . . . -64.2 -36.23 83.38 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.266 179.356 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 364' ' ' ARG . . . . . . . . . . . . . 58.9 mtp180 -87.18 -20.32 27.16 Favored 'General case' 0 N--CA 1.453 -0.286 0 CA-C-N 115.806 -0.634 . . . . 0.0 110.2 179.251 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 365' ' ' LEU . . . . . . . . . . . . . 23.6 tp -60.3 -21.11 61.58 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 115.824 -0.626 . . . . 0.0 109.916 179.239 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 366' ' ' PHE . . . . . . . . . . . . . 44.8 m-85 -131.13 -174.54 3.42 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.527 -0.76 . . . . 0.0 109.925 179.391 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 367' ' ' LYS . . . . . . . . . . . . . 66.5 mttm -133.89 -80.37 0.46 Allowed 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.745 0.307 . . . . 0.0 111.214 -179.943 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 368' ' ' ASN . . . . . . . . . . . . . 3.0 p-10 -90.18 8.83 30.98 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.955 -179.854 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 369' ' ' GLN . . . . . 0.439 ' HB3' HD13 ' B' ' 372' ' ' LEU . 13.4 mm100 -91.49 84.51 5.55 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.869 179.832 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 370' ' ' GLU . . . . . . . . . . . . . 2.2 mp0 -89.92 -11.43 41.82 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.535 -0.302 . . . . 0.0 110.653 179.749 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 371' ' ' ASP . . . . . . . . . . . . . 5.3 m-20 -63.67 -46.89 83.49 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.468 179.629 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 372' ' ' LEU . . . . . 0.439 HD13 ' HB3' ' B' ' 369' ' ' GLN . 6.3 mp -68.17 -45.81 72.44 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.553 179.477 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 373' ' ' LEU . . . . . 0.547 HD21 ' HA ' ' B' ' 363' ' ' ALA . 1.1 mp -59.08 -33.58 70.98 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.739 -0.664 . . . . 0.0 111.046 -179.898 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 374' ' ' SER . . . . . . . . . . . . . 47.7 t -74.16 -57.51 3.91 Favored 'General case' 0 C--O 1.236 0.344 0 CA-C-O 120.949 0.404 . . . . 0.0 110.673 179.794 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 375' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -54.35 -32.81 57.71 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.133 179.505 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 376' ' ' PHE . . . . . 0.465 ' O ' ' HB2' ' B' ' 379' ' ' PHE . 66.9 t80 -79.6 -31.36 41.71 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.02 179.196 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 377' ' ' GLY . . . . . . . . . . . . . . . -61.71 -33.17 84.2 Favored Glycine 0 N--CA 1.448 -0.532 0 C-N-CA 120.593 -0.813 . . . . 0.0 111.236 179.12 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 378' ' ' GLN . . . . . . . . . . . . . 23.8 mt-30 -69.53 -26.73 64.66 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.753 0.311 . . . . 0.0 110.884 179.303 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 379' ' ' PHE . . . . . 0.465 ' HB2' ' O ' ' B' ' 376' ' ' PHE . 12.9 m-85 -61.67 -38.22 86.95 Favored 'General case' 0 C--N 1.333 -0.14 0 CA-C-N 116.277 -0.419 . . . . 0.0 111.298 -179.9 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 380' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -53.22 141.43 41.09 Favored Pre-proline 0 C--N 1.331 -0.213 0 CA-C-N 116.523 -0.308 . . . . 0.0 110.62 -179.966 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 381' ' ' PRO . . . . . 0.63 ' HB3' ' H ' ' A' ' 377' ' ' ARG . 39.6 Cg_endo -66.65 145.71 76.72 Favored 'Trans proline' 0 C--N 1.346 0.405 0 C-N-CA 122.404 2.069 . . . . 0.0 112.164 -179.817 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 382' ' ' ASP . . . . . 0.415 ' H ' ' HG2' ' A' ' 377' ' ' ARG . 5.3 m-20 -94.73 108.28 20.28 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.019 179.994 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 383' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.027 0 CA-C-O 118.216 -0.897 . . . . 0.0 111.104 179.851 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 358' ' ' ASP . . . . . . . . . . . . . 3.9 p30 . . . . . 0 N--CA 1.485 1.308 0 CA-C-O 120.758 0.313 . . . . 0.0 110.87 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 359' ' ' PHE . . . . . . . . . . . . . 86.4 t80 -150.17 133.99 16.81 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.983 179.989 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 360' ' ' THR . . . . . . . . . . . . . 49.6 m -112.44 94.34 26.85 Favored Pre-proline 0 C--N 1.33 -0.265 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.039 179.877 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 361' ' ' PRO . . . . . . . . . . . . . 56.9 Cg_endo -71.07 -170.59 0.49 Allowed 'Trans proline' 0 C--N 1.347 0.492 0 C-N-CA 122.387 2.058 . . . . 0.0 112.512 -179.881 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 362' ' ' MET . . . . . 0.634 ' HG3' HD13 ' B' ' 329' ' ' LEU . 20.6 ttt -59.56 -71.52 0.12 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.996 -0.547 . . . . 0.0 111.043 -179.882 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 363' ' ' ASP . . . . . . . . . . . . . 16.7 t70 -174.42 -40.65 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.11 -179.822 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 364' ' ' SER . . . . . . . . . . . . . 48.4 t -111.09 -67.16 1.02 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.732 -0.667 . . . . 0.0 110.428 179.675 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 365' ' ' SER . . . . . . . . . . . . . 33.7 t -175.03 92.05 0.06 Allowed 'General case' 0 C--N 1.333 -0.149 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.958 179.761 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 366' ' ' ALA . . . . . . . . . . . . . . . -77.29 -34.13 55.61 Favored 'General case' 0 C--O 1.235 0.305 0 CA-C-O 121.326 0.584 . . . . 0.0 110.355 179.465 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 367' ' ' VAL . . . . . . . . . . . . . 35.2 m -62.16 -16.59 16.32 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 115.608 -0.724 . . . . 0.0 110.414 179.376 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 368' ' ' TYR . . . . . . . . . . . . . 66.9 t80 -71.39 -56.84 5.17 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.54 179.743 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 369' ' ' VAL . . . . . 0.586 HG11 ' HB3' ' B' ' 332' ' ' LEU . 3.4 p -61.21 -44.53 98.54 Favored 'Isoleucine or valine' 0 C--O 1.232 0.147 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.455 179.533 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 370' ' ' LEU . . . . . . . . . . . . . 91.9 mt -64.0 -36.49 84.16 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.71 179.821 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 371' ' ' SER . . . . . 0.545 ' HA ' ' HB3' ' B' ' 303' ' ' GLU . 29.9 t -60.85 -61.44 2.58 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.896 179.772 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 372' ' ' SER . . . . . 0.407 ' O ' ' HG3' ' A' ' 376' ' ' GLN . 79.3 p -57.43 -33.07 67.53 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.991 -179.783 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 373' ' ' MET . . . . . . . . . . . . . 52.3 ttm -58.93 -56.96 15.5 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.365 -179.804 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 374' ' ' ALA . . . . . 0.506 ' HB3' ' OE1' ' B' ' 303' ' ' GLU . . . -84.23 -6.92 59.46 Favored 'General case' 0 C--N 1.33 -0.246 0 N-CA-C 112.016 0.376 . . . . 0.0 112.016 -179.379 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 375' ' ' ARG . . . . . . . . . . . . . 21.2 tpp180 -80.97 -40.86 23.72 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.734 0.302 . . . . 0.0 110.753 179.94 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 376' ' ' GLN . . . . . 0.407 ' HG3' ' O ' ' A' ' 372' ' ' SER . 56.6 mt-30 -57.05 -82.51 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.882 179.843 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 377' ' ' ARG . . . . . . . . . . . . . 47.1 ttp180 51.86 24.78 2.67 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-O 121.085 0.469 . . . . 0.0 110.709 179.902 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 378' ' ' ARG . . . . . . . . . . . . . 98.2 mtt180 -77.24 142.36 39.58 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.988 -179.739 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 379' ' ' ALA . . . . . . . . . . . . . . . -147.14 -30.06 0.35 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.196 -0.457 . . . . 0.0 111.165 -179.975 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 380' ' ' SER . . . . . . . . . . . . . 59.1 p . . . . . 0 C--O 1.249 1.034 0 CA-C-O 118.323 -0.846 . . . . 0.0 110.885 -179.987 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' B' B ' 295' ' ' SER . . . . . . . . . . . . . 54.4 m . . . . . 0 N--CA 1.484 1.239 0 CA-C-O 120.769 0.319 . . . . 0.0 110.997 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' B' B ' 296' ' ' LEU . . . . . . . . . . . . . 78.1 mt -141.02 172.49 12.6 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.719 -179.916 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 297' ' ' GLN . . . . . . . . . . . . . 83.7 mm-40 -130.86 -36.65 1.35 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.813 179.803 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 298' ' ' ASN . . . . . . . . . . . . . 84.2 m-20 -106.52 171.21 7.48 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.85 179.861 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 299' ' ' ASN . . . . . . . . . . . . . 1.9 m-20 61.45 97.29 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.926 -179.96 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 300' ' ' GLN . . . . . 0.581 ' HB2' ' HD3' ' B' ' 301' ' ' PRO . 46.5 mt-30 -65.03 -49.57 66.7 Favored Pre-proline 0 CA--C 1.534 0.336 0 CA-C-N 116.198 -0.456 . . . . 0.0 111.371 -179.897 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 301' ' ' PRO . . . . . 0.581 ' HD3' ' HB2' ' B' ' 300' ' ' GLN . 23.3 Cg_exo -65.05 93.75 0.22 Allowed 'Trans proline' 0 C--N 1.355 0.889 0 C-N-CA 122.16 1.906 . . . . 0.0 112.078 179.812 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 302' ' ' VAL . . . . . 0.457 HG13 ' N ' ' B' ' 303' ' ' GLU . 4.2 p -92.17 -48.73 13.53 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.278 -179.964 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 303' ' ' GLU . . . . . 0.545 ' HB3' ' HA ' ' A' ' 371' ' ' SER . 72.7 mm-40 -67.32 -40.17 85.94 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.092 -0.504 . . . . 0.0 111.815 -179.314 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 304' ' ' PHE . . . . . . . . . . . . . 83.8 m-85 -58.85 -62.06 2.16 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.416 -179.482 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 305' ' ' ASN . . . . . . . . . . . . . 47.4 t-20 -59.59 -43.14 93.78 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.845 -179.228 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 306' ' ' HIS . . . . . . . . . . . . . 7.0 t-160 -61.29 -65.4 0.7 Allowed 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 111.881 0.326 . . . . 0.0 111.881 -179.063 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 307' ' ' ALA . . . . . . . . . . . . . . . -54.23 -43.86 71.23 Favored 'General case' 0 C--N 1.33 -0.242 0 N-CA-C 112.147 0.425 . . . . 0.0 112.147 -179.036 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 308' ' ' ILE . . . . . . . . . . . . . 62.7 mt -58.87 -54.75 29.48 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-O 120.676 0.274 . . . . 0.0 111.393 -179.735 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 309' ' ' ASN . . . . . 0.535 ' N ' HD22 ' B' ' 309' ' ' ASN . 0.9 OUTLIER -58.47 -30.88 67.32 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.835 0.35 . . . . 0.0 111.041 -179.962 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 310' ' ' TYR . . . . . 0.421 ' O ' ' HG3' ' B' ' 313' ' ' LYS . 24.0 t80 -65.38 -62.3 1.61 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.83 179.967 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 311' ' ' VAL . . . . . . . . . . . . . 56.4 t -61.3 -23.37 30.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.975 179.94 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 312' ' ' ASN . . . . . . . . . . . . . 27.2 t-20 -69.45 -56.72 6.6 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.486 -179.6 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 313' ' ' LYS . . . . . 0.421 ' HG3' ' O ' ' B' ' 310' ' ' TYR . 0.0 OUTLIER -64.69 -33.45 75.97 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.362 -0.381 . . . . 0.0 111.372 -179.381 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 314' ' ' ILE . . . . . . . . . . . . . 79.3 mt -72.22 -36.92 57.49 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-O 120.755 0.312 . . . . 0.0 111.278 179.774 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 315' ' ' LYS . . . . . . . . . . . . . 25.8 ttpp -67.93 -45.76 73.38 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.37 -0.377 . . . . 0.0 111.095 -179.761 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 316' ' ' ASN . . . . . . . . . . . . . 52.1 t-20 -68.58 -48.74 63.43 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.187 -0.461 . . . . 0.0 111.317 -179.625 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 317' ' ' ARG . . . . . . . . . . . . . 49.5 ttt180 -59.48 -64.2 1.03 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.481 -179.474 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 318' ' ' PHE . . . . . . . . . . . . . 96.8 m-85 -84.38 33.08 0.5 Allowed 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.323 -179.59 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 319' ' ' GLN . . . . . . . . . . . . . 7.1 tp60 -64.87 -20.16 66.28 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.416 -0.356 . . . . 0.0 110.702 179.795 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 320' ' ' GLY . . . . . . . . . . . . . . . -85.72 -21.15 54.45 Favored Glycine 0 C--N 1.33 0.213 0 C-N-CA 120.858 -0.687 . . . . 0.0 112.626 179.936 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 321' ' ' GLN . . . . . . . . . . . . . 29.6 mm-40 -106.87 96.45 14.71 Favored Pre-proline 0 C--N 1.33 -0.261 0 CA-C-O 120.539 0.209 . . . . 0.0 110.809 179.91 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 322' ' ' PRO . . . . . . . . . . . . . 86.7 Cg_endo -78.4 -28.46 4.51 Favored 'Trans proline' 0 C--N 1.348 0.537 0 C-N-CA 122.417 2.078 . . . . 0.0 112.72 -179.817 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 323' ' ' ASP . . . . . . . . . . . . . 31.3 m-20 -65.29 -48.01 74.64 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.354 -0.384 . . . . 0.0 111.103 -179.725 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 324' ' ' ILE . . . . . . . . . . . . . 71.6 mt -66.2 -47.25 85.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.236 -179.962 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 325' ' ' TYR . . . . . 0.404 ' CE2' HD11 ' B' ' 329' ' ' LEU . 41.1 t80 -55.82 -57.73 10.8 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.982 -179.989 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 326' ' ' LYS . . . . . 0.476 ' O ' ' HG3' ' B' ' 330' ' ' GLU . 98.5 mttt -55.53 -48.85 74.04 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.046 -0.524 . . . . 0.0 111.259 -179.898 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 327' ' ' ALA . . . . . . . . . . . . . . . -49.08 -51.67 30.22 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.372 -0.377 . . . . 0.0 111.231 -179.922 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 328' ' ' PHE . . . . . . . . . . . . . 84.1 t80 -56.33 -46.03 80.07 Favored 'General case' 0 C--O 1.235 0.324 0 CA-C-N 116.191 -0.459 . . . . 0.0 109.975 179.316 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 329' ' ' LEU . . . . . 0.634 HD13 ' HG3' ' A' ' 362' ' ' MET . 83.5 mt -58.71 -31.22 68.06 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 115.711 -0.677 . . . . 0.0 110.186 179.042 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 330' ' ' GLU . . . . . 0.476 ' HG3' ' O ' ' B' ' 326' ' ' LYS . 38.8 mt-10 -71.73 -36.05 70.36 Favored 'General case' 0 C--N 1.333 -0.13 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.679 179.65 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 331' ' ' ILE . . . . . . . . . . . . . 61.5 mt -65.48 -47.8 85.32 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.152 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.872 179.881 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 332' ' ' LEU . . . . . 0.586 ' HB3' HG11 ' A' ' 369' ' ' VAL . 14.0 mt -67.36 -37.82 83.8 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.412 -0.358 . . . . 0.0 110.899 179.97 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 333' ' ' HIS . . . . . . . . . . . . . 48.4 t-80 -61.29 -57.89 10.52 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.649 179.635 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 334' ' ' THR . . . . . 0.448 HG22 HD13 ' B' ' 353' ' ' LEU . 86.3 m -59.56 -35.17 73.73 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.915 -0.584 . . . . 0.0 111.005 179.842 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 335' ' ' TYR . . . . . . . . . . . . . 83.4 t80 -61.1 -60.35 3.9 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.902 -179.935 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 336' ' ' GLN . . . . . 0.64 HE21 ' HA ' ' B' ' 336' ' ' GLN . 0.0 OUTLIER -56.98 -33.62 67.28 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.715 -179.856 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 337' ' ' LYS . . . . . . . . . . . . . 23.9 ttmm -59.02 -54.27 48.97 Favored 'General case' 0 C--O 1.234 0.251 0 CA-C-O 120.971 0.415 . . . . 0.0 110.528 179.296 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 338' ' ' GLU . . . . . . . . . . . . . 26.2 mm-40 -60.05 -33.69 72.39 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.296 179.468 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 339' ' ' GLN . . . . . . . . . . . . . 57.7 tp60 -64.1 -43.5 95.17 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.464 179.549 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 340' ' ' ARG . . . . . . . . . . . . . 94.7 mtt180 -61.83 -53.89 49.67 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.597 179.68 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 341' ' ' ASN . . . . . . . . . . . . . 47.9 t-20 -57.6 -33.05 67.8 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.507 179.696 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 342' ' ' ALA . . . . . . . . . . . . . . . -65.91 -43.28 88.62 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.937 -0.574 . . . . 0.0 111.023 179.917 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 343' ' ' LYS . . . . . . . . . . . . . 88.2 tttt -66.93 -39.79 87.42 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.839 179.965 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 344' ' ' GLU . . . . . . . . . . . . . 12.6 mm-40 -69.54 -31.79 70.21 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.898 -179.978 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 345' ' ' ALA . . . . . . . . . . . . . . . -66.43 -24.7 66.5 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.243 -179.878 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 346' ' ' GLY . . . . . . . . . . . . . . . 63.99 41.86 98.45 Favored Glycine 0 N--CA 1.452 -0.262 0 C-N-CA 120.873 -0.68 . . . . 0.0 112.47 179.992 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 347' ' ' GLY . . . . . . . . . . . . . . . 96.6 178.77 35.22 Favored Glycine 0 N--CA 1.452 -0.237 0 C-N-CA 120.762 -0.732 . . . . 0.0 112.665 179.806 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 348' ' ' ASN . . . . . . . . . . . . . 13.7 m120 59.81 13.93 3.85 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-O 120.749 0.309 . . . . 0.0 111.256 179.913 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 349' ' ' TYR . . . . . . . . . . . . . 62.5 t80 -114.24 137.2 52.08 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.843 179.929 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 350' ' ' THR . . . . . . . . . . . . . 90.8 m -110.41 96.95 29.36 Favored Pre-proline 0 C--N 1.331 -0.228 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.019 -179.957 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 351' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_exo -51.41 137.16 48.15 Favored 'Trans proline' 0 C--N 1.349 0.564 0 C-N-CA 122.476 2.118 . . . . 0.0 112.057 179.846 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 352' ' ' ALA . . . . . . . . . . . . . . . -64.32 -58.99 4.92 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.11 -0.495 . . . . 0.0 111.562 -179.485 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 353' ' ' LEU . . . . . 0.448 HD13 HG22 ' B' ' 334' ' ' THR . 6.7 mp -101.12 128.93 46.97 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.923 0.392 . . . . 0.0 111.535 -179.536 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 354' ' ' THR . . . . . . . . . . . . . 61.6 p -113.1 -173.9 2.35 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.528 179.429 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 355' ' ' GLU . . . . . . . . . . . . . 31.2 mt-10 -58.59 -35.2 72.04 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.992 0.425 . . . . 0.0 110.578 179.783 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 356' ' ' GLN . . . . . . . . . . . . . 8.6 tt0 -73.86 -37.91 64.63 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.887 -0.597 . . . . 0.0 111.01 -179.881 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 357' ' ' GLU . . . . . 0.436 ' HG2' ' HG ' ' B' ' 353' ' ' LEU . 6.9 tp10 -62.5 -45.83 91.23 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-O 120.925 0.393 . . . . 0.0 110.575 179.998 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 358' ' ' VAL . . . . . 0.52 ' O ' HG23 ' B' ' 362' ' ' VAL . 70.5 t -66.76 -58.19 7.36 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.02 -0.536 . . . . 0.0 111.114 179.933 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 359' ' ' TYR . . . . . . . . . . . . . 40.3 t80 -52.09 -32.43 34.9 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.611 -0.268 . . . . 0.0 111.087 -179.626 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 360' ' ' ALA . . . . . . . . . . . . . . . -68.91 -56.51 7.66 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.412 -0.358 . . . . 0.0 111.043 179.868 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 361' ' ' GLN . . . . . . . . . . . . . 53.4 mt-30 -57.01 -44.35 82.74 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.73 179.872 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 362' ' ' VAL . . . . . 0.52 HG23 ' O ' ' B' ' 358' ' ' VAL . 45.2 t -65.56 -32.96 60.49 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.524 179.84 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 363' ' ' ALA . . . . . 0.693 ' HA ' HD21 ' B' ' 373' ' ' LEU . . . -62.48 -51.67 66.53 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.722 179.645 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 364' ' ' ARG . . . . . . . . . . . . . 96.7 mtt180 -75.1 -18.38 60.27 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.625 179.58 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 365' ' ' LEU . . . . . . . . . . . . . 7.2 tp -59.66 -31.91 69.98 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.731 179.894 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 366' ' ' PHE . . . . . . . . . . . . . 58.4 m-85 -118.16 173.32 6.86 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.57 179.8 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 367' ' ' LYS . . . . . . . . . . . . . 47.3 mmtm -129.25 -78.16 0.55 Allowed 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.754 0.312 . . . . 0.0 111.373 -179.775 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 368' ' ' ASN . . . . . . . . . . . . . 7.5 t30 -82.95 -10.17 58.93 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.142 -179.65 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 369' ' ' GLN . . . . . . . . . . . . . 19.5 mp0 -94.2 87.59 5.31 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.411 -0.359 . . . . 0.0 111.143 -179.784 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 370' ' ' GLU . . . . . . . . . . . . . 44.0 mt-10 -94.45 -10.59 31.89 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.726 179.516 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 371' ' ' ASP . . . . . . . . . . . . . 13.8 t70 -58.48 -38.05 76.81 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.429 179.674 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 372' ' ' LEU . . . . . 0.45 ' H ' HD12 ' B' ' 372' ' ' LEU . 6.0 mp -70.12 -39.2 75.6 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.905 -0.588 . . . . 0.0 110.49 179.316 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 373' ' ' LEU . . . . . 0.693 HD21 ' HA ' ' B' ' 363' ' ' ALA . 1.4 mp -65.73 -36.27 83.12 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.582 -0.735 . . . . 0.0 111.305 -179.702 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 374' ' ' SER . . . . . . . . . . . . . 87.8 p -71.72 -51.18 24.16 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.883 0.373 . . . . 0.0 110.287 179.663 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 375' ' ' GLU . . . . . . . . . . . . . 11.1 mm-40 -58.33 -33.38 69.45 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.263 179.347 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 376' ' ' PHE . . . . . 0.436 ' HA ' ' HB2' ' B' ' 379' ' ' PHE . 64.6 t80 -80.8 -29.7 36.0 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.151 179.373 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 377' ' ' GLY . . . . . . . . . . . . . . . -62.84 -40.13 98.87 Favored Glycine 0 N--CA 1.45 -0.412 0 C-N-CA 120.715 -0.755 . . . . 0.0 111.388 179.267 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 378' ' ' GLN . . . . . . . . . . . . . 12.9 mm100 -78.04 -16.89 57.68 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.053 0.454 . . . . 0.0 110.093 179.074 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 379' ' ' PHE . . . . . 0.436 ' HB2' ' HA ' ' B' ' 376' ' ' PHE . 0.2 OUTLIER -68.31 -42.3 79.61 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.714 -0.675 . . . . 0.0 110.622 179.803 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 380' ' ' LEU . . . . . . . . . . . . . 64.0 mt -56.82 147.32 53.74 Favored Pre-proline 0 C--N 1.33 -0.247 0 CA-C-N 116.013 -0.54 . . . . 0.0 110.866 -179.932 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 381' ' ' PRO . . . . . . . . . . . . . 70.9 Cg_exo -48.79 108.71 0.2 Allowed 'Trans proline' 0 C--N 1.347 0.497 0 C-N-CA 122.68 2.253 . . . . 0.0 112.554 -179.989 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 382' ' ' ASP . . . . . . . . . . . . . 7.9 m-20 -85.02 -172.05 3.97 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.879 179.918 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 383' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.074 0 CA-C-O 118.23 -0.89 . . . . 0.0 111.222 -179.924 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 358' ' ' ASP . . . . . . . . . . . . . 6.2 m-20 . . . . . 0 N--CA 1.486 1.327 0 CA-C-O 120.822 0.344 . . . . 0.0 110.98 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 359' ' ' PHE . . . . . . . . . . . . . 48.7 p90 -158.15 165.87 33.87 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.758 179.974 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 360' ' ' THR . . . . . . . . . . . . . 61.1 p -128.8 130.72 23.47 Favored Pre-proline 0 C--N 1.33 -0.252 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.955 179.88 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 361' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.17 -162.24 0.08 OUTLIER 'Trans proline' 0 C--N 1.348 0.502 0 C-N-CA 122.436 2.09 . . . . 0.0 112.242 -179.933 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 362' ' ' MET . . . . . 0.512 ' HG3' HD13 ' B' ' 329' ' ' LEU . 23.8 ttt -51.39 -50.22 60.03 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.911 -179.99 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 363' ' ' ASP . . . . . . . . . . . . . 18.5 t70 -171.13 -71.5 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.581 179.962 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 364' ' ' SER . . . . . . . . . . . . . 34.6 t -174.96 20.55 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.541 179.953 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 365' ' ' SER . . . . . 0.601 ' HB2' HE22 ' B' ' 336' ' ' GLN . 80.4 p -124.93 -39.77 2.23 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.403 -179.799 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 366' ' ' ALA . . . . . . . . . . . . . . . -53.68 -44.03 69.37 Favored 'General case' 0 C--O 1.233 0.209 0 CA-C-O 120.786 0.327 . . . . 0.0 111.418 -179.664 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 367' ' ' VAL . . . . . . . . . . . . . 20.6 m -60.36 -30.29 45.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.232 179.911 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 368' ' ' TYR . . . . . . . . . . . . . 37.1 t80 -75.87 -40.54 54.35 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.991 -179.76 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 369' ' ' VAL . . . . . 0.45 HG22 ' HB2' ' B' ' 336' ' ' GLN . 20.1 t -63.31 -43.56 98.69 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.162 -179.923 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 370' ' ' LEU . . . . . . . . . . . . . 96.5 mt -71.37 -47.14 58.14 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.018 179.93 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 371' ' ' SER . . . . . 0.474 ' HA ' ' HB2' ' B' ' 303' ' ' GLU . 79.7 p -58.92 -33.0 70.07 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.219 -179.859 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 372' ' ' SER . . . . . . . . . . . . . 79.1 p -76.82 -58.01 3.52 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.417 -0.356 . . . . 0.0 111.409 -179.475 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 373' ' ' MET . . . . . . . . . . . . . 20.4 ptm -55.59 -26.81 45.84 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.382 -0.372 . . . . 0.0 111.605 -179.451 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 374' ' ' ALA . . . . . . . . . . . . . . . -87.04 -44.04 11.87 Favored 'General case' 0 C--N 1.33 -0.271 0 N-CA-C 111.692 0.256 . . . . 0.0 111.692 -179.722 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 375' ' ' ARG . . . . . 0.658 ' HB2' ' HG2' ' B' ' 303' ' ' GLU . 21.4 tpp180 -64.89 -26.67 68.42 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.83 0.348 . . . . 0.0 110.753 -179.969 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 376' ' ' GLN . . . . . . . . . . . . . 15.1 mm100 -69.59 -7.32 37.58 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.045 179.852 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 377' ' ' ARG . . . . . 0.644 ' HG3' ' H ' ' B' ' 382' ' ' ASP . 74.2 ttt180 -58.99 -37.63 77.31 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.907 0.384 . . . . 0.0 110.609 179.69 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 378' ' ' ARG . . . . . 0.449 HH11 ' HD3' ' A' ' 377' ' ' ARG . 0.1 OUTLIER -100.95 146.45 27.37 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.848 179.884 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 379' ' ' ALA . . . . . . . . . . . . . . . -90.66 120.33 31.64 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.05 179.972 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 380' ' ' SER . . . . . . . . . . . . . 68.8 p . . . . . 0 C--O 1.249 1.047 0 CA-C-O 118.128 -0.939 . . . . 0.0 110.946 -179.973 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' B' B ' 295' ' ' SER . . . . . . . . . . . . . 52.6 m . . . . . 0 N--CA 1.484 1.266 0 CA-C-O 120.692 0.282 . . . . 0.0 110.958 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' B' B ' 296' ' ' LEU . . . . . . . . . . . . . 59.1 mt 60.7 100.73 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.148 179.905 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 297' ' ' GLN . . . . . . . . . . . . . 57.3 tp60 -163.61 -42.95 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.835 179.977 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 298' ' ' ASN . . . . . . . . . . . . . 26.1 p-10 -137.91 15.11 2.88 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.815 -179.911 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 299' ' ' ASN . . . . . . . . . . . . . 13.7 m120 -85.59 1.24 49.95 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.119 -0.492 . . . . 0.0 111.128 -179.816 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 300' ' ' GLN . . . . . 0.507 ' N ' ' HD2' ' B' ' 301' ' ' PRO . 6.1 tp-100 -82.51 -51.09 0.75 Allowed Pre-proline 0 CA--C 1.534 0.363 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.425 -179.935 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 301' ' ' PRO . . . . . 0.605 ' HB2' ' HB3' ' B' ' 304' ' ' PHE . 54.3 Cg_endo -69.24 118.93 5.98 Favored 'Trans proline' 0 C--N 1.354 0.819 0 C-N-CA 122.09 1.86 . . . . 0.0 112.124 179.883 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 302' ' ' VAL . . . . . 0.52 HG23 ' H ' ' B' ' 303' ' ' GLU . 8.8 m -92.12 -55.15 6.46 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.752 -179.738 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 303' ' ' GLU . . . . . 0.658 ' HG2' ' HB2' ' A' ' 375' ' ' ARG . 0.0 OUTLIER -72.26 -30.92 65.31 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.266 -0.425 . . . . 0.0 111.72 -179.273 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 304' ' ' PHE . . . . . 0.605 ' HB3' ' HB2' ' B' ' 301' ' ' PRO . 84.7 t80 -72.65 -51.05 21.14 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.678 0.275 . . . . 0.0 110.915 -179.663 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 305' ' ' ASN . . . . . 0.496 HD22 HD11 ' B' ' 308' ' ' ILE . 3.0 t-20 -64.46 -40.39 95.62 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.858 -179.975 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 306' ' ' HIS . . . . . . . . . . . . . 15.6 t-160 -66.8 -39.48 87.75 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.344 -0.389 . . . . 0.0 111.011 179.954 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 307' ' ' ALA . . . . . . . . . . . . . . . -67.09 -49.93 63.31 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.39 -0.368 . . . . 0.0 111.58 -179.712 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 308' ' ' ILE . . . . . 0.496 HD11 HD22 ' B' ' 305' ' ' ASN . 47.6 pt -62.38 -38.41 81.16 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.221 0 CA-C-O 120.682 0.277 . . . . 0.0 111.204 -179.681 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 309' ' ' ASN . . . . . 0.427 ' N ' HG13 ' B' ' 308' ' ' ILE . 95.9 m-20 -70.41 -32.64 70.34 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.404 -0.362 . . . . 0.0 110.605 179.681 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 310' ' ' TYR . . . . . . . . . . . . . 49.3 t80 -67.07 -51.63 52.07 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.607 179.808 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 311' ' ' VAL . . . . . . . . . . . . . 97.8 t -60.27 -43.8 94.25 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.212 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.605 179.338 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 312' ' ' ASN . . . . . . . . . . . . . 2.9 t-20 -64.37 -31.69 72.99 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.513 179.578 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 313' ' ' LYS . . . . . . . . . . . . . 20.6 tttp -65.04 -56.8 10.95 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.912 -0.586 . . . . 0.0 110.672 179.648 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 314' ' ' ILE . . . . . . . . . . . . . 30.3 mt -62.61 -28.87 45.65 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.777 -179.912 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 315' ' ' LYS . . . . . . . . . . . . . 22.1 ttmm -70.47 -36.75 74.07 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.74 179.726 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 316' ' ' ASN . . . . . . . . . . . . . 66.5 m-20 -82.23 -58.78 2.8 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.942 -0.572 . . . . 0.0 111.445 -179.8 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 317' ' ' ARG . . . . . . . . . . . . . 25.4 tpp180 -54.13 -64.4 0.84 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.096 179.988 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 318' ' ' PHE . . . . . . . . . . . . . 91.6 m-85 -86.71 42.8 1.03 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.97 179.896 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 319' ' ' GLN . . . . . . . . . . . . . 6.6 tp-100 -68.39 -22.57 64.63 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.821 179.904 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 320' ' ' GLY . . . . . . . . . . . . . . . -89.02 -15.77 58.76 Favored Glycine 0 N--CA 1.452 -0.291 0 C-N-CA 120.761 -0.733 . . . . 0.0 112.507 179.969 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 321' ' ' GLN . . . . . . . . . . . . . 2.2 mp0 -111.24 91.89 14.56 Favored Pre-proline 0 C--N 1.33 -0.267 0 CA-C-O 120.586 0.231 . . . . 0.0 110.958 -179.975 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 322' ' ' PRO . . . . . . . . . . . . . 96.7 Cg_endo -82.24 -18.28 7.37 Favored 'Trans proline' 0 C--N 1.348 0.513 0 C-N-CA 122.625 2.217 . . . . 0.0 112.392 179.875 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 323' ' ' ASP . . . . . . . . . . . . . 18.0 t70 -69.65 -50.58 42.76 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.701 -179.907 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 324' ' ' ILE . . . . . . . . . . . . . 56.3 mt -64.58 -43.86 96.76 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-N 116.081 -0.508 . . . . 0.0 110.85 179.857 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 325' ' ' TYR . . . . . 0.402 ' O ' ' HG ' ' B' ' 329' ' ' LEU . 25.8 t80 -59.61 -48.18 82.67 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.647 179.822 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 326' ' ' LYS . . . . . . . . . . . . . 60.6 tttm -60.05 -45.51 92.63 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.937 -179.972 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 327' ' ' ALA . . . . . . . . . . . . . . . -55.08 -50.47 69.08 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.123 179.944 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 328' ' ' PHE . . . . . . . . . . . . . 66.3 t80 -55.78 -49.33 73.45 Favored 'General case' 0 C--O 1.234 0.273 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.53 179.781 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 329' ' ' LEU . . . . . 0.512 HD13 ' HG3' ' A' ' 362' ' ' MET . 93.1 mt -56.26 -34.3 66.28 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.53 179.541 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 330' ' ' GLU . . . . . . . . . . . . . 19.4 mm-40 -69.56 -37.45 77.02 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.869 179.85 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 331' ' ' ILE . . . . . 0.513 HG22 HG22 ' B' ' 358' ' ' VAL . 71.0 mt -62.48 -48.21 89.36 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-N 116.391 -0.368 . . . . 0.0 110.433 179.358 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 332' ' ' LEU . . . . . . . . . . . . . 10.7 mp -68.53 -31.03 69.97 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.97 179.786 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 333' ' ' HIS . . . . . . . . . . . . . 40.4 t60 -63.97 -59.52 4.39 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.93 0.395 . . . . 0.0 110.231 179.532 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 334' ' ' THR . . . . . 0.416 HG22 HD13 ' B' ' 353' ' ' LEU . 94.6 m -58.03 -38.97 77.22 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.87 -0.604 . . . . 0.0 110.471 179.366 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 335' ' ' TYR . . . . . . . . . . . . . 75.2 t80 -58.14 -43.85 87.51 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.744 -0.662 . . . . 0.0 110.306 179.509 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 336' ' ' GLN . . . . . 0.601 HE22 ' HB2' ' A' ' 365' ' ' SER . 8.1 tt0 -64.57 -42.57 95.55 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.769 -0.651 . . . . 0.0 110.802 179.974 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 337' ' ' LYS . . . . . . . . . . . . . 28.2 ttpp -58.3 -41.38 84.35 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.734 179.82 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 338' ' ' GLU . . . . . . . . . . . . . 24.9 mm-40 -66.13 -42.23 89.43 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.884 179.661 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 339' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -59.97 -49.29 78.24 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.13 -0.487 . . . . 0.0 110.593 179.668 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 340' ' ' ARG . . . . . . . . . . . . . 99.6 mtt180 -57.0 -53.82 53.7 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.896 179.867 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 341' ' ' ASN . . . . . . . . . . . . . 14.6 m120 -53.63 -38.47 64.1 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.936 179.923 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 342' ' ' ALA . . . . . . . . . . . . . . . -68.41 -32.95 73.36 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.92 179.875 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 343' ' ' LYS . . . . . . . . . . . . . 61.2 tttp -68.94 -49.23 59.85 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.092 -0.504 . . . . 0.0 111.006 179.822 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 344' ' ' GLU . . . . . . . . . . . . . 14.8 mm-40 -65.15 -36.03 82.97 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.236 -179.817 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 345' ' ' ALA . . . . . . . . . . . . . . . -57.82 -37.48 73.89 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.253 -179.965 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 346' ' ' GLY . . . . . . . . . . . . . . . 70.97 58.36 5.73 Favored Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 120.72 -0.752 . . . . 0.0 112.37 -179.856 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 347' ' ' GLY . . . . . . . . . . . . . . . 79.35 179.02 51.75 Favored Glycine 0 N--CA 1.45 -0.368 0 C-N-CA 120.773 -0.727 . . . . 0.0 112.397 -179.854 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 348' ' ' ASN . . . . . . . . . . . . . 18.5 m120 57.13 20.43 5.57 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.598 0.237 . . . . 0.0 111.283 179.988 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 349' ' ' TYR . . . . . . . . . . . . . 50.0 t80 -122.45 146.53 47.28 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.424 -0.353 . . . . 0.0 110.918 -180.0 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 350' ' ' THR . . . . . . . . . . . . . 59.8 m -120.71 101.46 45.7 Favored Pre-proline 0 C--N 1.328 -0.341 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.017 -179.866 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 351' ' ' PRO . . . . . . . . . . . . . 46.2 Cg_exo -56.36 170.67 1.13 Allowed 'Trans proline' 0 C--N 1.35 0.619 0 C-N-CA 122.505 2.137 . . . . 0.0 112.126 179.795 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 352' ' ' ALA . . . . . . . . . . . . . . . -98.41 -69.44 0.76 Allowed 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.378 -0.374 . . . . 0.0 111.458 -179.858 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 353' ' ' LEU . . . . . 0.446 ' HG ' ' HG2' ' B' ' 357' ' ' GLU . 6.2 mp -87.62 119.68 28.16 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.308 -0.405 . . . . 0.0 111.205 -179.777 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 354' ' ' THR . . . . . . . . . . . . . 81.7 p -107.42 -175.16 2.71 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.978 -0.556 . . . . 0.0 110.368 179.342 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 355' ' ' GLU . . . . . . . . . . . . . 39.9 mt-10 -54.36 -35.93 63.29 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.056 0.455 . . . . 0.0 110.484 179.718 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 356' ' ' GLN . . . . . . . . . . . . . 22.6 mt-30 -72.93 -41.22 64.75 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.928 -179.998 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 357' ' ' GLU . . . . . 0.446 ' HG2' ' HG ' ' B' ' 353' ' ' LEU . 5.3 tp10 -57.52 -50.72 72.14 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.933 0.397 . . . . 0.0 110.58 -179.914 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 358' ' ' VAL . . . . . 0.559 ' O ' HG23 ' B' ' 362' ' ' VAL . 55.0 t -64.33 -58.88 5.38 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 115.982 -0.554 . . . . 0.0 111.013 179.887 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 359' ' ' TYR . . . . . . . . . . . . . 39.0 t80 -51.14 -27.16 7.87 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.491 -0.322 . . . . 0.0 111.279 -179.452 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 360' ' ' ALA . . . . . . . . . . . . . . . -74.09 -54.21 8.31 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.77 0.319 . . . . 0.0 110.838 179.59 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 361' ' ' GLN . . . . . . . . . . . . . 77.2 mt-30 -60.54 -36.01 77.39 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.527 179.705 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 362' ' ' VAL . . . . . 0.559 HG23 ' O ' ' B' ' 358' ' ' VAL . 51.2 t -70.02 -40.31 78.38 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.214 0 CA-C-N 116.013 -0.54 . . . . 0.0 110.347 179.538 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 363' ' ' ALA . . . . . 0.606 ' HA ' HD21 ' B' ' 373' ' ' LEU . . . -61.82 -38.09 86.86 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.346 179.414 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 364' ' ' ARG . . . . . . . . . . . . . 38.3 ttm180 -80.08 -23.84 41.02 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.783 -0.644 . . . . 0.0 110.146 179.317 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 365' ' ' LEU . . . . . . . . . . . . . 2.5 tp -60.64 -29.03 69.0 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.487 179.627 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 366' ' ' PHE . . . . . . . . . . . . . 25.0 m-85 -125.55 -177.98 4.09 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.38 179.747 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 367' ' ' LYS . . . . . . . . . . . . . 68.4 mttm -137.4 -82.87 0.34 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.399 -0.364 . . . . 0.0 111.164 179.919 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 368' ' ' ASN . . . . . . . . . . . . . 27.6 p-10 -82.65 1.03 40.39 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.802 0.334 . . . . 0.0 110.918 179.995 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 369' ' ' GLN . . . . . 0.409 ' HB3' HD13 ' B' ' 372' ' ' LEU . 21.2 mp0 -98.32 58.14 1.26 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.6 179.842 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 370' ' ' GLU . . . . . . . . . . . . . 41.2 mt-10 -69.78 -13.0 62.06 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.852 -179.928 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 371' ' ' ASP . . . . . . . . . . . . . 11.6 m-20 -55.58 -39.69 71.03 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.459 179.809 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 372' ' ' LEU . . . . . 0.421 ' H ' HD12 ' B' ' 372' ' ' LEU . 6.2 mp -69.97 -37.99 75.95 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.567 179.649 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 373' ' ' LEU . . . . . 0.606 HD21 ' HA ' ' B' ' 363' ' ' ALA . 2.7 mp -62.19 -34.65 76.85 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.844 179.828 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 374' ' ' SER . . . . . . . . . . . . . 51.0 m -73.44 -55.66 6.07 Favored 'General case' 0 C--O 1.234 0.28 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.261 179.335 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 375' ' ' GLU . . . . . . . . . . . . . 43.0 mt-10 -54.91 -33.25 61.89 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-N 115.934 -0.576 . . . . 0.0 110.26 179.357 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 376' ' ' PHE . . . . . 0.429 ' O ' ' HB2' ' B' ' 379' ' ' PHE . 87.3 t80 -82.27 -30.21 30.77 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.025 179.333 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 377' ' ' GLY . . . . . . . . . . . . . . . -61.93 -33.51 85.74 Favored Glycine 0 N--CA 1.448 -0.564 0 C-N-CA 120.474 -0.87 . . . . 0.0 111.207 179.114 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 378' ' ' GLN . . . . . . . . . . . . . 98.1 mt-30 -69.75 -29.25 66.56 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.798 0.332 . . . . 0.0 110.56 179.155 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 379' ' ' PHE . . . . . 0.429 ' HB2' ' O ' ' B' ' 376' ' ' PHE . 10.2 m-85 -61.15 -40.35 93.51 Favored 'General case' 0 C--N 1.333 -0.123 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.639 179.541 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 380' ' ' LEU . . . . . . . . . . . . . 95.3 mt -58.19 136.26 84.65 Favored Pre-proline 0 C--N 1.33 -0.265 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.526 179.848 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 381' ' ' PRO . . . . . . . . . . . . . 51.5 Cg_exo -52.73 120.38 7.45 Favored 'Trans proline' 0 C--N 1.348 0.508 0 C-N-CA 122.377 2.051 . . . . 0.0 112.251 -179.574 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 382' ' ' ASP . . . . . 0.644 ' H ' ' HG3' ' A' ' 377' ' ' ARG . 15.4 t70 -88.75 121.68 31.38 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.279 -0.418 . . . . 0.0 110.971 179.966 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 383' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.094 0 CA-C-O 118.21 -0.9 . . . . 0.0 111.086 179.991 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 358' ' ' ASP . . . . . . . . . . . . . 4.2 p30 . . . . . 0 N--CA 1.486 1.366 0 CA-C-O 120.771 0.319 . . . . 0.0 110.884 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 359' ' ' PHE . . . . . . . . . . . . . 81.0 t80 -154.5 133.95 12.68 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.865 179.987 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 360' ' ' THR . . . . . . . . . . . . . 65.1 p -94.24 151.71 39.72 Favored Pre-proline 0 C--N 1.329 -0.293 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.962 179.79 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 361' ' ' PRO . . . . . . . . . . . . . 28.1 Cg_endo -62.16 -172.29 0.11 Allowed 'Trans proline' 0 C--N 1.349 0.562 0 C-N-CA 122.509 2.139 . . . . 0.0 112.418 -179.852 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 362' ' ' MET . . . . . 0.401 ' SD ' ' HB3' ' B' ' 329' ' ' LEU . 26.6 ttt -52.23 -62.77 1.43 Allowed 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.842 -179.814 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 363' ' ' ASP . . . . . . . . . . . . . 15.6 t70 -170.7 -72.08 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.59 179.915 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 364' ' ' SER . . . . . . . . . . . . . 67.4 m -160.58 9.62 0.09 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.765 179.973 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 365' ' ' SER . . . . . . . . . . . . . 48.1 t -101.72 -52.13 3.27 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.282 -179.622 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 366' ' ' ALA . . . . . . . . . . . . . . . -58.55 -45.15 89.54 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.871 0.367 . . . . 0.0 111.353 -179.818 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 367' ' ' VAL . . . . . . . . . . . . . 28.0 m -68.3 -29.51 44.54 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.354 -179.925 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 368' ' ' TYR . . . . . . . . . . . . . 71.3 t80 -72.1 -47.65 49.7 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.47 -0.332 . . . . 0.0 111.252 -179.749 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 369' ' ' VAL . . . . . 0.413 ' O ' ' HB2' ' A' ' 373' ' ' MET . 13.3 m -64.58 -48.37 85.13 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.487 -0.324 . . . . 0.0 111.273 -179.846 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 370' ' ' LEU . . . . . 0.583 HD23 ' HA ' ' B' ' 307' ' ' ALA . 8.3 mp -62.97 -42.92 99.97 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.645 -0.252 . . . . 0.0 111.362 179.997 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 371' ' ' SER . . . . . 0.424 ' O ' ' HB2' ' A' ' 375' ' ' ARG . 88.7 p -57.46 -60.3 3.86 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.481 -0.327 . . . . 0.0 110.942 179.957 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 372' ' ' SER . . . . . . . . . . . . . 44.1 t -62.96 -24.2 67.77 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.31 -0.405 . . . . 0.0 111.15 -179.783 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 373' ' ' MET . . . . . 0.413 ' HB2' ' O ' ' A' ' 369' ' ' VAL . 50.6 tpp -65.11 -49.16 71.06 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.797 0.332 . . . . 0.0 111.196 -179.939 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 374' ' ' ALA . . . . . . . . . . . . . . . -85.32 -17.37 37.03 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.818 -179.391 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 375' ' ' ARG . . . . . 0.424 ' HB2' ' O ' ' A' ' 371' ' ' SER . 0.0 OUTLIER -88.3 -22.21 24.01 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.712 0.291 . . . . 0.0 111.083 -179.68 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 376' ' ' GLN . . . . . . . . . . . . . 57.6 tp60 -59.94 -82.97 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.429 -0.35 . . . . 0.0 110.749 -179.937 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 377' ' ' ARG . . . . . 0.502 ' HG2' ' H ' ' B' ' 382' ' ' ASP . 94.1 mtt180 53.49 -168.24 0.06 Allowed 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.275 179.709 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 378' ' ' ARG . . . . . 0.509 ' HA ' ' HE ' ' A' ' 378' ' ' ARG . 2.9 mmp_? -119.47 6.36 11.1 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.739 179.87 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 379' ' ' ALA . . . . . . . . . . . . . . . -123.35 109.69 14.22 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.088 -0.506 . . . . 0.0 111.108 179.926 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 380' ' ' SER . . . . . . . . . . . . . 71.6 p . . . . . 0 C--O 1.248 1.015 0 CA-C-O 118.334 -0.841 . . . . 0.0 110.881 -179.993 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' B' B ' 295' ' ' SER . . . . . . . . . . . . . 80.6 p . . . . . 0 N--CA 1.486 1.339 0 CA-C-O 120.76 0.314 . . . . 0.0 110.824 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' B' B ' 296' ' ' LEU . . . . . 0.469 HD22 ' N ' ' B' ' 296' ' ' LEU . 3.2 mm? -62.27 145.3 54.07 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.772 -179.946 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 297' ' ' GLN . . . . . . . . . . . . . 57.3 tp60 -138.12 124.07 20.12 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.965 -179.842 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 298' ' ' ASN . . . . . . . . . . . . . 3.0 m-20 -101.5 129.37 47.56 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.823 179.945 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 299' ' ' ASN . . . . . . . . . . . . . 7.1 t30 -137.76 -71.68 0.43 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.74 179.901 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 300' ' ' GLN . . . . . 0.604 ' HB3' ' HD3' ' B' ' 301' ' ' PRO . 29.9 tt0 -105.44 -50.2 0.11 Allowed Pre-proline 0 CA--C 1.535 0.37 0 CA-C-N 116.119 -0.492 . . . . 0.0 111.489 179.752 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 301' ' ' PRO . . . . . 0.604 ' HD3' ' HB3' ' B' ' 300' ' ' GLN . 7.1 Cg_exo -73.97 78.46 2.52 Favored 'Trans proline' 0 C--N 1.353 0.81 0 C-N-CA 122.41 2.074 . . . . 0.0 112.381 -179.969 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 302' ' ' VAL . . . . . 0.554 ' HA ' HD21 ' B' ' 305' ' ' ASN . 7.7 p -92.41 -44.75 14.16 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.03 179.815 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 303' ' ' GLU . . . . . 0.447 ' N ' HG13 ' B' ' 302' ' ' VAL . 29.1 mt-10 -58.15 -33.83 69.63 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.888 -179.958 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 304' ' ' PHE . . . . . . . . . . . . . 76.5 t80 -58.05 -76.94 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.895 -0.593 . . . . 0.0 111.225 -179.612 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 305' ' ' ASN . . . . . 0.554 HD21 ' HA ' ' B' ' 302' ' ' VAL . 9.5 p30 -49.36 -38.8 29.55 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.757 -179.507 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 306' ' ' HIS . . . . . . . . . . . . . 2.0 m-70 -59.24 -74.63 0.07 Allowed 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 112.301 0.482 . . . . 0.0 112.301 -179.391 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 307' ' ' ALA . . . . . 0.583 ' HA ' HD23 ' A' ' 370' ' ' LEU . . . -56.48 -44.75 80.93 Favored 'General case' 0 C--N 1.33 -0.26 0 N-CA-C 112.455 0.539 . . . . 0.0 112.455 -178.542 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 308' ' ' ILE . . . . . . . . . . . . . 46.4 mm -58.11 -64.24 0.57 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 N-CA-C 111.737 0.273 . . . . 0.0 111.737 -179.51 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 309' ' ' ASN . . . . . . . . . . . . . 49.9 t30 -50.77 -37.29 41.32 Favored 'General case' 0 N--CA 1.463 0.196 0 CA-C-O 120.735 0.303 . . . . 0.0 110.972 -179.692 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 310' ' ' TYR . . . . . 0.532 ' O ' HG12 ' B' ' 314' ' ' ILE . 90.9 t80 -58.32 -65.92 0.57 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.731 179.705 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 311' ' ' VAL . . . . . . . . . . . . . 59.6 t -51.23 -29.39 8.57 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.378 -0.374 . . . . 0.0 111.163 -179.759 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 312' ' ' ASN . . . . . . . . . . . . . 27.0 t-20 -65.04 -57.09 9.56 Favored 'General case' 0 C--O 1.234 0.262 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.596 -179.832 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 313' ' ' LYS . . . . . 0.434 ' HG3' ' O ' ' B' ' 310' ' ' TYR . 0.1 OUTLIER -65.62 -28.95 69.49 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 120.587 0.232 . . . . 0.0 111.623 -179.371 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 314' ' ' ILE . . . . . 0.532 HG12 ' O ' ' B' ' 310' ' ' TYR . 20.3 mm -67.7 -44.98 85.57 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-O 120.879 0.371 . . . . 0.0 110.841 179.791 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 315' ' ' LYS . . . . . 0.434 ' HE3' ' HB3' ' B' ' 315' ' ' LYS . 1.2 tmmt? -67.34 -42.37 83.66 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.897 -179.988 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 316' ' ' ASN . . . . . . . . . . . . . 6.0 t30 -61.14 -54.39 45.1 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.398 -0.364 . . . . 0.0 111.326 -179.73 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 317' ' ' ARG . . . . . . . . . . . . . 27.9 mmm180 -59.68 -24.33 63.84 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.831 0.348 . . . . 0.0 111.123 -179.875 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 318' ' ' PHE . . . . . . . . . . . . . 34.9 m-85 -114.46 36.76 3.63 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.809 179.837 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 319' ' ' GLN . . . . . . . . . . . . . 32.1 tt0 -64.84 -18.15 64.89 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.903 -0.589 . . . . 0.0 110.893 -179.996 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 320' ' ' GLY . . . . . . . . . . . . . . . -115.64 27.03 8.6 Favored Glycine 0 N--CA 1.452 -0.269 0 C-N-CA 120.851 -0.69 . . . . 0.0 112.591 -179.956 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 321' ' ' GLN . . . . . 0.571 ' HA ' HE21 ' B' ' 321' ' ' GLN . 0.1 OUTLIER -148.74 89.32 5.03 Favored Pre-proline 0 C--N 1.329 -0.302 0 CA-C-O 120.517 0.199 . . . . 0.0 110.717 179.946 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 322' ' ' PRO . . . . . . . . . . . . . 87.8 Cg_endo -81.27 -22.04 6.09 Favored 'Trans proline' 0 C--N 1.347 0.459 0 C-N-CA 122.608 2.205 . . . . 0.0 112.827 -179.764 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 323' ' ' ASP . . . . . 0.4 ' OD2' HG13 ' B' ' 324' ' ' ILE . 6.4 p-10 -68.37 -53.92 20.75 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.495 -0.321 . . . . 0.0 111.219 -179.667 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 324' ' ' ILE . . . . . 0.419 HD12 ' HG2' ' B' ' 321' ' ' GLN . 56.1 mt -64.89 -44.41 96.22 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-O 120.786 0.326 . . . . 0.0 111.007 179.958 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 325' ' ' TYR . . . . . . . . . . . . . 37.3 t80 -58.72 -43.39 90.14 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.599 179.89 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 326' ' ' LYS . . . . . . . . . . . . . 63.3 tttm -62.85 -43.82 97.76 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.449 179.54 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 327' ' ' ALA . . . . . . . . . . . . . . . -55.9 -44.27 78.05 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.78 179.547 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 328' ' ' PHE . . . . . . . . . . . . . 71.5 t80 -60.67 -50.63 72.72 Favored 'General case' 0 C--O 1.233 0.223 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.484 179.732 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 329' ' ' LEU . . . . . 0.401 ' HB3' ' SD ' ' A' ' 362' ' ' MET . 95.6 mt -58.3 -28.85 65.38 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 115.816 -0.629 . . . . 0.0 110.863 179.662 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 330' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 -73.07 -41.23 64.33 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.894 179.845 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 331' ' ' ILE . . . . . 0.427 HG22 HG22 ' B' ' 358' ' ' VAL . 78.8 mt -62.01 -44.51 99.05 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.199 0 CA-C-O 120.852 0.358 . . . . 0.0 110.357 179.227 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 332' ' ' LEU . . . . . . . . . . . . . 9.6 mp -69.37 -34.98 75.36 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.619 179.603 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 333' ' ' HIS . . . . . . . . . . . . . 49.4 t-80 -62.59 -53.87 48.12 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.297 179.428 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 334' ' ' THR . . . . . . . . . . . . . 86.0 m -59.87 -38.94 83.59 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.306 179.303 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 335' ' ' TYR . . . . . . . . . . . . . 55.6 t80 -62.04 -37.83 86.42 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.211 179.396 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 336' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -64.85 -47.98 75.95 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 115.76 -0.654 . . . . 0.0 110.372 179.806 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 337' ' ' LYS . . . . . . . . . . . . . 39.5 ttpt -55.17 -48.11 74.22 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.66 179.575 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 338' ' ' GLU . . . . . 0.42 ' HB3' ' HB3' ' B' ' 351' ' ' PRO . 13.6 mm-40 -60.37 -40.36 90.55 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.71 179.685 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 339' ' ' GLN . . . . . . . . . . . . . 8.6 tp-100 -58.27 -44.9 88.63 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.741 179.883 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 340' ' ' ARG . . . . . . . . . . . . . 59.1 mtp180 -62.02 -53.28 57.77 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.433 179.755 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 341' ' ' ASN . . . . . . . . . . . . . 86.6 m-20 -53.37 -31.87 46.67 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.846 -0.616 . . . . 0.0 110.577 179.341 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 342' ' ' ALA . . . . . . . . . . . . . . . -74.28 -43.15 58.06 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.97 -0.559 . . . . 0.0 111.13 179.932 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 343' ' ' LYS . . . . . . . . . . . . . 64.0 tttm -75.6 -11.8 60.09 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.709 -179.966 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 344' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -92.41 -40.48 10.85 Favored 'General case' 0 N--CA 1.453 -0.298 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.478 179.786 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 345' ' ' ALA . . . . . . . . . . . . . . . -61.41 -26.2 67.7 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.985 179.926 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 346' ' ' GLY . . . . . . . . . . . . . . . 76.76 33.46 46.67 Favored Glycine 0 N--CA 1.451 -0.326 0 C-N-CA 120.784 -0.722 . . . . 0.0 112.692 179.85 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 347' ' ' GLY . . . . . . . . . . . . . . . 99.75 176.7 30.96 Favored Glycine 0 N--CA 1.452 -0.262 0 C-N-CA 120.742 -0.742 . . . . 0.0 112.569 179.938 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 348' ' ' ASN . . . . . . . . . . . . . 66.1 t30 60.27 14.96 4.97 Favored 'General case' 0 C--N 1.333 -0.122 0 CA-C-O 120.979 0.419 . . . . 0.0 110.795 -179.979 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 349' ' ' TYR . . . . . . . . . . . . . 59.8 t80 -117.73 124.95 49.74 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.817 179.994 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 350' ' ' THR . . . . . . . . . . . . . 61.4 m -105.81 103.52 44.43 Favored Pre-proline 0 C--N 1.33 -0.264 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.009 179.95 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 351' ' ' PRO . . . . . 0.42 ' HB3' ' HB3' ' B' ' 338' ' ' GLU . 47.0 Cg_exo -56.61 166.79 3.32 Favored 'Trans proline' 0 C--N 1.349 0.562 0 C-N-CA 122.5 2.133 . . . . 0.0 112.43 179.902 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 352' ' ' ALA . . . . . . . . . . . . . . . -83.08 -63.15 1.42 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.041 179.868 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 353' ' ' LEU . . . . . 0.416 ' HG ' ' HG2' ' B' ' 357' ' ' GLU . 6.3 mp -88.12 116.51 26.36 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.137 -179.99 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 354' ' ' THR . . . . . . . . . . . . . 61.3 p -111.25 -166.06 1.04 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.269 179.397 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 355' ' ' GLU . . . . . . . . . . . . . 8.1 pt-20 -56.8 -42.29 79.27 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.912 0.387 . . . . 0.0 110.638 179.616 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 356' ' ' GLN . . . . . . . . . . . . . 15.0 mm100 -68.07 -42.6 80.2 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.875 -0.602 . . . . 0.0 111.42 -179.888 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 357' ' ' GLU . . . . . 0.416 ' HG2' ' HG ' ' B' ' 353' ' ' LEU . 5.0 tp10 -60.31 -51.45 69.49 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.515 -0.311 . . . . 0.0 111.082 -179.584 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 358' ' ' VAL . . . . . 0.433 ' O ' HG23 ' B' ' 362' ' ' VAL . 4.4 t -60.41 -59.84 3.5 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.352 -0.386 . . . . 0.0 111.24 179.941 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 359' ' ' TYR . . . . . . . . . . . . . 4.4 t80 -51.97 -31.65 30.09 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.616 -0.266 . . . . 0.0 111.05 -179.285 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 360' ' ' ALA . . . . . . . . . . . . . . . -67.99 -59.71 3.06 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.527 -0.306 . . . . 0.0 110.954 179.659 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 361' ' ' GLN . . . . . . . . . . . . . 14.7 mm100 -53.43 -40.49 65.2 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.264 -0.426 . . . . 0.0 110.722 179.7 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 362' ' ' VAL . . . . . 0.433 HG23 ' O ' ' B' ' 358' ' ' VAL . 60.2 t -68.81 -37.03 76.88 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.366 179.502 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 363' ' ' ALA . . . . . 0.55 ' HA ' HD11 ' B' ' 373' ' ' LEU . . . -60.54 -35.72 76.69 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 121.042 0.449 . . . . 0.0 110.003 179.136 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 364' ' ' ARG . . . . . . . . . . . . . 77.3 ttt180 -86.16 -20.02 29.24 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.673 -0.694 . . . . 0.0 109.799 179.048 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 365' ' ' LEU . . . . . . . . . . . . . 24.8 tp -65.6 -42.33 91.75 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 115.594 -0.73 . . . . 0.0 110.393 179.497 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 366' ' ' PHE . . . . . . . . . . . . . 25.4 m-85 -112.83 144.5 42.27 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.289 179.358 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 367' ' ' LYS . . . . . . . . . . . . . 37.4 mtmm -120.76 -79.73 0.61 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.691 0.281 . . . . 0.0 111.358 -179.754 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 368' ' ' ASN . . . . . . . . . . . . . 33.6 m-80 -70.99 -14.83 62.49 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.341 -0.39 . . . . 0.0 110.938 -179.842 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 369' ' ' GLN . . . . . 0.401 HE21 ' HB2' ' B' ' 369' ' ' GLN . 17.4 mt-30 -107.7 94.03 4.86 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.0 179.932 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 370' ' ' GLU . . . . . . . . . . . . . 45.1 mt-10 -93.56 -5.06 49.79 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.996 -179.982 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 371' ' ' ASP . . . . . . . . . . . . . 8.9 m-20 -47.29 -63.78 0.95 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.322 -179.856 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 372' ' ' LEU . . . . . 0.734 HD22 ' H ' ' B' ' 372' ' ' LEU . 0.0 OUTLIER -58.6 -33.34 69.88 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.37 -0.377 . . . . 0.0 111.172 -179.906 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 373' ' ' LEU . . . . . 0.55 HD11 ' HA ' ' B' ' 363' ' ' ALA . 5.4 tp -58.54 -52.93 63.59 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.112 -0.494 . . . . 0.0 111.236 -179.399 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 374' ' ' SER . . . . . . . . . . . . . 46.7 t -64.95 -46.21 82.54 Favored 'General case' 0 C--O 1.233 0.23 0 CA-C-O 120.942 0.401 . . . . 0.0 110.536 179.788 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 375' ' ' GLU . . . . . . . . . . . . . 10.5 tp10 -54.36 -35.11 62.43 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.792 -0.64 . . . . 0.0 110.441 179.647 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 376' ' ' PHE . . . . . . . . . . . . . 85.9 t80 -78.31 -32.77 49.46 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.089 179.49 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 377' ' ' GLY . . . . . . . . . . . . . . . -60.99 -36.0 91.57 Favored Glycine 0 N--CA 1.449 -0.481 0 C-N-CA 120.805 -0.712 . . . . 0.0 111.977 179.581 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 378' ' ' GLN . . . . . . . . . . . . . 88.5 mt-30 -55.49 -28.33 53.96 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-O 120.826 0.346 . . . . 0.0 110.67 179.497 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 379' ' ' PHE . . . . . 0.405 ' HB3' ' H ' ' B' ' 380' ' ' LEU . 67.0 m-85 -72.69 -146.2 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.399 179.39 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 380' ' ' LEU . . . . . 0.405 ' H ' ' HB3' ' B' ' 379' ' ' PHE . 40.4 mt 67.13 143.18 0.08 OUTLIER Pre-proline 0 N--CA 1.462 0.173 0 CA-C-N 116.492 -0.322 . . . . 0.0 110.871 -179.874 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 381' ' ' PRO . . . . . . . . . . . . . 52.2 Cg_exo -53.08 116.78 3.16 Favored 'Trans proline' 0 C--N 1.347 0.456 0 C-N-CA 122.563 2.176 . . . . 0.0 112.398 -179.988 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 382' ' ' ASP . . . . . 0.502 ' H ' ' HG2' ' A' ' 377' ' ' ARG . 15.4 t70 -64.38 138.96 58.7 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.993 -179.973 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 383' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.083 0 CA-C-O 118.352 -0.833 . . . . 0.0 111.098 179.949 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 358' ' ' ASP . . . . . . . . . . . . . 4.2 p30 . . . . . 0 N--CA 1.486 1.329 0 CA-C-O 120.795 0.331 . . . . 0.0 110.866 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 359' ' ' PHE . . . . . . . . . . . . . 43.7 p90 -141.56 139.66 33.22 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.862 179.978 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 360' ' ' THR . . . . . . . . . . . . . 28.7 m -91.54 128.97 44.49 Favored Pre-proline 0 C--N 1.328 -0.341 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.051 -179.87 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 361' ' ' PRO . . . . . . . . . . . . . 43.4 Cg_exo -57.36 -58.86 0.72 Allowed 'Trans proline' 0 C--N 1.349 0.588 0 C-N-CA 122.494 2.13 . . . . 0.0 112.59 -179.978 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 362' ' ' MET . . . . . 0.57 ' HB2' HD12 ' B' ' 329' ' ' LEU . 27.0 ttt -117.76 -71.38 0.74 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.009 -179.771 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 363' ' ' ASP . . . . . . . . . . . . . 24.9 t70 -168.83 -35.85 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.886 -0.597 . . . . 0.0 110.544 -179.936 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 364' ' ' SER . . . . . . . . . . . . . 44.3 t -115.76 -71.26 0.75 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.934 -0.575 . . . . 0.0 110.675 179.704 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 365' ' ' SER . . . . . . . . . . . . . 47.7 t -169.57 82.69 0.12 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.048 -0.524 . . . . 0.0 111.128 179.925 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 366' ' ' ALA . . . . . . . . . . . . . . . -78.33 -22.48 48.0 Favored 'General case' 0 C--O 1.237 0.418 0 CA-C-O 121.229 0.538 . . . . 0.0 110.333 179.429 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 367' ' ' VAL . . . . . . . . . . . . . 32.7 m -59.66 -29.05 41.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 115.441 -0.799 . . . . 0.0 110.52 179.533 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 368' ' ' TYR . . . . . . . . . . . . . 91.6 t80 -62.43 -42.27 99.33 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.35 179.452 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 369' ' ' VAL . . . . . . . . . . . . . 18.6 t -68.29 -52.76 34.25 Favored 'Isoleucine or valine' 0 C--O 1.234 0.285 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.635 179.641 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 370' ' ' LEU . . . . . . . . . . . . . 97.0 mt -57.16 -36.07 70.31 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.995 179.923 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 371' ' ' SER . . . . . . . . . . . . . 67.7 m -69.49 -41.69 75.8 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.587 179.773 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 372' ' ' SER . . . . . . . . . . . . . 64.4 m -61.31 -35.14 76.54 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.642 179.746 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 373' ' ' MET . . . . . . . . . . . . . 65.4 mtt -70.44 -48.54 55.5 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.313 179.728 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 374' ' ' ALA . . . . . . . . . . . . . . . -72.92 -19.2 61.31 Favored 'General case' 0 C--N 1.331 -0.239 0 N-CA-C 112.054 0.39 . . . . 0.0 112.054 -179.283 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 375' ' ' ARG . . . . . . . . . . . . . 28.9 mmt180 -90.84 -32.67 15.97 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 111.582 0.216 . . . . 0.0 111.582 -179.584 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 376' ' ' GLN . . . . . 0.534 ' HG3' ' H ' ' A' ' 378' ' ' ARG . 6.3 tp-100 -61.04 -87.32 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.677 0.275 . . . . 0.0 110.814 -179.996 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 377' ' ' ARG . . . . . . . . . . . . . 75.5 mtp180 57.46 13.28 1.76 Allowed 'General case' 0 N--CA 1.462 0.131 0 CA-C-N 116.4 -0.364 . . . . 0.0 111.48 179.682 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 378' ' ' ARG . . . . . 0.534 ' H ' ' HG3' ' A' ' 376' ' ' GLN . 37.2 mmt180 -103.12 141.84 35.15 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.422 -0.354 . . . . 0.0 110.927 179.985 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 379' ' ' ALA . . . . . . . . . . . . . . . -96.94 -66.69 0.89 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.078 179.944 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 380' ' ' SER . . . . . . . . . . . . . 49.3 m . . . . . 0 C--O 1.249 1.068 0 CA-C-O 118.286 -0.864 . . . . 0.0 110.898 179.97 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' B' B ' 295' ' ' SER . . . . . . . . . . . . . 52.8 m . . . . . 0 N--CA 1.485 1.324 0 CA-C-O 120.753 0.311 . . . . 0.0 110.888 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' B' B ' 296' ' ' LEU . . . . . 0.494 HD22 ' N ' ' B' ' 296' ' ' LEU . 2.9 mm? -77.36 -23.59 50.8 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.662 179.717 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 297' ' ' GLN . . . . . . . . . . . . . 25.8 mt-30 -87.37 161.67 17.77 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.751 179.86 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 298' ' ' ASN . . . . . . . . . . . . . 24.4 p-10 -127.89 164.29 22.58 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.244 -0.434 . . . . 0.0 111.035 -179.949 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 299' ' ' ASN . . . . . . . . . . . . . 19.0 m120 -147.08 154.14 40.81 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.72 179.838 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 300' ' ' GLN . . . . . . . . . . . . . 77.3 mt-30 -113.81 151.48 44.74 Favored Pre-proline 0 C--N 1.331 -0.228 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.853 179.978 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 301' ' ' PRO . . . . . . . . . . . . . 57.9 Cg_endo -71.26 135.18 26.37 Favored 'Trans proline' 0 C--N 1.347 0.477 0 C-N-CA 122.44 2.093 . . . . 0.0 112.277 179.933 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 302' ' ' VAL . . . . . . . . . . . . . 35.9 m -72.44 -12.47 15.79 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.093 -179.942 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 303' ' ' GLU . . . . . . . . . . . . . 46.5 mt-10 -58.04 -83.25 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.0 -0.545 . . . . 0.0 111.422 -179.724 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 304' ' ' PHE . . . . . . . . . . . . . 99.6 m-85 -59.97 -30.46 69.13 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.339 -179.583 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 305' ' ' ASN . . . . . . . . . . . . . 27.3 t-20 -58.21 -69.69 0.17 Allowed 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.402 -0.363 . . . . 0.0 111.45 -179.599 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 306' ' ' HIS . . . . . . . . . . . . . 20.5 m-70 -62.57 -47.16 85.04 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.123 -0.489 . . . . 0.0 112.147 -179.152 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 307' ' ' ALA . . . . . . . . . . . . . . . -56.61 -62.45 1.72 Allowed 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 112.361 0.504 . . . . 0.0 112.361 -178.921 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 308' ' ' ILE . . . . . . . . . . . . . 85.1 mt -56.56 -49.41 77.75 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.247 0 N-CA-C 111.644 0.239 . . . . 0.0 111.644 -179.335 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 309' ' ' ASN . . . . . . . . . . . . . 36.7 t30 -54.21 -42.73 70.12 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.885 0.374 . . . . 0.0 111.011 -179.82 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 310' ' ' TYR . . . . . 0.483 ' O ' HG12 ' B' ' 314' ' ' ILE . 84.5 t80 -61.94 -62.78 1.54 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.949 -179.808 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 311' ' ' VAL . . . . . . . . . . . . . 43.6 t -54.24 -25.61 13.81 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-O 120.859 0.361 . . . . 0.0 110.978 -179.833 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 312' ' ' ASN . . . . . . . . . . . . . 2.8 t-20 -67.9 -56.71 8.03 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.026 -179.924 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 313' ' ' LYS . . . . . 0.449 ' HD3' ' N ' ' B' ' 314' ' ' ILE . 0.1 OUTLIER -65.32 -30.53 71.38 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.519 -0.309 . . . . 0.0 111.514 -179.592 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 314' ' ' ILE . . . . . 0.483 HG12 ' O ' ' B' ' 310' ' ' TYR . 25.9 mm -70.06 -40.55 78.55 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.197 0 CA-C-O 120.945 0.402 . . . . 0.0 110.744 179.578 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 315' ' ' LYS . . . . . . . . . . . . . 4.3 ttmp? -66.92 -42.42 85.4 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.936 -0.574 . . . . 0.0 110.911 -179.899 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 316' ' ' ASN . . . . . . . . . . . . . 27.6 t-20 -64.19 -52.61 58.05 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.333 -179.713 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 317' ' ' ARG . . . . . 0.441 ' HA ' ' NE ' ' B' ' 317' ' ' ARG . 4.7 mmp_? -59.38 -60.75 3.36 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.904 0.383 . . . . 0.0 111.197 -179.873 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 318' ' ' PHE . . . . . . . . . . . . . 65.4 m-85 -85.23 38.14 0.71 Allowed 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.093 -0.503 . . . . 0.0 111.379 -179.559 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 319' ' ' GLN . . . . . . . . . . . . . 22.6 tt0 -65.28 -26.17 67.96 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.706 179.863 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 320' ' ' GLY . . . . . . . . . . . . . . . -96.9 -5.43 58.49 Favored Glycine 0 N--CA 1.451 -0.301 0 C-N-CA 120.804 -0.712 . . . . 0.0 112.624 -179.845 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 321' ' ' GLN . . . . . . . . . . . . . 27.8 mm-40 -108.33 94.04 12.65 Favored Pre-proline 0 C--N 1.329 -0.298 0 CA-C-O 120.45 0.167 . . . . 0.0 110.945 -179.962 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 322' ' ' PRO . . . . . . . . . . . . . 97.1 Cg_endo -79.69 -33.78 1.16 Allowed 'Trans proline' 0 C--N 1.348 0.531 0 C-N-CA 122.459 2.106 . . . . 0.0 112.458 -179.911 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 323' ' ' ASP . . . . . . . . . . . . . 20.8 m-20 -63.86 -51.7 63.44 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.146 -179.682 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 324' ' ' ILE . . . . . . . . . . . . . 57.1 mt -65.12 -46.24 91.73 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.424 -179.696 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 325' ' ' TYR . . . . . 0.422 ' O ' HD23 ' B' ' 329' ' ' LEU . 35.0 t80 -57.57 -58.43 8.34 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.996 -179.624 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 326' ' ' LYS . . . . . . . . . . . . . 14.2 mptt -54.03 -44.73 71.23 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.017 179.916 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 327' ' ' ALA . . . . . . . . . . . . . . . -53.59 -45.64 70.09 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 121.055 0.455 . . . . 0.0 110.916 179.802 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 328' ' ' PHE . . . . . . . . . . . . . 54.9 t80 -60.54 -54.92 39.7 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.857 -0.611 . . . . 0.0 110.822 179.961 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 329' ' ' LEU . . . . . 0.57 HD12 ' HB2' ' A' ' 362' ' ' MET . 4.0 mm? -59.76 -25.63 65.03 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.652 179.815 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 330' ' ' GLU . . . . . . . . . . . . . 10.2 mm-40 -69.76 -41.97 74.48 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.39 -0.368 . . . . 0.0 110.037 179.107 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 331' ' ' ILE . . . . . . . . . . . . . 84.8 mt -63.88 -42.41 95.71 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.038 178.814 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 332' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -64.48 -44.42 91.09 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.655 -0.702 . . . . 0.0 110.671 179.532 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 333' ' ' HIS . . . . . . . . . . . . . 54.1 t-80 -61.95 -56.27 20.9 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.777 -179.99 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 334' ' ' THR . . . . . 0.415 HG22 HD13 ' B' ' 353' ' ' LEU . 70.9 m -54.16 -37.51 64.52 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.338 179.486 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 335' ' ' TYR . . . . . . . . . . . . . 60.7 t80 -63.27 -38.56 91.66 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.069 179.299 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 336' ' ' GLN . . . . . . . . . . . . . 23.8 tt0 -64.68 -43.83 92.27 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.729 179.454 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 337' ' ' LYS . . . . . . . . . . . . . 26.9 ttpp -59.16 -52.24 66.57 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.821 -179.849 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 338' ' ' GLU . . . . . . . . . . . . . 35.5 mm-40 -58.29 -42.84 87.48 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.797 179.706 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 339' ' ' GLN . . . . . . . . . . . . . 8.7 tt0 -59.36 -41.1 88.46 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.755 -179.963 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 340' ' ' ARG . . . . . . . . . . . . . 99.1 mtt180 -62.41 -52.03 65.2 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.753 179.772 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 341' ' ' ASN . . . . . . . . . . . . . 18.9 m120 -60.96 -27.2 68.09 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.872 179.881 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 342' ' ' ALA . . . . . . . . . . . . . . . -73.8 -42.22 61.26 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.21 179.973 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 343' ' ' LYS . . . . . . . . . . . . . 98.6 mttt -76.61 -24.66 53.41 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.99 -179.95 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 344' ' ' GLU . . . . . . . . . . . . . 15.6 mm-40 -82.43 -34.01 28.35 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.264 -0.426 . . . . 0.0 110.861 179.814 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 345' ' ' ALA . . . . . . . . . . . . . . . -64.56 -30.37 71.4 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.066 179.911 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 346' ' ' GLY . . . . . . . . . . . . . . . 85.88 -40.48 3.04 Favored Glycine 0 N--CA 1.452 -0.249 0 C-N-CA 120.743 -0.741 . . . . 0.0 112.576 -179.977 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 347' ' ' GLY . . . . . . . . . . . . . . . -178.53 178.12 48.59 Favored Glycine 0 N--CA 1.452 -0.276 0 C-N-CA 120.804 -0.712 . . . . 0.0 112.514 -179.987 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 348' ' ' ASN . . . . . . . . . . . . . 2.9 t-20 59.31 17.61 5.97 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.909 0.385 . . . . 0.0 111.008 179.93 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 349' ' ' TYR . . . . . . . . . . . . . 56.0 t80 -107.86 141.59 39.21 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.768 179.984 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 350' ' ' THR . . . . . . . . . . . . . 39.1 m -119.73 96.8 49.74 Favored Pre-proline 0 C--N 1.329 -0.306 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.981 179.891 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 351' ' ' PRO . . . . . . . . . . . . . 51.8 Cg_exo -52.56 131.33 40.56 Favored 'Trans proline' 0 C--N 1.348 0.543 0 C-N-CA 122.451 2.101 . . . . 0.0 112.288 179.97 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 352' ' ' ALA . . . . . . . . . . . . . . . -62.75 -57.27 11.52 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.066 -0.516 . . . . 0.0 111.401 -179.739 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 353' ' ' LEU . . . . . 0.46 ' HG ' ' HG2' ' B' ' 357' ' ' GLU . 5.9 mp -101.33 121.97 42.86 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 120.924 0.392 . . . . 0.0 111.375 -179.846 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 354' ' ' THR . . . . . . . . . . . . . 79.9 p -112.35 -170.76 1.72 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.389 179.158 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 355' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -57.57 -37.45 73.17 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.997 0.427 . . . . 0.0 110.28 179.654 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 356' ' ' GLN . . . . . . . . . . . . . 93.5 mt-30 -71.21 -40.71 70.96 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.807 -0.633 . . . . 0.0 111.029 -179.857 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 357' ' ' GLU . . . . . 0.46 ' HG2' ' HG ' ' B' ' 353' ' ' LEU . 6.6 tp10 -59.34 -52.74 64.32 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 116.345 -0.389 . . . . 0.0 110.908 -179.62 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 358' ' ' VAL . . . . . 0.51 ' O ' HG23 ' B' ' 362' ' ' VAL . 76.3 t -61.51 -54.66 31.87 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.942 179.842 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 359' ' ' TYR . . . . . . . . . . . . . 38.4 t80 -54.57 -28.66 47.59 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.689 0.281 . . . . 0.0 111.196 -179.444 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 360' ' ' ALA . . . . . . . . . . . . . . . -72.09 -60.66 2.12 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.867 0.365 . . . . 0.0 110.981 179.768 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 361' ' ' GLN . . . . . . . . . . . . . 24.2 mm-40 -55.0 -40.33 69.99 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.593 179.788 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 362' ' ' VAL . . . . . 0.51 HG23 ' O ' ' B' ' 358' ' ' VAL . 90.5 t -66.25 -39.87 85.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.304 179.338 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 363' ' ' ALA . . . . . 0.561 ' HA ' HD21 ' B' ' 373' ' ' LEU . . . -58.98 -36.93 75.7 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.139 179.227 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 364' ' ' ARG . . . . . . . . . . . . . 98.2 mtt180 -80.74 -25.29 38.13 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.729 -0.669 . . . . 0.0 110.41 179.387 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 365' ' ' LEU . . . . . . . . . . . . . 14.6 tp -61.14 -29.67 69.93 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.456 179.843 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 366' ' ' PHE . . . . . . . . . . . . . 43.9 m-85 -120.09 -170.2 1.92 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.855 -0.611 . . . . 0.0 110.164 179.545 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 367' ' ' LYS . . . . . . . . . . . . . 61.0 tttp -158.32 -84.24 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.663 0.268 . . . . 0.0 111.38 179.944 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 368' ' ' ASN . . . . . . . . . . . . . 80.6 m-20 -70.0 -7.87 44.41 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.378 -0.373 . . . . 0.0 110.948 -179.83 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 369' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -110.57 86.83 2.39 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.888 179.999 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 370' ' ' GLU . . . . . . . . . . . . . 42.8 mt-10 -91.36 -12.55 34.57 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.396 -0.365 . . . . 0.0 110.553 179.837 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 371' ' ' ASP . . . . . . . . . . . . . 19.2 t70 -55.1 -34.11 63.4 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 116.158 -0.473 . . . . 0.0 110.155 179.476 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 372' ' ' LEU . . . . . 0.465 ' N ' HD12 ' B' ' 372' ' ' LEU . 6.0 mp -69.97 -38.16 76.0 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.662 -0.699 . . . . 0.0 110.211 179.15 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 373' ' ' LEU . . . . . 0.561 HD21 ' HA ' ' B' ' 363' ' ' ALA . 1.7 mp -63.26 -37.31 86.75 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.733 -0.667 . . . . 0.0 110.783 179.793 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 374' ' ' SER . . . . . . . . . . . . . 61.6 m -72.67 -57.14 4.35 Favored 'General case' 0 C--O 1.235 0.339 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.462 179.532 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 375' ' ' GLU . . . . . . . . . . . . . 17.2 mm-40 -52.56 -40.58 62.72 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.565 179.503 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 376' ' ' PHE . . . . . . . . . . . . . 81.5 t80 -72.8 -34.47 66.92 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.13 -0.487 . . . . 0.0 109.99 179.442 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 377' ' ' GLY . . . . . . . . . . . . . . . -58.97 -32.74 71.36 Favored Glycine 0 N--CA 1.449 -0.485 0 C-N-CA 120.583 -0.818 . . . . 0.0 111.373 179.091 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 378' ' ' GLN . . . . . . . . . . . . . 15.8 mm100 -56.98 -36.31 70.18 Favored 'General case' 0 C--N 1.333 -0.142 0 CA-C-O 120.929 0.395 . . . . 0.0 110.09 178.829 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 379' ' ' PHE . . . . . . . . . . . . . 70.3 m-85 -68.14 -42.06 80.68 Favored 'General case' 0 C--N 1.333 -0.144 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.243 179.339 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 380' ' ' LEU . . . . . 0.414 HD12 ' HA ' ' B' ' 380' ' ' LEU . 5.8 tp -51.38 121.27 16.62 Favored Pre-proline 0 C--N 1.329 -0.306 0 CA-C-N 115.554 -0.748 . . . . 0.0 110.667 -179.829 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 381' ' ' PRO . . . . . . . . . . . . . 84.9 Cg_exo -46.4 122.14 5.35 Favored 'Trans proline' 0 C--N 1.351 0.677 0 C-N-CA 122.413 2.075 . . . . 0.0 112.462 -179.984 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 382' ' ' ASP . . . . . . . . . . . . . 28.9 t70 -61.26 132.28 53.11 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.92 -179.872 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 383' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.045 0 CA-C-O 118.203 -0.904 . . . . 0.0 111.079 -179.972 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 358' ' ' ASP . . . . . . . . . . . . . 17.3 m-20 . . . . . 0 N--CA 1.485 1.318 0 CA-C-O 120.815 0.34 . . . . 0.0 110.845 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 359' ' ' PHE . . . . . . . . . . . . . 77.7 t80 -142.13 141.93 32.71 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.189 -0.46 . . . . 0.0 111.055 -179.98 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 360' ' ' THR . . . . . 0.679 HG22 ' HB ' ' B' ' 308' ' ' ILE . 0.1 OUTLIER -159.57 -51.82 0.01 OUTLIER Pre-proline 0 CA--C 1.534 0.351 0 CA-C-N 115.999 -0.546 . . . . 0.0 111.559 179.643 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 361' ' ' PRO . . . . . 0.567 ' HD2' ' H ' ' A' ' 360' ' ' THR . 53.7 Cg_endo -88.55 176.48 3.49 Favored 'Trans proline' 0 C--N 1.354 0.844 0 C-N-CA 122.411 2.074 . . . . 0.0 112.087 179.431 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 362' ' ' MET . . . . . 0.439 ' SD ' ' HB3' ' B' ' 329' ' ' LEU . 5.7 ttt -101.26 -71.36 0.71 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.086 0.47 . . . . 0.0 110.655 179.361 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 363' ' ' ASP . . . . . . . . . . . . . 14.5 t70 -170.92 -32.28 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.621 -0.718 . . . . 0.0 110.122 -179.719 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 364' ' ' SER . . . . . . . . . . . . . 78.7 p -115.62 19.19 15.48 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.703 -0.681 . . . . 0.0 110.171 179.434 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 365' ' ' SER . . . . . . . . . . . . . 46.3 t 65.36 80.0 0.24 Allowed 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.632 -0.713 . . . . 0.0 111.283 -179.883 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 366' ' ' ALA . . . . . . . . . . . . . . . -77.99 -20.74 52.02 Favored 'General case' 0 C--O 1.234 0.253 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.643 179.67 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 367' ' ' VAL . . . . . . . . . . . . . 21.4 t -53.28 -32.65 19.74 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 115.892 -0.595 . . . . 0.0 110.986 179.969 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 368' ' ' TYR . . . . . . . . . . . . . 66.3 t80 -68.02 -36.78 80.52 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.675 179.785 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 369' ' ' VAL . . . . . 0.406 HG22 ' HB2' ' B' ' 336' ' ' GLN . 6.0 t -67.26 -52.97 36.99 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.238 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.728 179.85 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 370' ' ' LEU . . . . . 0.412 HD22 ' N ' ' A' ' 370' ' ' LEU . 3.4 mm? -62.32 -32.36 73.1 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.766 179.801 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 371' ' ' SER . . . . . . . . . . . . . 27.2 t -64.12 -58.34 6.94 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.045 179.878 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 372' ' ' SER . . . . . . . . . . . . . 41.7 t -59.68 -32.5 70.54 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.09 -179.86 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 373' ' ' MET . . . . . . . . . . . . . 55.6 ttm -63.99 -47.24 81.09 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.402 -0.363 . . . . 0.0 111.174 179.935 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 374' ' ' ALA . . . . . . . . . . . . . . . -83.17 -13.79 54.77 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.363 -0.38 . . . . 0.0 111.686 -179.715 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 375' ' ' ARG . . . . . 0.533 ' HG2' ' HG2' ' B' ' 303' ' ' GLU . 7.0 mmt180 -86.07 -30.73 22.38 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.487 -0.324 . . . . 0.0 111.25 -179.844 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 376' ' ' GLN . . . . . 0.47 ' HB3' ' HG3' ' B' ' 381' ' ' PRO . 52.6 tt0 -54.16 -82.33 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.255 -0.429 . . . . 0.0 111.179 -179.617 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 377' ' ' ARG . . . . . . . . . . . . . 67.0 mtm180 55.47 -167.28 0.1 Allowed 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.803 0.335 . . . . 0.0 110.985 -179.965 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 378' ' ' ARG . . . . . . . . . . . . . 35.5 mmt180 -115.82 9.64 15.13 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.31 -0.405 . . . . 0.0 111.016 179.82 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 379' ' ' ALA . . . . . . . . . . . . . . . -65.61 -37.06 85.53 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.955 179.845 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 380' ' ' SER . . . . . . . . . . . . . 49.3 m . . . . . 0 C--O 1.25 1.115 0 CA-C-O 118.152 -0.928 . . . . 0.0 111.046 179.811 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' B' B ' 295' ' ' SER . . . . . . . . . . . . . 76.3 p . . . . . 0 N--CA 1.485 1.313 0 CA-C-O 120.821 0.343 . . . . 0.0 111.039 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' B' B ' 296' ' ' LEU . . . . . 0.48 HD22 ' N ' ' B' ' 296' ' ' LEU . 2.8 mm? -111.41 145.99 37.96 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.733 179.864 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 297' ' ' GLN . . . . . 0.678 HE21 ' H ' ' B' ' 297' ' ' GLN . 0.0 OUTLIER -104.93 136.47 44.35 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.808 179.888 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 298' ' ' ASN . . . . . . . . . . . . . 26.8 t-20 -114.3 -50.78 2.79 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.788 179.932 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 299' ' ' ASN . . . . . . . . . . . . . 8.8 p30 -82.69 138.78 34.0 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.665 179.864 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 300' ' ' GLN . . . . . . . . . . . . . 3.9 pt20 -96.53 146.68 31.73 Favored Pre-proline 0 C--N 1.329 -0.285 0 CA-C-N 116.268 -0.424 . . . . 0.0 111.012 -179.875 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 301' ' ' PRO . . . . . . . . . . . . . 25.2 Cg_exo -63.01 131.3 32.12 Favored 'Trans proline' 0 C--N 1.348 0.506 0 C-N-CA 122.527 2.151 . . . . 0.0 112.298 179.807 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 302' ' ' VAL . . . . . . . . . . . . . 15.0 p -92.22 -29.58 4.59 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.23 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.805 179.766 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 303' ' ' GLU . . . . . 0.533 ' HG2' ' HG2' ' A' ' 375' ' ' ARG . 35.5 mt-10 -51.64 -80.75 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.77 -0.65 . . . . 0.0 111.879 -179.34 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 304' ' ' PHE . . . . . 0.492 ' O ' HG12 ' B' ' 308' ' ' ILE . 81.0 m-85 -54.79 -55.0 34.78 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.918 -0.583 . . . . 0.0 112.043 -179.023 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 305' ' ' ASN . . . . . . . . . . . . . 2.8 t-20 -47.58 -68.89 0.15 Allowed 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 112.87 0.693 . . . . 0.0 112.87 -178.668 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 306' ' ' HIS . . . . . . . . . . . . . 2.5 t-160 -54.98 -46.33 75.1 Favored 'General case' 0 C--N 1.33 -0.266 0 N-CA-C 112.417 0.525 . . . . 0.0 112.417 -178.244 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 307' ' ' ALA . . . . . . . . . . . . . . . -58.6 -62.19 2.04 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 112.37 0.507 . . . . 0.0 112.37 -178.89 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 308' ' ' ILE . . . . . 0.679 ' HB ' HG22 ' A' ' 360' ' ' THR . 30.9 pt -54.68 -37.74 40.72 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.208 0 N-CA-C 111.825 0.306 . . . . 0.0 111.825 -179.173 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 309' ' ' ASN . . . . . 0.433 ' N ' HG13 ' B' ' 308' ' ' ILE . 5.3 m-20 -61.58 -45.27 94.85 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.896 0.379 . . . . 0.0 110.804 179.987 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 310' ' ' TYR . . . . . 0.509 ' O ' HG12 ' B' ' 314' ' ' ILE . 81.4 t80 -61.54 -60.13 4.16 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.847 179.869 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 311' ' ' VAL . . . . . . . . . . . . . 47.5 t -54.13 -31.26 21.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-O 120.896 0.379 . . . . 0.0 111.178 -179.572 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 312' ' ' ASN . . . . . . . . . . . . . 3.2 t-20 -65.11 -56.52 12.48 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.361 -179.668 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 313' ' ' LYS . . . . . 0.516 ' NZ ' ' HB2' ' B' ' 313' ' ' LYS . 0.0 OUTLIER -65.31 -23.52 67.04 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 116.493 -0.321 . . . . 0.0 111.595 -179.555 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 314' ' ' ILE . . . . . 0.509 HG12 ' O ' ' B' ' 310' ' ' TYR . 24.6 mm -76.68 -36.61 27.45 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-O 120.814 0.34 . . . . 0.0 111.087 179.723 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 315' ' ' LYS . . . . . . . . . . . . . 1.2 tmmt? -75.84 -35.94 59.8 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.404 -0.362 . . . . 0.0 110.858 -179.982 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 316' ' ' ASN . . . . . . . . . . . . . 27.0 t-20 -74.4 -46.0 43.11 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.045 -0.525 . . . . 0.0 111.525 -179.47 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 317' ' ' ARG . . . . . . . . . . . . . 19.1 tpt180 -68.61 -25.55 64.91 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.448 -0.342 . . . . 0.0 111.177 -179.644 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 318' ' ' PHE . . . . . . . . . . . . . 95.7 m-85 -117.31 37.51 3.85 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.172 -179.837 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 319' ' ' GLN . . . . . . . . . . . . . 3.0 pt20 -63.4 -15.15 56.7 Favored 'General case' 0 N--CA 1.447 -0.586 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.925 179.591 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 320' ' ' GLY . . . . . . . . . . . . . . . -104.98 -7.22 38.79 Favored Glycine 0 C--N 1.331 0.284 0 C-N-CA 120.837 -0.697 . . . . 0.0 112.697 -179.85 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 321' ' ' GLN . . . . . . . . . . . . . 23.5 mp0 -113.05 88.32 11.92 Favored Pre-proline 0 C--N 1.33 -0.281 0 CA-C-O 120.549 0.214 . . . . 0.0 111.004 -179.991 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 322' ' ' PRO . . . . . . . . . . . . . 90.2 Cg_endo -80.87 -26.5 3.6 Favored 'Trans proline' 0 C--N 1.348 0.507 0 C-N-CA 122.474 2.116 . . . . 0.0 112.689 179.778 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 323' ' ' ASP . . . . . . . . . . . . . 12.4 m-20 -67.05 -56.82 8.41 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.383 -179.542 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 324' ' ' ILE . . . . . . . . . . . . . 57.1 mt -64.3 -43.39 97.17 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 CA-C-N 116.299 -0.41 . . . . 0.0 111.195 -179.784 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 325' ' ' TYR . . . . . 0.45 ' O ' HD23 ' B' ' 329' ' ' LEU . 55.1 t80 -57.12 -58.23 9.09 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.714 179.957 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 326' ' ' LYS . . . . . 0.438 ' O ' ' HG2' ' B' ' 330' ' ' GLU . 58.6 mtpt -52.2 -50.02 62.72 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.012 179.833 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 327' ' ' ALA . . . . . 0.439 ' O ' ' HB2' ' B' ' 330' ' ' GLU . . . -50.35 -46.46 55.76 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 116.369 -0.378 . . . . 0.0 111.207 179.997 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 328' ' ' PHE . . . . . . . . . . . . . 71.3 t80 -58.01 -53.5 57.49 Favored 'General case' 0 C--O 1.237 0.44 0 CA-C-O 121.062 0.458 . . . . 0.0 109.985 179.293 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 329' ' ' LEU . . . . . 0.45 HD23 ' O ' ' B' ' 325' ' ' TYR . 4.2 mm? -58.73 -27.73 65.19 Favored 'General case' 0 N--CA 1.452 -0.327 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.372 179.082 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 330' ' ' GLU . . . . . 0.439 ' HB2' ' O ' ' B' ' 327' ' ' ALA . 27.4 mm-40 -69.23 -39.22 78.66 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.035 179.464 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 331' ' ' ILE . . . . . 0.463 HG22 HG22 ' B' ' 358' ' ' VAL . 68.2 mt -63.8 -50.51 77.39 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.23 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.254 179.204 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 332' ' ' LEU . . . . . . . . . . . . . 11.0 mp -66.48 -28.92 68.96 Favored 'General case' 0 C--O 1.233 0.2 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.796 179.643 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 333' ' ' HIS . . . . . . . . . . . . . 34.4 t-80 -66.88 -61.05 2.14 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.401 179.348 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 334' ' ' THR . . . . . . . . . . . . . 95.3 m -56.1 -34.29 65.89 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.925 -0.579 . . . . 0.0 110.242 179.286 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 335' ' ' TYR . . . . . . . . . . . . . 52.4 t80 -63.79 -41.73 97.88 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.809 -0.632 . . . . 0.0 110.245 179.31 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 336' ' ' GLN . . . . . 0.406 ' HB2' HG22 ' A' ' 369' ' ' VAL . 44.4 tt0 -62.77 -47.07 85.08 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.773 179.665 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 337' ' ' LYS . . . . . . . . . . . . . 28.7 ttpp -56.72 -54.32 47.52 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.177 -179.914 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 338' ' ' GLU . . . . . . . . . . . . . 19.7 mm-40 -60.94 -33.34 73.03 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.272 -179.916 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 339' ' ' GLN . . . . . . . . . . . . . 60.5 tt0 -63.14 -61.22 2.52 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.854 -179.949 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 340' ' ' ARG . . . . . . . . . . . . . 95.4 mtt180 -52.54 -52.67 53.68 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.011 -0.54 . . . . 0.0 111.084 -179.99 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 341' ' ' ASN . . . . . . . . . . . . . 80.2 m-20 -54.32 -40.66 68.2 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.952 179.906 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 342' ' ' ALA . . . . . . . . . . . . . . . -66.89 -31.25 71.72 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.119 179.961 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 343' ' ' LYS . . . . . . . . . . . . . 14.0 mmmm -72.35 -46.64 54.61 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.112 -0.494 . . . . 0.0 111.195 -179.885 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 344' ' ' GLU . . . . . . . . . . . . . 14.1 mm-40 -69.7 -29.23 66.59 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.17 -179.706 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 345' ' ' ALA . . . . . . . . . . . . . . . -59.98 -28.91 68.08 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.215 -179.898 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 346' ' ' GLY . . . . . . . . . . . . . . . 135.56 -23.69 3.41 Favored Glycine 0 N--CA 1.45 -0.398 0 C-N-CA 120.786 -0.721 . . . . 0.0 112.531 -179.966 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 347' ' ' GLY . . . . . . . . . . . . . . . 113.96 -17.17 20.19 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.829 -0.701 . . . . 0.0 112.488 179.977 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 348' ' ' ASN . . . . . . . . . . . . . 13.8 m120 -85.99 -14.89 43.2 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.751 0.31 . . . . 0.0 111.035 -179.967 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 349' ' ' TYR . . . . . . . . . . . . . 80.2 t80 -70.91 130.22 41.07 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.896 179.927 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 350' ' ' THR . . . . . . . . . . . . . 33.0 m -92.9 110.93 48.91 Favored Pre-proline 0 C--N 1.33 -0.267 0 CA-C-N 116.158 -0.474 . . . . 0.0 111.022 179.984 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 351' ' ' PRO . . . . . . . . . . . . . 52.5 Cg_exo -55.65 162.44 6.53 Favored 'Trans proline' 0 C--N 1.348 0.52 0 C-N-CA 122.453 2.102 . . . . 0.0 112.459 -179.878 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 352' ' ' ALA . . . . . . . . . . . . . . . -77.26 -41.71 39.94 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.058 179.947 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 353' ' ' LEU . . . . . 0.453 ' HG ' ' HG2' ' B' ' 357' ' ' GLU . 7.1 mp -114.74 130.32 56.82 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.01 179.969 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 354' ' ' THR . . . . . . . . . . . . . 81.0 p -112.36 -174.86 2.55 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.055 -0.521 . . . . 0.0 110.805 179.769 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 355' ' ' GLU . . . . . . . . . . . . . 8.5 pt-20 -56.54 -42.14 77.97 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 121.209 0.528 . . . . 0.0 110.573 179.985 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 356' ' ' GLN . . . . . . . . . . . . . 15.8 mm100 -65.95 -38.92 89.85 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.5 -0.773 . . . . 0.0 111.055 179.789 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 357' ' ' GLU . . . . . 0.453 ' HG2' ' HG ' ' B' ' 353' ' ' LEU . 5.5 tp10 -61.33 -46.48 90.09 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 120.856 0.36 . . . . 0.0 110.707 -179.833 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 358' ' ' VAL . . . . . 0.512 ' O ' HG23 ' B' ' 362' ' ' VAL . 71.5 t -63.5 -59.92 3.57 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-N 116.101 -0.499 . . . . 0.0 111.173 179.889 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 359' ' ' TYR . . . . . . . . . . . . . 46.5 t80 -52.36 -32.47 38.6 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.375 -0.375 . . . . 0.0 111.569 -179.335 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 360' ' ' ALA . . . . . . . . . . . . . . . -68.42 -60.54 2.36 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.77 0.319 . . . . 0.0 111.075 -179.95 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 361' ' ' GLN . . . . . . . . . . . . . 25.0 mt-30 -55.44 -45.5 76.82 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.68 179.939 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 362' ' ' VAL . . . . . 0.512 HG23 ' O ' ' B' ' 358' ' ' VAL . 57.5 t -61.61 -36.96 76.66 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.217 0 CA-C-N 116.152 -0.477 . . . . 0.0 110.305 179.399 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 363' ' ' ALA . . . . . . . . . . . . . . . -63.84 -34.69 78.49 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.104 179.133 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 364' ' ' ARG . . . . . . . . . . . . . 59.2 ttt180 -75.83 -26.93 57.64 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.821 -0.627 . . . . 0.0 110.085 179.197 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 365' ' ' LEU . . . . . . . . . . . . . 2.5 mp -60.04 -57.97 10.53 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.792 179.333 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 366' ' ' PHE . . . . . 0.423 ' HB3' ' HB2' ' B' ' 369' ' ' GLN . 4.9 m-85 -104.97 133.72 49.29 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.609 179.937 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 367' ' ' LYS . . . . . . . . . . . . . 96.7 mttt -105.23 -78.0 0.58 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.844 0.354 . . . . 0.0 111.15 -179.636 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 368' ' ' ASN . . . . . . . . . . . . . 14.8 m120 -66.88 -16.59 64.41 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.935 -179.982 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 369' ' ' GLN . . . . . 0.423 ' HB2' ' HB3' ' B' ' 366' ' ' PHE . 22.7 mt-30 -97.02 85.75 3.81 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.947 179.964 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 370' ' ' GLU . . . . . . . . . . . . . 10.5 mm-40 -94.06 -6.03 46.09 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.068 -0.515 . . . . 0.0 111.095 179.847 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 371' ' ' ASP . . . . . . . . . . . . . 20.2 t70 -58.67 -62.77 1.62 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.009 -179.976 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 372' ' ' LEU . . . . . 0.558 HD12 ' N ' ' B' ' 373' ' ' LEU . 0.3 OUTLIER -62.25 -22.52 66.04 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.077 179.927 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 373' ' ' LEU . . . . . 0.558 ' N ' HD12 ' B' ' 372' ' ' LEU . 6.1 tp -70.18 -39.82 75.04 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.25 -179.997 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 374' ' ' SER . . . . . . . . . . . . . 54.7 m -71.98 -48.82 42.24 Favored 'General case' 0 C--O 1.234 0.274 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.065 179.247 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 375' ' ' GLU . . . . . . . . . . . . . 15.3 mm-40 -54.43 -44.79 72.75 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-N 116.009 -0.542 . . . . 0.0 110.057 179.361 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 376' ' ' PHE . . . . . . . . . . . . . 82.3 t80 -65.54 -38.52 89.85 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.015 -0.538 . . . . 0.0 109.934 179.206 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 377' ' ' GLY . . . . . . . . . . . . . . . -58.05 -34.27 72.12 Favored Glycine 0 N--CA 1.449 -0.451 0 C-N-CA 120.683 -0.77 . . . . 0.0 111.721 179.332 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 378' ' ' GLN . . . . . . . . . . . . . 98.1 mt-30 -60.99 -34.73 75.24 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.68 0.276 . . . . 0.0 110.711 179.381 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 379' ' ' PHE . . . . . . . . . . . . . 56.6 m-85 -59.57 -36.5 76.34 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.57 179.656 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 380' ' ' LEU . . . . . . . . . . . . . 93.5 mt -54.22 145.49 35.44 Favored Pre-proline 0 C--N 1.331 -0.204 0 CA-C-N 115.921 -0.581 . . . . 0.0 110.644 179.834 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 381' ' ' PRO . . . . . 0.47 ' HG3' ' HB3' ' A' ' 376' ' ' GLN . 76.6 Cg_exo -50.69 107.49 0.17 Allowed 'Trans proline' 0 C--N 1.346 0.428 0 C-N-CA 122.408 2.072 . . . . 0.0 112.226 179.929 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 382' ' ' ASP . . . . . . . . . . . . . 16.4 m-20 -66.45 134.67 52.94 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.92 -179.962 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 383' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.077 0 CA-C-O 118.206 -0.902 . . . . 0.0 111.173 -179.845 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 358' ' ' ASP . . . . . . . . . . . . . 15.3 t70 . . . . . 0 N--CA 1.486 1.34 0 CA-C-O 120.903 0.382 . . . . 0.0 110.829 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 359' ' ' PHE . . . . . . . . . . . . . 41.9 p90 -87.8 178.99 6.57 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.73 179.901 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 360' ' ' THR . . . . . . . . . . . . . 73.7 p -101.61 130.51 24.49 Favored Pre-proline 0 C--N 1.328 -0.363 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.887 179.838 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 361' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_endo -74.33 -172.04 1.07 Allowed 'Trans proline' 0 C--N 1.348 0.519 0 C-N-CA 122.376 2.05 . . . . 0.0 112.212 179.978 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 362' ' ' MET . . . . . 0.582 ' HG2' HD13 ' B' ' 329' ' ' LEU . 2.1 tmt? -76.24 -71.12 0.4 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.561 179.932 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 363' ' ' ASP . . . . . 0.41 ' HB3' ' SD ' ' A' ' 362' ' ' MET . 14.6 t70 -179.72 -37.98 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 115.89 -0.596 . . . . 0.0 110.039 179.783 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 364' ' ' SER . . . . . . . . . . . . . 35.6 t -124.24 29.35 6.41 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.715 -0.675 . . . . 0.0 110.155 179.608 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 365' ' ' SER . . . . . . . . . . . . . 49.7 m 62.33 96.77 0.04 OUTLIER 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 115.726 -0.67 . . . . 0.0 111.138 -179.781 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 366' ' ' ALA . . . . . . . . . . . . . . . -75.66 -18.1 59.76 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.033 -0.531 . . . . 0.0 110.762 179.75 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 367' ' ' VAL . . . . . . . . . . . . . 21.9 t -59.64 -19.4 16.81 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.744 179.918 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 368' ' ' TYR . . . . . . . . . . . . . 84.7 t80 -65.91 -60.03 3.26 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.061 -179.993 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 369' ' ' VAL . . . . . 0.439 HG21 ' HB3' ' B' ' 332' ' ' LEU . 20.8 m -67.82 -36.82 77.14 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.19 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.555 -179.697 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 370' ' ' LEU . . . . . . . . . . . . . 97.5 mt -62.4 -58.46 7.56 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.958 0.409 . . . . 0.0 110.94 179.88 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 371' ' ' SER . . . . . . . . . . . . . 36.6 t -58.87 -51.4 70.17 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.045 -0.525 . . . . 0.0 111.037 179.8 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 372' ' ' SER . . . . . . . . . . . . . 93.0 p -55.17 -41.32 71.72 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.338 -179.503 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 373' ' ' MET . . . . . 0.575 ' HG2' ' H ' ' B' ' 380' ' ' LEU . 54.3 ttm -62.97 -41.49 99.56 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.458 -0.337 . . . . 0.0 111.186 -179.724 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 374' ' ' ALA . . . . . . . . . . . . . . . -87.03 -6.68 58.65 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.357 -0.383 . . . . 0.0 111.922 -179.595 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 375' ' ' ARG . . . . . . . . . . . . . 22.1 mmm180 -107.81 -12.64 15.16 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.591 0.234 . . . . 0.0 111.603 -179.804 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 376' ' ' GLN . . . . . 0.573 ' HB3' ' HG3' ' B' ' 381' ' ' PRO . 54.0 tt0 -83.25 14.57 3.44 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 121.039 0.447 . . . . 0.0 110.892 -179.727 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 377' ' ' ARG . . . . . 0.441 ' HG2' ' H ' ' B' ' 382' ' ' ASP . 69.8 mtm180 -63.39 -22.16 66.72 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.843 179.9 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 378' ' ' ARG . . . . . . . . . . . . . 27.3 tpt180 -149.55 112.38 4.82 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.077 -0.511 . . . . 0.0 110.745 -179.96 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 379' ' ' ALA . . . . . . . . . . . . . . . -61.64 137.8 58.27 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.001 179.912 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 380' ' ' SER . . . . . . . . . . . . . 58.1 m . . . . . 0 C--O 1.249 1.047 0 CA-C-O 118.26 -0.876 . . . . 0.0 110.941 -179.997 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' B' B ' 295' ' ' SER . . . . . . . . . . . . . 47.7 t . . . . . 0 N--CA 1.485 1.284 0 CA-C-O 120.912 0.387 . . . . 0.0 110.937 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' B' B ' 296' ' ' LEU . . . . . 0.408 HD22 ' N ' ' B' ' 296' ' ' LEU . 3.8 mm? -92.26 115.09 27.77 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.896 -179.93 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 297' ' ' GLN . . . . . . . . . . . . . 4.7 pt20 -151.25 -14.6 0.21 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.817 179.97 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 298' ' ' ASN . . . . . . . . . . . . . 12.0 m120 58.47 -177.07 0.08 Allowed 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.983 -179.91 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 299' ' ' ASN . . . . . . . . . . . . . 30.4 m-80 -118.63 -65.48 1.17 Allowed 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.85 -179.993 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 300' ' ' GLN . . . . . 0.608 ' H ' ' HD2' ' B' ' 301' ' ' PRO . 35.3 tt0 -169.41 -51.85 0.0 OUTLIER Pre-proline 0 CA--C 1.535 0.368 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.599 -179.947 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 301' ' ' PRO . . . . . 0.608 ' HD2' ' H ' ' B' ' 300' ' ' GLN . 61.1 Cg_endo -73.09 134.23 20.96 Favored 'Trans proline' 0 C--N 1.353 0.786 0 C-N-CA 121.986 1.791 . . . . 0.0 112.443 -179.866 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 302' ' ' VAL . . . . . . . . . . . . . 8.2 p -92.13 -32.06 5.0 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.912 179.809 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 303' ' ' GLU . . . . . 0.408 ' HG3' ' H ' ' B' ' 303' ' ' GLU . 18.7 mt-10 -54.48 -81.18 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.629 -0.714 . . . . 0.0 111.709 -179.244 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 304' ' ' PHE . . . . . 0.561 ' HA ' HD13 ' B' ' 308' ' ' ILE . 80.8 t80 -51.07 -50.15 59.25 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.871 -179.199 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 305' ' ' ASN . . . . . . . . . . . . . 27.7 t-20 -50.43 -72.76 0.05 OUTLIER 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 112.634 0.605 . . . . 0.0 112.634 -178.817 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 306' ' ' HIS . . . . . . . . . . . . . 20.1 m-70 -58.95 -55.27 37.33 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 113.024 0.75 . . . . 0.0 113.024 -177.994 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 307' ' ' ALA . . . . . . . . . . . . . . . -50.66 -62.37 1.64 Allowed 'General case' 0 CA--C 1.532 0.277 0 N-CA-C 112.554 0.576 . . . . 0.0 112.554 -178.678 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 308' ' ' ILE . . . . . 0.561 HD13 ' HA ' ' B' ' 304' ' ' PHE . 1.8 mp -57.91 -52.79 53.78 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.219 0 N-CA-C 112.024 0.379 . . . . 0.0 112.024 -179.071 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 309' ' ' ASN . . . . . . . . . . . . . 12.3 m120 -54.33 -28.97 46.24 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.643 0.258 . . . . 0.0 111.427 -179.473 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 310' ' ' TYR . . . . . 0.563 ' O ' ' HG3' ' B' ' 313' ' ' LYS . 43.7 t80 -74.09 -61.26 1.92 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.948 0.404 . . . . 0.0 111.059 -179.674 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 311' ' ' VAL . . . . . . . . . . . . . 58.5 t -58.64 -27.73 35.01 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.428 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.673 179.949 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 312' ' ' ASN . . . . . . . . . . . . . 7.5 t30 -72.49 -56.69 5.01 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.71 -179.148 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 313' ' ' LYS . . . . . 0.563 ' HG3' ' O ' ' B' ' 310' ' ' TYR . 0.0 OUTLIER -56.56 -38.09 71.45 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.648 0.261 . . . . 0.0 111.465 -179.359 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 314' ' ' ILE . . . . . 0.419 HG13 ' O ' ' B' ' 310' ' ' TYR . 11.0 mt -78.08 -31.14 16.4 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.22 0 N-CA-C 111.958 0.355 . . . . 0.0 111.958 -179.409 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 315' ' ' LYS . . . . . 0.409 ' HE3' ' HB3' ' B' ' 315' ' ' LYS . 1.4 tmmt? -70.54 -34.92 72.81 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.61 0.243 . . . . 0.0 111.281 -179.983 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 316' ' ' ASN . . . . . . . . . . . . . 61.5 t30 -86.01 -38.55 17.78 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.478 -0.328 . . . . 0.0 111.746 -179.087 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 317' ' ' ARG . . . . . . . . . . . . . 32.6 tpt180 -75.58 -44.13 44.71 Favored 'General case' 0 C--N 1.327 -0.374 0 N-CA-C 111.733 0.272 . . . . 0.0 111.733 -179.29 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 318' ' ' PHE . . . . . . . . . . . . . 62.9 m-85 -98.0 34.63 1.88 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.537 -0.302 . . . . 0.0 111.394 -179.455 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 319' ' ' GLN . . . . . . . . . . . . . 3.8 pt20 -67.97 -9.13 42.97 Favored 'General case' 0 N--CA 1.447 -0.602 0 CA-C-N 116.443 -0.344 . . . . 0.0 111.068 179.658 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 320' ' ' GLY . . . . . . . . . . . . . . . -96.05 -19.11 29.56 Favored Glycine 0 N--CA 1.451 -0.347 0 C-N-CA 120.845 -0.693 . . . . 0.0 112.711 -179.857 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 321' ' ' GLN . . . . . . . . . . . . . 58.9 mt-30 -108.07 92.27 9.1 Favored Pre-proline 0 C--N 1.33 -0.274 0 CA-C-O 120.473 0.178 . . . . 0.0 111.139 179.935 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 322' ' ' PRO . . . . . . . . . . . . . 93.0 Cg_endo -79.03 -23.57 7.67 Favored 'Trans proline' 0 C--N 1.349 0.601 0 C-N-CA 122.502 2.135 . . . . 0.0 112.355 179.75 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 323' ' ' ASP . . . . . . . . . . . . . 10.0 m-20 -69.36 -52.69 24.67 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.824 179.949 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 324' ' ' ILE . . . . . . . . . . . . . 64.4 mt -69.12 -42.54 81.85 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.98 179.929 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 325' ' ' TYR . . . . . . . . . . . . . 40.3 t80 -58.21 -57.17 14.03 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.697 179.874 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 326' ' ' LYS . . . . . 0.463 ' O ' ' HG2' ' B' ' 330' ' ' GLU . 28.6 mtpp -57.84 -46.8 84.22 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.938 179.789 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 327' ' ' ALA . . . . . . . . . . . . . . . -48.19 -54.14 14.51 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 116.308 -0.405 . . . . 0.0 111.193 -179.916 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 328' ' ' PHE . . . . . . . . . . . . . 84.0 t80 -56.12 -47.29 78.41 Favored 'General case' 0 C--O 1.237 0.405 0 CA-C-O 121.14 0.495 . . . . 0.0 109.903 179.283 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 329' ' ' LEU . . . . . 0.582 HD13 ' HG2' ' A' ' 362' ' ' MET . 91.7 mt -61.36 -26.19 67.66 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.614 -0.721 . . . . 0.0 110.636 179.496 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 330' ' ' GLU . . . . . 0.463 ' HG2' ' O ' ' B' ' 326' ' ' LYS . 16.1 mm-40 -75.63 -32.89 60.42 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.151 -0.477 . . . . 0.0 109.983 179.454 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 331' ' ' ILE . . . . . 0.493 HG22 HG22 ' B' ' 358' ' ' VAL . 74.4 mt -67.22 -47.53 81.2 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.191 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.343 179.063 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 332' ' ' LEU . . . . . 0.439 ' HB3' HG21 ' A' ' 369' ' ' VAL . 9.3 mp -69.21 -35.87 76.66 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.755 179.426 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 333' ' ' HIS . . . . . . . . . . . . . 17.0 t-80 -64.05 -52.94 57.03 Favored 'General case' 0 C--O 1.232 0.182 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.37 179.608 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 334' ' ' THR . . . . . . . . . . . . . 84.4 m -60.44 -36.78 79.02 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.036 -0.529 . . . . 0.0 109.838 179.094 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 335' ' ' TYR . . . . . . . . . . . . . 50.9 t80 -61.36 -37.1 82.13 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.516 -0.765 . . . . 0.0 109.933 179.249 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 336' ' ' GLN . . . . . . . . . . . . . 9.8 tt0 -66.01 -51.6 56.87 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 115.798 -0.637 . . . . 0.0 110.492 179.315 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 337' ' ' LYS . . . . . . . . . . . . . 27.1 ttpp -55.36 -39.21 69.8 Favored 'General case' 0 C--O 1.233 0.195 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.936 179.853 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 338' ' ' GLU . . . . . . . . . . . . . 15.6 mm-40 -66.47 -42.29 87.75 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.94 179.881 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 339' ' ' GLN . . . . . . . . . . . . . 74.0 mt-30 -61.45 -42.4 98.71 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.323 -0.398 . . . . 0.0 110.957 179.608 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 340' ' ' ARG . . . . . . . . . . . . . 73.6 mtp180 -62.39 -55.27 29.52 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.901 -179.875 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 341' ' ' ASN . . . . . . . . . . . . . 82.7 m-20 -57.17 -35.01 69.04 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.874 179.912 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 342' ' ' ALA . . . . . . . . . . . . . . . -66.31 -43.24 86.79 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.061 -0.518 . . . . 0.0 111.102 179.92 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 343' ' ' LYS . . . . . . . . . . . . . 14.4 tmtt? -65.03 -46.64 80.44 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.634 -179.979 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 344' ' ' GLU . . . . . . . . . . . . . 12.5 mm-40 -63.98 -32.44 73.98 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.886 -179.999 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 345' ' ' ALA . . . . . . . . . . . . . . . -67.66 -23.13 65.29 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.029 179.938 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 346' ' ' GLY . . . . . . . . . . . . . . . 112.54 -67.66 0.24 Allowed Glycine 0 N--CA 1.452 -0.258 0 C-N-CA 120.728 -0.749 . . . . 0.0 112.529 179.99 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 347' ' ' GLY . . . . . . . . . . . . . . . 172.14 -17.2 0.05 OUTLIER Glycine 0 N--CA 1.452 -0.274 0 C-N-CA 120.772 -0.728 . . . . 0.0 112.454 -179.964 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 348' ' ' ASN . . . . . . . . . . . . . 24.2 t-20 -73.7 -10.37 59.62 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 121.011 0.434 . . . . 0.0 110.513 -179.972 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 349' ' ' TYR . . . . . . . . . . . . . 82.8 t80 -84.44 150.86 25.02 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.961 -0.563 . . . . 0.0 111.058 -179.86 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 350' ' ' THR . . . . . . . . . . . . . 93.3 m -119.87 105.58 42.76 Favored Pre-proline 0 C--N 1.33 -0.282 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.795 179.772 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 351' ' ' PRO . . . . . . . . . . . . . 54.7 Cg_exo -52.39 134.25 51.11 Favored 'Trans proline' 0 C--N 1.349 0.579 0 C-N-CA 122.464 2.109 . . . . 0.0 112.497 -179.956 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 352' ' ' ALA . . . . . . . . . . . . . . . -61.04 -59.43 5.38 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.028 179.936 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 353' ' ' LEU . . . . . 0.447 ' HG ' ' HG2' ' B' ' 357' ' ' GLU . 5.9 mp -89.88 117.6 28.82 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.856 0.36 . . . . 0.0 111.137 179.921 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 354' ' ' THR . . . . . 0.423 ' H ' ' HB2' ' B' ' 357' ' ' GLU . 73.1 p -110.62 -171.19 1.78 Allowed 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.088 -0.506 . . . . 0.0 110.551 179.427 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 355' ' ' GLU . . . . . . . . . . . . . 34.8 mt-10 -54.9 -42.55 72.29 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 121.065 0.46 . . . . 0.0 110.406 179.671 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 356' ' ' GLN . . . . . . . . . . . . . 96.5 mt-30 -67.2 -35.86 80.5 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.667 -0.697 . . . . 0.0 111.054 -179.936 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 357' ' ' GLU . . . . . 0.447 ' HG2' ' HG ' ' B' ' 353' ' ' LEU . 5.7 tp10 -62.41 -53.85 48.95 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.528 -0.306 . . . . 0.0 110.877 -179.703 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 358' ' ' VAL . . . . . 0.502 ' O ' HG23 ' B' ' 362' ' ' VAL . 72.6 t -59.83 -57.03 13.49 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.413 -0.358 . . . . 0.0 111.042 179.984 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 359' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -51.85 -35.19 43.9 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.806 0.336 . . . . 0.0 110.932 -179.527 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 360' ' ' ALA . . . . . . . . . . . . . . . -68.38 -59.21 3.34 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.501 -0.318 . . . . 0.0 111.451 -179.904 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 361' ' ' GLN . . . . . . . . . . . . . 13.3 mm100 -53.66 -42.68 68.11 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.993 -179.991 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 362' ' ' VAL . . . . . 0.502 HG23 ' O ' ' B' ' 358' ' ' VAL . 49.0 t -68.96 -37.66 77.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.732 179.82 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 363' ' ' ALA . . . . . 0.587 ' HA ' HD21 ' B' ' 373' ' ' LEU . . . -59.62 -38.25 80.82 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.736 179.687 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 364' ' ' ARG . . . . . . . . . . . . . 77.6 ttt180 -90.33 -18.79 24.92 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.826 -0.624 . . . . 0.0 110.723 179.964 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 365' ' ' LEU . . . . . . . . . . . . . 25.2 tp -55.7 -30.82 61.77 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.531 179.749 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 366' ' ' PHE . . . . . . . . . . . . . 69.3 m-85 -112.63 159.89 18.43 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.31 179.724 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 367' ' ' LYS . . . . . . . . . . . . . 34.5 mmtp -89.34 -75.67 0.43 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.407 -0.36 . . . . 0.0 111.551 -179.31 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 368' ' ' ASN . . . . . . . . . . . . . 29.4 m-80 -115.48 14.95 16.74 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.406 -0.361 . . . . 0.0 111.136 -179.59 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 369' ' ' GLN . . . . . . . . . . . . . 70.9 mt-30 -89.61 90.3 8.19 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.891 179.989 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 370' ' ' GLU . . . . . . . . . . . . . 34.3 mt-10 -91.8 -11.44 36.59 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.755 179.986 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 371' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -58.4 -57.58 12.27 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.83 179.947 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 372' ' ' LEU . . . . . . . . . . . . . 23.1 mt -61.74 -38.59 88.51 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.491 179.75 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 373' ' ' LEU . . . . . 0.587 HD21 ' HA ' ' B' ' 363' ' ' ALA . 1.0 OUTLIER -56.71 -38.93 73.02 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.567 179.866 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 374' ' ' SER . . . . . . . . . . . . . 70.8 m -73.25 -44.87 58.64 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.046 -0.524 . . . . 0.0 110.296 179.417 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 375' ' ' GLU . . . . . . . . . . . . . 28.1 mm-40 -56.76 -34.34 67.49 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.347 179.437 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 376' ' ' PHE . . . . . . . . . . . . . 66.8 t80 -82.58 -30.12 29.8 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.878 -0.601 . . . . 0.0 109.854 179.266 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 377' ' ' GLY . . . . . . . . . . . . . . . -64.59 -31.37 80.67 Favored Glycine 0 N--CA 1.45 -0.389 0 C-N-CA 120.837 -0.697 . . . . 0.0 111.909 179.326 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 378' ' ' GLN . . . . . . . . . . . . . 30.1 mm-40 -56.8 -26.76 58.58 Favored 'General case' 0 C--N 1.333 -0.139 0 CA-C-O 120.953 0.406 . . . . 0.0 110.477 179.553 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 379' ' ' PHE . . . . . . . . . . . . . 63.6 m-85 -73.12 -148.19 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.627 179.527 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 380' ' ' LEU . . . . . 0.575 ' H ' ' HG2' ' A' ' 373' ' ' MET . 32.7 mt 66.81 131.13 0.03 OUTLIER Pre-proline 0 CA--C 1.531 0.226 0 CA-C-N 116.482 -0.326 . . . . 0.0 110.789 179.991 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 381' ' ' PRO . . . . . 0.573 ' HG3' ' HB3' ' A' ' 376' ' ' GLN . 62.8 Cg_exo -51.55 125.66 17.36 Favored 'Trans proline' 0 C--N 1.349 0.582 0 C-N-CA 122.28 1.986 . . . . 0.0 112.486 179.989 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 382' ' ' ASP . . . . . 0.441 ' H ' ' HG2' ' A' ' 377' ' ' ARG . 3.3 p30 -132.05 -179.69 5.57 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.894 179.952 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 383' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.077 0 CA-C-O 118.225 -0.893 . . . . 0.0 111.026 -179.929 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 358' ' ' ASP . . . . . . . . . . . . . 7.7 m-20 . . . . . 0 N--CA 1.486 1.36 0 CA-C-O 120.789 0.328 . . . . 0.0 110.899 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 359' ' ' PHE . . . . . . . . . . . . . 5.4 t80 -106.04 145.0 31.96 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.676 -179.926 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 360' ' ' THR . . . . . 0.42 ' HB ' ' HD2' ' A' ' 361' ' ' PRO . 43.9 p -58.01 157.66 15.39 Favored Pre-proline 0 C--N 1.33 -0.281 0 CA-C-N 116.178 -0.464 . . . . 0.0 111.346 179.959 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 361' ' ' PRO . . . . . 0.42 ' HD2' ' HB ' ' A' ' 360' ' ' THR . 30.8 Cg_endo -63.67 -5.08 8.05 Favored 'Trans proline' 0 C--N 1.349 0.596 0 C-N-CA 122.532 2.155 . . . . 0.0 112.51 179.858 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 362' ' ' MET . . . . . 0.581 ' HG3' HD13 ' B' ' 329' ' ' LEU . 26.4 mmt -79.04 11.04 2.95 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.735 179.787 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 363' ' ' ASP . . . . . . . . . . . . . 21.8 t70 -83.57 -6.12 59.36 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.871 179.892 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 364' ' ' SER . . . . . . . . . . . . . 48.8 m -141.79 -22.25 0.72 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.798 179.771 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 365' ' ' SER . . . . . . . . . . . . . 46.9 t -73.66 -63.13 1.27 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.738 179.783 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 366' ' ' ALA . . . . . . . . . . . . . . . -64.12 -17.98 63.98 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.09 179.806 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 367' ' ' VAL . . . . . . . . . . . . . 39.9 t -73.22 -31.39 34.21 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.051 -179.995 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 368' ' ' TYR . . . . . . . . . . . . . 49.1 t80 -70.42 -42.77 71.17 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.932 -179.885 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 369' ' ' VAL . . . . . 0.431 HG13 ' N ' ' A' ' 370' ' ' LEU . 5.7 p -70.56 -46.88 68.05 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.216 0 CA-C-N 116.242 -0.436 . . . . 0.0 111.157 -179.923 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 370' ' ' LEU . . . . . 0.51 HD13 ' HA ' ' B' ' 307' ' ' ALA . 89.8 mt -60.18 -43.85 95.53 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.816 0.341 . . . . 0.0 110.868 179.808 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 371' ' ' SER . . . . . . . . . . . . . 45.2 t -62.01 -57.28 12.25 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.967 179.89 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 372' ' ' SER . . . . . 0.407 ' O ' ' HG2' ' A' ' 376' ' ' GLN . 47.3 t -51.59 -50.85 59.36 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.224 -179.77 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 373' ' ' MET . . . . . . . . . . . . . 94.2 mtp -54.18 -45.54 72.14 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.353 -179.768 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 374' ' ' ALA . . . . . . . . . . . . . . . -79.81 -9.81 59.71 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.583 -0.28 . . . . 0.0 111.635 -179.832 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 375' ' ' ARG . . . . . . . . . . . . . 22.3 mmm180 -100.68 -12.13 19.41 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.558 -0.292 . . . . 0.0 111.363 179.871 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 376' ' ' GLN . . . . . 0.573 ' HB2' ' HG3' ' B' ' 381' ' ' PRO . 18.1 mm-40 -78.18 -7.65 57.34 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.511 -0.313 . . . . 0.0 111.084 179.952 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 377' ' ' ARG . . . . . . . . . . . . . 15.0 ptp180 -63.86 121.67 14.61 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.975 0.417 . . . . 0.0 110.978 -179.641 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 378' ' ' ARG . . . . . . . . . . . . . 99.6 mtt180 53.27 25.53 4.49 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.033 -0.531 . . . . 0.0 111.322 179.798 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 379' ' ' ALA . . . . . . . . . . . . . . . -82.25 -16.99 47.56 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.387 -0.37 . . . . 0.0 111.14 -179.995 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 380' ' ' SER . . . . . . . . . . . . . 64.7 p . . . . . 0 C--O 1.249 1.065 0 CA-C-O 118.33 -0.843 . . . . 0.0 110.947 -179.966 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' B' B ' 295' ' ' SER . . . . . . . . . . . . . 61.1 m . . . . . 0 N--CA 1.486 1.351 0 CA-C-O 120.784 0.326 . . . . 0.0 110.917 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' B' B ' 296' ' ' LEU . . . . . . . . . . . . . 62.0 mt -112.83 -4.44 13.99 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.89 -179.927 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 297' ' ' GLN . . . . . . . . . . . . . 47.5 mt-30 -110.63 157.11 20.05 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.319 -0.401 . . . . 0.0 111.061 -179.921 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 298' ' ' ASN . . . . . 0.546 HD22 ' N ' ' B' ' 298' ' ' ASN . 0.9 OUTLIER 58.73 -177.5 0.08 Allowed 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.099 179.896 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 299' ' ' ASN . . . . . . . . . . . . . 17.1 m120 -112.55 -40.85 3.97 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.948 -179.94 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 300' ' ' GLN . . . . . . . . . . . . . 25.5 tp60 -120.42 100.65 47.15 Favored Pre-proline 0 C--N 1.33 -0.278 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.069 -179.869 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 301' ' ' PRO . . . . . . . . . . . . . 40.1 Cg_endo -66.46 114.74 3.19 Favored 'Trans proline' 0 C--N 1.349 0.579 0 C-N-CA 122.301 2.001 . . . . 0.0 112.046 179.776 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 302' ' ' VAL . . . . . . . . . . . . . 10.3 p -83.28 -33.28 9.95 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.147 -179.823 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 303' ' ' GLU . . . . . . . . . . . . . 27.7 mt-10 -52.12 -74.08 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.859 -0.609 . . . . 0.0 112.016 -179.407 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 304' ' ' PHE . . . . . . . . . . . . . 90.3 m-85 -50.07 -66.52 0.38 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.968 -0.56 . . . . 0.0 112.291 -178.96 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 305' ' ' ASN . . . . . . . . . . . . . 16.8 m120 -41.77 -61.91 1.01 Allowed 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 112.798 0.666 . . . . 0.0 112.798 -178.704 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 306' ' ' HIS . . . . . . . . . . . . . 11.2 m170 -60.46 -67.52 0.39 Allowed 'General case' 0 C--N 1.33 -0.246 0 N-CA-C 112.703 0.631 . . . . 0.0 112.703 -178.519 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 307' ' ' ALA . . . . . 0.51 ' HA ' HD13 ' A' ' 370' ' ' LEU . . . -48.64 -58.11 5.23 Favored 'General case' 0 C--N 1.33 -0.27 0 N-CA-C 112.388 0.514 . . . . 0.0 112.388 -178.542 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 308' ' ' ILE . . . . . . . . . . . . . 42.8 mm -53.37 -60.0 1.51 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 N-CA-C 112.001 0.371 . . . . 0.0 112.001 -179.247 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 309' ' ' ASN . . . . . . . . . . . . . 14.0 m120 -57.82 -25.02 60.05 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 120.594 0.235 . . . . 0.0 111.615 -179.298 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 310' ' ' TYR . . . . . . . . . . . . . 36.3 t80 -69.87 -56.27 7.53 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.506 -0.315 . . . . 0.0 111.128 -179.541 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 311' ' ' VAL . . . . . . . . . . . . . 40.7 t -59.29 -44.05 91.33 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.719 179.976 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 312' ' ' ASN . . . . . . . . . . . . . 7.2 t30 -62.01 -39.94 93.98 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.925 179.914 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 313' ' ' LYS . . . . . . . . . . . . . 4.5 ttmm -60.62 -60.17 4.22 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.985 -179.924 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 314' ' ' ILE . . . . . . . . . . . . . 32.3 mt -59.48 -27.71 37.94 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.129 -179.5 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 315' ' ' LYS . . . . . . . . . . . . . 23.3 ttmm -70.18 -40.86 74.41 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.534 -0.303 . . . . 0.0 111.031 179.649 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 316' ' ' ASN . . . . . . . . . . . . . 60.3 t30 -88.89 -8.53 54.08 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.352 -0.386 . . . . 0.0 110.976 -179.716 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 317' ' ' ARG . . . . . . . . . . . . . 20.7 tpp180 -95.34 -61.8 1.41 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.084 -179.933 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 318' ' ' PHE . . . . . . . . . . . . . 73.6 m-85 -94.37 34.73 1.26 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.333 -179.767 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 319' ' ' GLN . . . . . . . . . . . . . 20.9 tm0? -61.62 -31.01 71.07 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.37 179.557 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 320' ' ' GLY . . . . . . . . . . . . . . . -60.33 -62.51 5.94 Favored Glycine 0 C--N 1.332 0.312 0 C-N-CA 120.986 -0.626 . . . . 0.0 112.704 -179.858 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 321' ' ' GLN . . . . . . . . . . . . . 15.0 mm100 -79.36 111.75 23.08 Favored Pre-proline 0 CA--C 1.531 0.22 0 CA-C-N 116.513 0.157 . . . . 0.0 110.989 -179.865 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 322' ' ' PRO . . . . . . . . . . . . . 97.1 Cg_endo -83.96 -22.81 3.36 Favored 'Trans proline' 0 C--N 1.349 0.582 0 C-N-CA 122.547 2.165 . . . . 0.0 112.619 179.989 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 323' ' ' ASP . . . . . . . . . . . . . 6.7 m-20 -70.12 -49.06 54.5 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.268 -0.423 . . . . 0.0 111.155 -179.725 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 324' ' ' ILE . . . . . . . . . . . . . 51.5 mt -64.7 -47.58 88.2 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.205 -179.825 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 325' ' ' TYR . . . . . . . . . . . . . 23.5 t80 -60.09 -52.4 65.52 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.078 -179.767 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 326' ' ' LYS . . . . . 0.402 ' O ' ' HG3' ' B' ' 330' ' ' GLU . 87.8 tttt -59.36 -36.24 75.38 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.726 179.879 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 327' ' ' ALA . . . . . . . . . . . . . . . -59.9 -52.81 63.82 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.722 179.644 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 328' ' ' PHE . . . . . . . . . . . . . 81.2 t80 -55.51 -49.58 72.21 Favored 'General case' 0 C--O 1.236 0.346 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.74 179.818 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 329' ' ' LEU . . . . . 0.581 HD13 ' HG3' ' A' ' 362' ' ' MET . 89.4 mt -57.54 -38.47 74.77 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.931 -0.577 . . . . 0.0 111.023 179.89 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 330' ' ' GLU . . . . . 0.402 ' HG3' ' O ' ' B' ' 326' ' ' LYS . 44.7 mt-10 -67.08 -35.35 79.62 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.361 -0.381 . . . . 0.0 111.086 -179.845 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 331' ' ' ILE . . . . . . . . . . . . . 94.4 mt -64.67 -50.91 73.45 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-O 120.855 0.359 . . . . 0.0 110.442 179.348 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 332' ' ' LEU . . . . . . . . . . . . . 4.8 mp -65.97 -31.64 72.67 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.769 179.709 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 333' ' ' HIS . . . . . . . . . . . . . 52.9 t-80 -64.28 -58.06 7.63 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.025 179.34 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 334' ' ' THR . . . . . . . . . . . . . 96.7 m -58.22 -32.44 68.3 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.78 -0.645 . . . . 0.0 110.232 179.139 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 335' ' ' TYR . . . . . . . . . . . . . 74.9 t80 -63.04 -44.43 95.9 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 115.701 -0.681 . . . . 0.0 110.062 179.239 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 336' ' ' GLN . . . . . . . . . . . . . 54.0 tt0 -63.35 -39.47 94.63 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.739 -0.664 . . . . 0.0 110.33 179.488 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 337' ' ' LYS . . . . . . . . . . . . . 14.6 tppt? -58.68 -59.5 5.3 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.929 179.544 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 338' ' ' GLU . . . . . . . . . . . . . 13.6 mm-40 -60.67 -31.08 70.34 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.969 -0.56 . . . . 0.0 111.086 -179.819 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 339' ' ' GLN . . . . . . . . . . . . . 53.5 tt0 -64.47 -45.64 86.51 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.896 0.379 . . . . 0.0 110.793 179.895 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 340' ' ' ARG . . . . . . . . . . . . . 65.7 mtt180 -65.42 -51.61 59.04 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.003 -0.544 . . . . 0.0 111.049 -179.979 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 341' ' ' ASN . . . . . . . . . . . . . 25.8 t-20 -56.43 -39.0 72.36 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.11 -0.496 . . . . 0.0 111.032 -179.8 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 342' ' ' ALA . . . . . . . . . . . . . . . -69.62 -38.64 77.32 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.297 -0.41 . . . . 0.0 111.146 -179.905 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 343' ' ' LYS . . . . . . . . . . . . . 62.8 tttm -65.02 -43.63 91.82 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.262 -0.427 . . . . 0.0 110.888 -179.997 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 344' ' ' GLU . . . . . . . . . . . . . 18.3 mm-40 -70.02 -35.92 74.7 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.041 -179.963 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 345' ' ' ALA . . . . . . . . . . . . . . . -62.34 -35.64 79.73 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.188 -179.893 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 346' ' ' GLY . . . . . . . . . . . . . . . 123.01 -73.07 0.39 Allowed Glycine 0 N--CA 1.453 -0.228 0 C-N-CA 120.771 -0.728 . . . . 0.0 112.61 179.936 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 347' ' ' GLY . . . . . . . . . . . . . . . -177.74 -12.12 0.02 OUTLIER Glycine 0 N--CA 1.451 -0.326 0 C-N-CA 120.778 -0.725 . . . . 0.0 112.509 -179.924 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 348' ' ' ASN . . . . . . . . . . . . . 6.9 t30 -79.1 -23.09 44.34 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.81 0.338 . . . . 0.0 110.719 -179.979 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 349' ' ' TYR . . . . . . . . . . . . . 71.5 t80 -69.8 141.96 53.25 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.799 179.903 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 350' ' ' THR . . . . . . . . . . . . . 38.3 m -107.39 103.41 48.48 Favored Pre-proline 0 C--N 1.328 -0.326 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.248 -179.894 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 351' ' ' PRO . . . . . . . . . . . . . 48.8 Cg_exo -56.54 157.26 19.31 Favored 'Trans proline' 0 C--N 1.349 0.569 0 C-N-CA 122.461 2.107 . . . . 0.0 112.284 179.868 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 352' ' ' ALA . . . . . . . . . . . . . . . -86.82 -43.11 12.74 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.177 179.978 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 353' ' ' LEU . . . . . 0.437 ' HG ' ' HG2' ' B' ' 357' ' ' GLU . 6.6 mp -115.64 125.78 53.32 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.954 0.407 . . . . 0.0 111.182 -179.99 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 354' ' ' THR . . . . . . . . . . . . . 74.0 p -114.19 -170.23 1.68 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.509 179.329 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 355' ' ' GLU . . . . . 0.401 ' CD ' ' H ' ' B' ' 355' ' ' GLU . 2.8 mp0 -59.81 -33.69 72.07 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.926 0.393 . . . . 0.0 110.511 179.744 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 356' ' ' GLN . . . . . . . . . . . . . 95.8 mt-30 -74.21 -43.93 55.21 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.006 -0.543 . . . . 0.0 111.331 -179.796 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 357' ' ' GLU . . . . . 0.437 ' HG2' ' HG ' ' B' ' 353' ' ' LEU . 6.2 tp10 -57.23 -48.95 77.53 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 120.992 0.425 . . . . 0.0 110.552 -179.981 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 358' ' ' VAL . . . . . 0.506 ' O ' HG23 ' B' ' 362' ' ' VAL . 73.7 t -64.43 -58.41 7.34 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 115.853 -0.612 . . . . 0.0 111.277 -179.941 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 359' ' ' TYR . . . . . . . . . . . . . 50.1 t80 -53.93 -26.62 26.24 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.598 -0.274 . . . . 0.0 111.159 -179.48 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 360' ' ' ALA . . . . . . . . . . . . . . . -72.48 -60.36 2.27 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.773 0.321 . . . . 0.0 111.147 179.855 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 361' ' ' GLN . . . . . . . . . . . . . 72.7 mt-30 -57.3 -39.44 75.77 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.922 179.886 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 362' ' ' VAL . . . . . 0.506 HG23 ' O ' ' B' ' 358' ' ' VAL . 58.1 t -68.39 -38.59 79.58 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.638 179.637 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 363' ' ' ALA . . . . . 0.509 ' HA ' HD11 ' B' ' 373' ' ' LEU . . . -59.21 -43.76 92.29 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.457 179.43 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 364' ' ' ARG . . . . . . . . . . . . . 41.8 ttm180 -79.99 -21.62 43.43 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.859 -0.61 . . . . 0.0 110.484 179.742 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 365' ' ' LEU . . . . . . . . . . . . . 7.5 tp -58.73 -25.9 63.41 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.44 179.657 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 366' ' ' PHE . . . . . . . . . . . . . 47.2 m-85 -129.05 169.12 15.11 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.757 -0.656 . . . . 0.0 110.38 179.818 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 367' ' ' LYS . . . . . . . . . . . . . 55.9 mtmt -132.2 -79.58 0.5 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.786 0.327 . . . . 0.0 111.131 179.974 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 368' ' ' ASN . . . . . . . . . . . . . 22.3 t-20 -73.5 -12.44 60.78 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.827 -179.859 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 369' ' ' GLN . . . . . . . . . . . . . 26.8 mm-40 -96.54 84.12 3.62 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.104 -179.941 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 370' ' ' GLU . . . . . . . . . . . . . 17.4 mm-40 -94.13 -8.9 38.19 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.67 179.438 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 371' ' ' ASP . . . . . . . . . . . . . 7.4 m-20 -57.64 -63.65 1.17 Allowed 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.911 -179.984 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 372' ' ' LEU . . . . . 0.608 HD12 ' N ' ' B' ' 373' ' ' LEU . 0.4 OUTLIER -57.87 -23.14 51.72 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.994 179.872 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 373' ' ' LEU . . . . . 0.608 ' N ' HD12 ' B' ' 372' ' ' LEU . 4.6 tp -72.69 -39.91 66.66 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.253 179.869 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 374' ' ' SER . . . . . . . . . . . . . 47.4 t -69.16 -51.79 34.6 Favored 'General case' 0 C--O 1.235 0.315 0 CA-C-N 116.025 -0.534 . . . . 0.0 109.916 179.058 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 375' ' ' GLU . . . . . . . . . . . . . 43.0 mt-10 -53.23 -43.61 67.44 Favored 'General case' 0 N--CA 1.455 -0.221 0 CA-C-N 115.791 -0.64 . . . . 0.0 109.698 178.915 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 376' ' ' PHE . . . . . 0.403 ' O ' ' HB2' ' B' ' 379' ' ' PHE . 70.9 t80 -62.81 -39.63 94.9 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 115.714 -0.675 . . . . 0.0 110.043 179.172 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 377' ' ' GLY . . . . . . . . . . . . . . . -58.83 -34.9 79.91 Favored Glycine 0 N--CA 1.449 -0.498 0 C-N-CA 120.735 -0.745 . . . . 0.0 111.724 179.32 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 378' ' ' GLN . . . . . . . . . . . . . 55.8 mt-30 -62.99 -30.92 71.97 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.654 0.264 . . . . 0.0 110.962 179.534 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 379' ' ' PHE . . . . . 0.403 ' HB2' ' O ' ' B' ' 376' ' ' PHE . 50.2 m-85 -61.45 -35.34 77.32 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.354 -0.384 . . . . 0.0 110.74 179.715 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 380' ' ' LEU . . . . . . . . . . . . . 89.4 mt -56.07 138.25 72.92 Favored Pre-proline 0 C--N 1.329 -0.289 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.864 179.884 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 381' ' ' PRO . . . . . 0.573 ' HG3' ' HB2' ' A' ' 376' ' ' GLN . 72.3 Cg_exo -51.34 133.65 43.01 Favored 'Trans proline' 0 C--N 1.347 0.473 0 C-N-CA 122.447 2.098 . . . . 0.0 112.309 179.953 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 382' ' ' ASP . . . . . . . . . . . . . 9.8 m-20 -114.65 109.64 18.54 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.886 -179.947 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 383' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.033 0 CA-C-O 118.225 -0.893 . . . . 0.0 111.235 -179.81 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 358' ' ' ASP . . . . . . . . . . . . . 11.0 m-20 . . . . . 0 N--CA 1.485 1.298 0 CA-C-O 120.852 0.358 . . . . 0.0 110.941 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 359' ' ' PHE . . . . . . . . . . . . . 30.4 p90 -111.97 -173.55 2.27 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.834 -179.981 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 360' ' ' THR . . . . . . . . . . . . . 77.2 p -132.3 148.1 68.38 Favored Pre-proline 0 C--N 1.328 -0.333 0 CA-C-N 116.275 -0.421 . . . . 0.0 111.257 -179.969 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 361' ' ' PRO . . . . . . . . . . . . . 65.2 Cg_endo -73.07 -154.48 0.04 OUTLIER 'Trans proline' 0 C--N 1.347 0.457 0 C-N-CA 122.57 2.18 . . . . 0.0 112.047 179.754 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 362' ' ' MET . . . . . 0.646 ' HG3' HD13 ' B' ' 329' ' ' LEU . 24.7 ttt -56.32 -71.25 0.09 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.339 -0.391 . . . . 0.0 110.885 179.849 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 363' ' ' ASP . . . . . . . . . . . . . 19.0 t70 -169.82 -55.02 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.647 179.969 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 364' ' ' SER . . . . . . . . . . . . . 79.6 p -100.4 31.13 3.54 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.672 179.84 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 365' ' ' SER . . . . . 0.469 ' HB3' HG22 ' A' ' 367' ' ' VAL . 50.9 m 62.24 94.19 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.952 -0.567 . . . . 0.0 111.1 -179.799 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 366' ' ' ALA . . . . . . . . . . . . . . . -71.91 -13.35 61.62 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.89 179.85 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 367' ' ' VAL . . . . . 0.469 HG22 ' HB3' ' A' ' 365' ' ' SER . 26.9 m -51.22 -21.42 1.5 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.209 0 CA-C-N 115.974 -0.557 . . . . 0.0 111.732 -179.871 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 368' ' ' TYR . . . . . . . . . . . . . 45.7 m-85 -65.19 -61.08 2.35 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.58 -0.282 . . . . 0.0 110.836 179.758 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 369' ' ' VAL . . . . . 0.671 HG13 HD22 ' A' ' 370' ' ' LEU . 2.9 p -64.25 -43.63 97.27 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.204 0 CA-C-N 116.551 -0.295 . . . . 0.0 111.541 -179.882 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 370' ' ' LEU . . . . . 0.671 HD22 HG13 ' A' ' 369' ' ' VAL . 4.2 mm? -57.9 -59.59 5.01 Favored 'General case' 0 C--O 1.235 0.295 0 CA-C-O 120.936 0.398 . . . . 0.0 111.254 -179.955 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 371' ' ' SER . . . . . . . . . . . . . 55.2 m -59.84 -32.33 70.57 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.041 -179.844 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 372' ' ' SER . . . . . . . . . . . . . 47.8 t -59.51 -50.08 75.3 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.849 0.357 . . . . 0.0 110.972 179.904 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 373' ' ' MET . . . . . . . . . . . . . 83.8 mtp -67.1 -34.64 78.07 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.48 -179.749 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 374' ' ' ALA . . . . . . . . . . . . . . . -83.66 -12.69 55.61 Favored 'General case' 0 C--N 1.33 -0.267 0 N-CA-C 112.161 0.43 . . . . 0.0 112.161 -179.239 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 375' ' ' ARG . . . . . . . . . . . . . 27.4 tpt180 -108.74 -13.05 14.85 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.75 0.309 . . . . 0.0 111.059 -179.757 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 376' ' ' GLN . . . . . 0.541 ' HB3' ' HG3' ' B' ' 381' ' ' PRO . 34.2 tt0 -72.37 3.08 5.1 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 121.002 0.43 . . . . 0.0 110.573 179.764 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 377' ' ' ARG . . . . . 0.568 ' HG2' ' HA ' ' B' ' 381' ' ' PRO . 80.8 mtm180 -55.59 -34.14 64.55 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.903 179.896 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 378' ' ' ARG . . . . . . . . . . . . . 38.9 mmt180 -118.46 -39.22 3.04 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.08 -179.782 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 379' ' ' ALA . . . . . . . . . . . . . . . -79.3 168.75 19.11 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.369 -179.848 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 380' ' ' SER . . . . . . . . . . . . . 73.6 p . . . . . 0 C--O 1.25 1.094 0 CA-C-O 118.132 -0.937 . . . . 0.0 110.941 -179.993 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' B' B ' 295' ' ' SER . . . . . . . . . . . . . 49.3 m . . . . . 0 N--CA 1.485 1.318 0 CA-C-O 120.749 0.309 . . . . 0.0 110.94 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' B' B ' 296' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -87.92 -10.07 51.72 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.126 -179.975 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 297' ' ' GLN . . . . . . . . . . . . . 46.8 mt-30 -83.66 169.27 15.49 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.372 -0.376 . . . . 0.0 110.985 -179.915 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 298' ' ' ASN . . . . . . . . . . . . . 8.3 p30 -144.5 6.81 1.28 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.121 -0.49 . . . . 0.0 111.04 -179.872 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 299' ' ' ASN . . . . . . . . . . . . . 3.6 p30 -141.24 101.49 4.03 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.978 -179.886 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 300' ' ' GLN . . . . . 0.573 ' HB2' ' HD3' ' B' ' 301' ' ' PRO . 73.6 mt-30 -110.77 -51.03 0.06 OUTLIER Pre-proline 0 CA--C 1.534 0.361 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.576 179.978 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 301' ' ' PRO . . . . . 0.573 ' HD3' ' HB2' ' B' ' 300' ' ' GLN . 79.8 Cg_endo -87.81 27.76 0.53 Allowed 'Trans proline' 0 C--N 1.352 0.742 0 C-N-CA 122.301 2.001 . . . . 0.0 112.057 179.764 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 302' ' ' VAL . . . . . . . . . . . . . 12.8 p -55.59 -17.7 3.66 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-N 116.031 -0.531 . . . . 0.0 111.689 -179.47 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 303' ' ' GLU . . . . . . . . . . . . . 44.2 mt-10 -56.8 -87.35 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.404 -0.362 . . . . 0.0 111.638 -179.461 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 304' ' ' PHE . . . . . . . . . . . . . 42.6 p90 -65.61 -21.12 66.55 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.319 -0.401 . . . . 0.0 111.722 -179.176 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 305' ' ' ASN . . . . . . . . . . . . . 6.2 t30 -68.37 -64.68 0.82 Allowed 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.777 0.322 . . . . 0.0 111.032 -179.744 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 306' ' ' HIS . . . . . . . . . . . . . 18.8 t-160 -64.74 -34.44 78.32 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.3 -179.435 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 307' ' ' ALA . . . . . . . . . . . . . . . -64.43 -59.54 4.22 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.497 -0.32 . . . . 0.0 111.456 -179.736 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 308' ' ' ILE . . . . . . . . . . . . . 94.5 mt -56.98 -49.51 79.07 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 CA-C-N 116.53 -0.305 . . . . 0.0 111.406 -179.796 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 309' ' ' ASN . . . . . . . . . . . . . 3.6 m-20 -55.55 -40.93 72.54 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.809 0.338 . . . . 0.0 110.812 179.832 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 310' ' ' TYR . . . . . 0.454 ' O ' HG12 ' B' ' 314' ' ' ILE . 84.1 t80 -62.5 -64.24 0.98 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.902 -179.99 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 311' ' ' VAL . . . . . . . . . . . . . 55.4 t -52.84 -24.03 6.29 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.221 0 CA-C-O 120.873 0.368 . . . . 0.0 110.894 179.986 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 312' ' ' ASN . . . . . . . . . . . . . 44.2 t30 -69.89 -56.82 6.05 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.066 179.855 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 313' ' ' LYS . . . . . 0.435 ' HD3' ' N ' ' B' ' 314' ' ' ILE . 0.0 OUTLIER -66.28 -23.55 66.41 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-O 120.775 0.322 . . . . 0.0 111.152 -179.907 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 314' ' ' ILE . . . . . 0.454 HG12 ' O ' ' B' ' 310' ' ' TYR . 31.2 mm -74.65 -43.55 47.57 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 116.392 -0.367 . . . . 0.0 110.754 179.805 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 315' ' ' LYS . . . . . . . . . . . . . 25.5 ttpp -73.42 -27.64 61.55 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.785 179.84 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 316' ' ' ASN . . . . . . . . . . . . . 30.6 t30 -74.32 -50.48 18.61 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.958 179.885 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 317' ' ' ARG . . . . . . . . . . . . . 27.3 mmm180 -61.64 -53.64 53.49 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.142 179.979 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 318' ' ' PHE . . . . . . . . . . . . . 75.6 m-85 -90.77 31.62 1.05 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.082 -179.847 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 319' ' ' GLN . . . . . . . . . . . . . 35.3 tt0 -61.91 -25.64 67.69 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.851 179.936 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 320' ' ' GLY . . . . . . . . . . . . . . . -94.48 -18.38 35.93 Favored Glycine 0 N--CA 1.451 -0.361 0 C-N-CA 120.858 -0.687 . . . . 0.0 112.455 179.971 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 321' ' ' GLN . . . . . . . . . . . . . 8.7 tp-100 -109.83 91.47 10.8 Favored Pre-proline 0 C--N 1.33 -0.273 0 CA-C-O 120.437 0.16 . . . . 0.0 110.731 179.947 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 322' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_endo -76.26 -12.73 19.07 Favored 'Trans proline' 0 C--N 1.348 0.515 0 C-N-CA 122.552 2.168 . . . . 0.0 112.548 -179.891 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 323' ' ' ASP . . . . . . . . . . . . . 20.2 t70 -70.82 -56.32 6.58 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.19 -179.854 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 324' ' ' ILE . . . . . . . . . . . . . 62.1 mt -62.44 -40.63 88.79 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.222 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.096 -179.868 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 325' ' ' TYR . . . . . 0.422 ' CE2' HD11 ' B' ' 329' ' ' LEU . 35.0 t80 -63.22 -48.64 77.42 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.589 179.767 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 326' ' ' LYS . . . . . . . . . . . . . 41.0 ttmt -60.55 -37.3 80.79 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.706 179.887 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 327' ' ' ALA . . . . . . . . . . . . . . . -62.1 -54.48 40.69 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.133 179.941 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 328' ' ' PHE . . . . . . . . . . . . . 62.7 t80 -53.62 -45.55 70.14 Favored 'General case' 0 C--O 1.234 0.275 0 CA-C-O 121.008 0.432 . . . . 0.0 110.501 179.899 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 329' ' ' LEU . . . . . 0.646 HD13 ' HG3' ' A' ' 362' ' ' MET . 92.1 mt -59.21 -43.34 92.3 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.868 -0.606 . . . . 0.0 110.645 179.56 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 330' ' ' GLU . . . . . . . . . . . . . 40.6 mt-10 -59.64 -37.79 79.65 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.763 179.713 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 331' ' ' ILE . . . . . . . . . . . . . 76.1 mt -63.47 -56.6 16.08 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.806 179.728 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 332' ' ' LEU . . . . . 0.41 HD23 HD22 ' A' ' 370' ' ' LEU . 7.3 mp -66.28 -19.19 65.75 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.257 -179.984 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 333' ' ' HIS . . . . . . . . . . . . . 34.6 t-80 -71.61 -59.52 2.71 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 121.031 0.443 . . . . 0.0 110.09 179.284 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 334' ' ' THR . . . . . . . . . . . . . 88.7 m -62.41 -29.77 70.74 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.049 179.21 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 335' ' ' TYR . . . . . . . . . . . . . 69.8 t80 -69.14 -41.55 77.18 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 115.729 -0.669 . . . . 0.0 110.488 179.461 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 336' ' ' GLN . . . . . 0.433 ' HB2' ' HB ' ' A' ' 369' ' ' VAL . 26.3 tt0 -68.23 -33.38 74.3 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.693 -179.993 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 337' ' ' LYS . . . . . 0.558 ' O ' ' HG2' ' B' ' 340' ' ' ARG . 1.0 OUTLIER -72.96 -47.95 40.99 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.885 -179.976 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 338' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -65.78 -28.27 68.89 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.034 0.445 . . . . 0.0 109.873 179.434 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 339' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -73.83 -49.39 25.4 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 115.716 -0.675 . . . . 0.0 110.497 179.407 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 340' ' ' ARG . . . . . 0.572 ' HG3' ' N ' ' B' ' 341' ' ' ASN . 14.9 ptm180 -56.46 -51.83 66.97 Favored 'General case' 0 C--N 1.333 -0.138 0 CA-C-O 121.078 0.466 . . . . 0.0 110.742 -179.838 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 341' ' ' ASN . . . . . 0.572 ' N ' ' HG3' ' B' ' 340' ' ' ARG . 2.3 t-20 -58.72 -47.66 83.82 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.62 -0.718 . . . . 0.0 110.732 179.387 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 342' ' ' ALA . . . . . . . . . . . . . . . -63.79 -23.08 67.22 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.022 179.788 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 343' ' ' LYS . . . . . . . . . . . . . 88.0 tttt -78.77 -39.06 37.04 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.799 179.924 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 344' ' ' GLU . . . . . . . . . . . . . 7.0 mm-40 -75.64 -26.97 58.19 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.831 179.829 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 345' ' ' ALA . . . . . . . . . . . . . . . -64.93 -40.17 94.63 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.042 -0.526 . . . . 0.0 111.029 -179.905 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 346' ' ' GLY . . . . . . . . . . . . . . . 87.53 -36.39 3.35 Favored Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.692 -0.766 . . . . 0.0 112.361 -179.86 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 347' ' ' GLY . . . . . . . . . . . . . . . 176.71 179.17 47.0 Favored Glycine 0 N--CA 1.451 -0.35 0 C-N-CA 120.721 -0.752 . . . . 0.0 112.572 179.959 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 348' ' ' ASN . . . . . . . . . . . . . 14.5 t-20 58.89 20.03 7.66 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.898 0.38 . . . . 0.0 110.952 179.842 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 349' ' ' TYR . . . . . . . . . . . . . 57.7 t80 -120.19 136.82 54.5 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.853 -179.867 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 350' ' ' THR . . . . . . . . . . . . . 27.5 m -105.7 106.26 55.83 Favored Pre-proline 0 C--N 1.33 -0.28 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.819 179.998 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 351' ' ' PRO . . . . . . . . . . . . . 34.9 Cg_exo -58.09 177.36 0.27 Allowed 'Trans proline' 0 C--N 1.348 0.542 0 C-N-CA 122.485 2.124 . . . . 0.0 112.638 -179.813 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 352' ' ' ALA . . . . . . . . . . . . . . . -98.27 -73.57 0.61 Allowed 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.453 -179.751 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 353' ' ' LEU . . . . . 0.514 HD22 ' HG2' ' B' ' 357' ' ' GLU . 40.6 mt -99.25 133.32 43.71 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.934 0.397 . . . . 0.0 111.15 -179.778 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 354' ' ' THR . . . . . . . . . . . . . 57.6 p -104.08 -178.31 3.62 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.791 179.842 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 355' ' ' GLU . . . . . . . . . . . . . 41.4 mt-10 -60.65 -39.53 88.67 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.833 0.349 . . . . 0.0 110.786 179.914 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 356' ' ' GLN . . . . . . . . . . . . . 29.1 mm-40 -70.57 -38.82 74.14 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.0 -179.961 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 357' ' ' GLU . . . . . 0.514 ' HG2' HD22 ' B' ' 353' ' ' LEU . 9.6 tp10 -61.55 -49.37 76.94 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.41 -0.359 . . . . 0.0 110.55 179.999 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 358' ' ' VAL . . . . . 0.49 ' O ' HG23 ' B' ' 362' ' ' VAL . 53.3 t -61.42 -56.67 16.29 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.94 179.688 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 359' ' ' TYR . . . . . . . . . . . . . 2.8 t80 -53.96 -30.36 46.47 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.445 -0.343 . . . . 0.0 110.788 -179.802 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 360' ' ' ALA . . . . . . . . . . . . . . . -66.92 -60.42 2.66 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.165 179.821 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 361' ' ' GLN . . . . . . . . . . . . . 47.0 mt-30 -57.46 -39.01 75.41 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.477 179.865 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 362' ' ' VAL . . . . . 0.49 HG23 ' O ' ' B' ' 358' ' ' VAL . 94.2 t -66.53 -33.72 65.34 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.198 179.298 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 363' ' ' ALA . . . . . 0.554 ' HA ' HD21 ' B' ' 373' ' ' LEU . . . -63.85 -43.1 97.16 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.174 179.264 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 364' ' ' ARG . . . . . . . . . . . . . 9.6 mpt_? -80.06 -17.45 52.66 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.811 -0.631 . . . . 0.0 110.161 178.896 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 365' ' ' LEU . . . . . . . . . . . . . 14.1 tp -68.78 -40.76 79.51 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.787 -0.642 . . . . 0.0 111.226 -179.917 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 366' ' ' PHE . . . . . 0.682 ' HB3' ' HB2' ' B' ' 369' ' ' GLN . 32.8 m-85 -106.4 -29.84 9.49 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.438 -0.346 . . . . 0.0 111.393 -179.522 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 367' ' ' LYS . . . . . . . . . . . . . 92.0 mttt 54.01 -96.62 0.06 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.209 -0.451 . . . . 0.0 112.19 179.892 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 368' ' ' ASN . . . . . . . . . . . . . 18.5 m120 -54.75 -46.4 74.32 Favored 'General case' 0 N--CA 1.462 0.139 0 CA-C-N 116.541 -0.299 . . . . 0.0 111.561 -179.192 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 369' ' ' GLN . . . . . 0.682 ' HB2' ' HB3' ' B' ' 366' ' ' PHE . 2.4 mp0 -66.4 97.92 0.45 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.429 -0.35 . . . . 0.0 111.035 -179.778 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 370' ' ' GLU . . . . . . . . . . . . . 43.9 tt0 -93.69 -17.8 22.82 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.97 179.907 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 371' ' ' ASP . . . . . . . . . . . . . 6.9 m-20 -54.78 -45.35 74.27 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.31 -0.404 . . . . 0.0 110.676 179.81 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 372' ' ' LEU . . . . . 0.561 HD13 ' HB3' ' B' ' 369' ' ' GLN . 6.4 mp -64.85 -41.83 95.39 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.505 179.51 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 373' ' ' LEU . . . . . 0.554 HD21 ' HA ' ' B' ' 363' ' ' ALA . 1.1 mp -61.13 -32.2 71.9 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.808 179.842 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 374' ' ' SER . . . . . . . . . . . . . 56.0 m -71.61 -52.13 19.67 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.036 179.28 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 375' ' ' GLU . . . . . . . . . . . . . 7.7 tp10 -58.05 -33.05 68.59 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 115.732 -0.667 . . . . 0.0 109.898 179.279 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 376' ' ' PHE . . . . . . . . . . . . . 54.0 t80 -79.4 -27.81 41.81 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.736 -0.665 . . . . 0.0 109.906 179.263 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 377' ' ' GLY . . . . . . . . . . . . . . . -64.29 -41.2 98.32 Favored Glycine 0 N--CA 1.448 -0.546 0 C-N-CA 120.673 -0.775 . . . . 0.0 111.317 179.076 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 378' ' ' GLN . . . . . . . . . . . . . 46.1 mt-30 -71.63 -23.44 61.69 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.915 0.388 . . . . 0.0 110.144 179.095 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 379' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -62.33 -31.8 72.48 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-N 115.813 -0.631 . . . . 0.0 110.576 179.407 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 380' ' ' LEU . . . . . . . . . . . . . 39.8 mt -61.92 147.57 89.58 Favored Pre-proline 0 C--N 1.33 -0.28 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.714 -179.964 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 381' ' ' PRO . . . . . 0.568 ' HA ' ' HG2' ' A' ' 377' ' ' ARG . 52.1 Cg_exo -52.83 135.5 57.6 Favored 'Trans proline' 0 C--N 1.347 0.456 0 C-N-CA 122.391 2.061 . . . . 0.0 112.333 179.946 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 382' ' ' ASP . . . . . 0.487 ' H ' ' HG2' ' A' ' 377' ' ' ARG . 7.8 m-20 -93.35 130.01 39.26 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.308 -0.405 . . . . 0.0 110.958 179.972 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 383' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.045 0 CA-C-O 118.231 -0.89 . . . . 0.0 111.116 -179.861 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 358' ' ' ASP . . . . . . . . . . . . . 18.4 t70 . . . . . 0 N--CA 1.486 1.335 0 CA-C-O 120.761 0.315 . . . . 0.0 110.814 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 359' ' ' PHE . . . . . . . . . . . . . 72.3 t80 -140.08 148.3 41.53 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.803 -179.981 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 360' ' ' THR . . . . . 0.637 ' HB ' ' HD3' ' A' ' 361' ' ' PRO . 66.5 m -155.83 -52.58 0.02 OUTLIER Pre-proline 0 CA--C 1.533 0.31 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.667 179.802 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 361' ' ' PRO . . . . . 0.637 ' HD3' ' HB ' ' A' ' 360' ' ' THR . 73.0 Cg_endo -87.09 129.6 2.87 Favored 'Trans proline' 0 C--N 1.352 0.753 0 C-N-CA 122.204 1.936 . . . . 0.0 112.821 -179.783 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 362' ' ' MET . . . . . 0.469 ' SD ' HD23 ' B' ' 329' ' ' LEU . 4.0 tpt -58.32 -68.61 0.24 Allowed 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.553 179.436 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 363' ' ' ASP . . . . . . . . . . . . . 21.7 t70 -175.82 31.93 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.866 -0.606 . . . . 0.0 110.081 179.907 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 364' ' ' SER . . . . . . . . . . . . . 31.5 t 62.38 38.22 13.13 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.577 -179.697 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 365' ' ' SER . . . . . . . . . . . . . 49.0 m -140.28 -63.21 0.49 Allowed 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.226 -179.818 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 366' ' ' ALA . . . . . . . . . . . . . . . -57.53 -43.82 84.63 Favored 'General case' 0 C--O 1.233 0.223 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.618 -179.628 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 367' ' ' VAL . . . . . . . . . . . . . 35.7 m -54.88 -35.14 32.84 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.925 179.904 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 368' ' ' TYR . . . . . . . . . . . . . 68.7 m-85 -71.04 -24.24 62.31 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.487 179.531 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 369' ' ' VAL . . . . . 0.592 HG22 ' HB2' ' B' ' 336' ' ' GLN . 6.7 t -73.03 -57.73 6.37 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.195 179.383 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 370' ' ' LEU . . . . . 0.478 ' H ' HD22 ' A' ' 370' ' ' LEU . 3.2 mm? -58.56 -37.91 76.74 Favored 'General case' 0 C--O 1.233 0.201 0 CA-C-N 115.763 -0.653 . . . . 0.0 110.443 179.793 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 371' ' ' SER . . . . . 0.641 ' HA ' ' HB2' ' B' ' 303' ' ' GLU . 99.0 p -63.53 -55.87 20.5 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.901 179.928 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 372' ' ' SER . . . . . . . . . . . . . 91.4 p -54.48 -34.37 61.44 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.3 -179.806 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 373' ' ' MET . . . . . . . . . . . . . 56.6 mtt -66.69 -52.26 46.78 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.522 -179.971 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 374' ' ' ALA . . . . . 0.43 ' HB3' ' HB3' ' B' ' 303' ' ' GLU . . . -81.6 -6.74 59.29 Favored 'General case' 0 C--N 1.331 -0.236 0 N-CA-C 112.387 0.514 . . . . 0.0 112.387 -178.973 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 375' ' ' ARG . . . . . . . . . . . . . 18.7 mmt180 -94.82 -42.58 8.63 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.81 0.338 . . . . 0.0 111.164 179.88 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 376' ' ' GLN . . . . . . . . . . . . . 44.2 tt0 -83.32 35.35 0.49 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.046 -0.524 . . . . 0.0 111.077 -179.579 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 377' ' ' ARG . . . . . 0.516 ' HG2' ' HA ' ' B' ' 381' ' ' PRO . 73.0 mtp180 -78.78 4.23 14.47 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.344 -0.389 . . . . 0.0 111.094 179.931 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 378' ' ' ARG . . . . . . . . . . . . . 21.3 tpp180 -99.04 -25.61 14.5 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.308 -0.405 . . . . 0.0 110.906 -179.957 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 379' ' ' ALA . . . . . . . . . . . . . . . -65.98 144.97 56.42 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.145 -179.962 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 380' ' ' SER . . . . . . . . . . . . . 46.6 t . . . . . 0 C--O 1.25 1.108 0 CA-C-O 118.285 -0.864 . . . . 0.0 111.052 -179.902 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' B' B ' 295' ' ' SER . . . . . . . . . . . . . 39.1 t . . . . . 0 N--CA 1.487 1.383 0 CA-C-O 120.853 0.358 . . . . 0.0 110.961 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' B' B ' 296' ' ' LEU . . . . . 0.572 ' N ' HD13 ' B' ' 296' ' ' LEU . 0.0 OUTLIER -134.03 9.5 3.83 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.132 -0.486 . . . . 0.0 111.122 -179.878 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' B' B ' 297' ' ' GLN . . . . . 0.447 ' HG2' ' H ' ' B' ' 299' ' ' ASN . 33.2 tt0 -82.56 156.79 23.78 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.869 179.922 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 298' ' ' ASN . . . . . . . . . . . . . 18.8 m120 -138.91 -0.17 1.91 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.212 -179.988 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 299' ' ' ASN . . . . . 0.447 ' H ' ' HG2' ' B' ' 297' ' ' GLN . 42.5 m-80 -66.59 -49.03 67.67 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.458 -0.337 . . . . 0.0 110.742 179.918 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 300' ' ' GLN . . . . . . . . . . . . . 48.1 mt-30 -77.76 159.71 75.95 Favored Pre-proline 0 C--N 1.33 -0.265 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.656 179.583 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 301' ' ' PRO . . . . . 0.48 ' HB2' ' HB3' ' B' ' 304' ' ' PHE . 89.0 Cg_exo -46.99 156.31 0.72 Allowed 'Trans proline' 0 C--N 1.351 0.696 0 C-N-CA 122.601 2.201 . . . . 0.0 112.373 179.908 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 302' ' ' VAL . . . . . 0.571 HG13 ' H ' ' B' ' 303' ' ' GLU . 2.7 p -90.76 -58.12 3.78 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-N 116.439 -0.346 . . . . 0.0 111.761 -179.409 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 303' ' ' GLU . . . . . 0.641 ' HB2' ' HA ' ' A' ' 371' ' ' SER . 0.1 OUTLIER -62.13 -29.71 70.52 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.404 -0.362 . . . . 0.0 111.769 -179.058 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' B' B ' 304' ' ' PHE . . . . . 0.48 ' HB3' ' HB2' ' B' ' 301' ' ' PRO . 67.3 t80 -63.0 -71.33 0.17 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.77 0.319 . . . . 0.0 111.188 -179.648 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 305' ' ' ASN . . . . . . . . . . . . . 27.2 t-20 -53.68 -42.86 68.39 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.582 -179.413 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 306' ' ' HIS . . . . . . . . . . . . . 8.5 m-70 -62.53 -67.7 0.4 Allowed 'General case' 0 C--N 1.331 -0.22 0 N-CA-C 112.083 0.401 . . . . 0.0 112.083 -179.225 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 307' ' ' ALA . . . . . . . . . . . . . . . -49.89 -52.74 30.59 Favored 'General case' 0 N--CA 1.465 0.289 0 N-CA-C 112.331 0.493 . . . . 0.0 112.331 -178.905 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 308' ' ' ILE . . . . . 0.443 HD13 ' O ' ' B' ' 304' ' ' PHE . 1.7 mp -54.93 -58.96 2.79 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-O 120.595 0.236 . . . . 0.0 111.439 -179.617 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 309' ' ' ASN . . . . . . . . . . . . . 14.1 m120 -61.52 -19.4 62.07 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.546 -0.297 . . . . 0.0 111.265 -179.646 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 310' ' ' TYR . . . . . . . . . . . . . 24.0 t80 -74.95 -57.28 4.0 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.416 -0.356 . . . . 0.0 111.326 -179.479 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 311' ' ' VAL . . . . . . . . . . . . . 5.8 m -63.19 -33.69 62.42 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.203 0 CA-C-O 120.87 0.367 . . . . 0.0 110.639 -179.818 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 312' ' ' ASN . . . . . . . . . . . . . 6.3 t30 -70.11 -42.88 72.09 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.585 179.751 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 313' ' ' LYS . . . . . . . . . . . . . 4.5 ttmm -60.23 -49.57 77.11 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.035 179.807 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 314' ' ' ILE . . . . . . . . . . . . . 75.8 mt -64.6 -39.59 86.12 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.658 -179.43 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 315' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -65.51 -40.2 92.72 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.744 0.307 . . . . 0.0 111.095 -179.714 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 316' ' ' ASN . . . . . . . . . . . . . 28.2 t-20 -68.77 -51.35 42.06 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.321 -0.399 . . . . 0.0 111.355 -179.479 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 317' ' ' ARG . . . . . 0.569 HH22 HD11 ' B' ' 372' ' ' LEU . 35.7 mtm180 -59.99 -59.08 6.0 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.384 -0.371 . . . . 0.0 111.071 -179.91 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 318' ' ' PHE . . . . . . . . . . . . . 95.1 m-85 -87.65 40.87 0.96 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.917 -179.97 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 319' ' ' GLN . . . . . . . . . . . . . 63.3 tt0 -59.5 -33.64 71.6 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.972 -179.875 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 320' ' ' GLY . . . . . . . . . . . . . . . -80.27 -14.32 80.53 Favored Glycine 0 N--CA 1.452 -0.256 0 C-N-CA 120.853 -0.689 . . . . 0.0 112.261 179.735 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 321' ' ' GLN . . . . . . . . . . . . . 6.1 tp-100 -118.07 83.29 19.18 Favored Pre-proline 0 C--N 1.329 -0.315 0 CA-C-O 120.528 0.204 . . . . 0.0 110.802 -179.998 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 322' ' ' PRO . . . . . . . . . . . . . 76.5 Cg_endo -77.71 -10.17 17.06 Favored 'Trans proline' 0 C--N 1.346 0.404 0 C-N-CA 122.386 2.058 . . . . 0.0 112.338 179.844 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 323' ' ' ASP . . . . . . . . . . . . . 9.5 m-20 -70.08 -52.78 21.07 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.07 -0.514 . . . . 0.0 111.191 -179.742 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 324' ' ' ILE . . . . . . . . . . . . . 71.3 mt -63.89 -46.34 94.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.425 -0.352 . . . . 0.0 111.246 -179.904 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 325' ' ' TYR . . . . . . . . . . . . . 68.8 t80 -58.15 -58.27 9.21 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.155 179.982 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 326' ' ' LYS . . . . . . . . . . . . . 39.4 ttmt -56.95 -41.47 78.35 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.121 -179.728 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 327' ' ' ALA . . . . . . . . . . . . . . . -57.02 -48.29 78.85 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.907 0.384 . . . . 0.0 111.148 -179.997 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 328' ' ' PHE . . . . . . . . . . . . . 45.7 t80 -58.56 -53.87 53.43 Favored 'General case' 0 C--O 1.237 0.435 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.664 179.931 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 329' ' ' LEU . . . . . 0.469 HD23 ' SD ' ' A' ' 362' ' ' MET . 10.4 mp -60.82 -26.71 67.51 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.979 -179.844 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 330' ' ' GLU . . . . . . . . . . . . . 28.4 mt-10 -70.38 -42.32 71.89 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.852 0.358 . . . . 0.0 110.207 179.306 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 331' ' ' ILE . . . . . 0.509 HG22 HG22 ' B' ' 358' ' ' VAL . 93.8 mt -61.03 -48.03 90.92 Favored 'Isoleucine or valine' 0 C--O 1.233 0.224 0 CA-C-N 116.126 -0.488 . . . . 0.0 109.956 179.085 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 332' ' ' LEU . . . . . . . . . . . . . 10.8 mp -64.81 -33.66 76.52 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 115.813 -0.631 . . . . 0.0 110.512 179.427 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 333' ' ' HIS . . . . . . . . . . . . . 43.3 t60 -60.83 -54.15 48.67 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.057 -0.52 . . . . 0.0 109.956 179.297 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 334' ' ' THR . . . . . . . . . . . . . 62.8 m -61.35 -30.48 70.54 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.687 -0.688 . . . . 0.0 110.338 179.238 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 335' ' ' TYR . . . . . . . . . . . . . 67.8 t80 -60.62 -53.79 53.19 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.844 -0.617 . . . . 0.0 111.158 179.696 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 336' ' ' GLN . . . . . 0.592 ' HB2' HG22 ' A' ' 369' ' ' VAL . 6.4 tp-100 -65.89 -36.64 83.97 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.417 -0.356 . . . . 0.0 111.029 -179.928 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 337' ' ' LYS . . . . . . . . . . . . . 39.8 ttpt -57.89 -56.65 19.27 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.951 0.405 . . . . 0.0 110.995 179.9 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 338' ' ' GLU . . . . . 0.462 ' HG3' ' HB3' ' B' ' 352' ' ' ALA . 19.5 mm-40 -64.11 -36.25 83.42 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.037 -0.528 . . . . 0.0 111.289 -179.857 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 339' ' ' GLN . . . . . . . . . . . . . 6.5 tp-100 -61.0 -46.07 92.25 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.312 -0.403 . . . . 0.0 110.847 179.968 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 340' ' ' ARG . . . . . . . . . . . . . 96.6 mtt180 -63.87 -51.71 63.32 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.652 179.836 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 341' ' ' ASN . . . . . . . . . . . . . 74.9 m-20 -56.59 -33.44 66.21 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.8 179.706 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 342' ' ' ALA . . . . . . . . . . . . . . . -72.75 -37.05 67.82 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.011 179.885 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 343' ' ' LYS . . . . . . . . . . . . . 64.6 tttp -71.85 -28.07 63.31 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.978 -0.555 . . . . 0.0 110.497 179.803 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 344' ' ' GLU . . . . . . . . . . . . . 17.3 mm-40 -77.9 -41.32 36.95 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.912 -0.585 . . . . 0.0 110.788 179.681 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 345' ' ' ALA . . . . . . . . . . . . . . . -60.63 -32.94 72.08 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.272 179.898 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 346' ' ' GLY . . . . . . . . . . . . . . . 69.1 33.39 74.04 Favored Glycine 0 N--CA 1.451 -0.362 0 C-N-CA 120.712 -0.756 . . . . 0.0 112.387 -179.832 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 347' ' ' GLY . . . . . . . . . . . . . . . 113.07 176.88 19.58 Favored Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.825 -0.702 . . . . 0.0 112.441 -179.993 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 348' ' ' ASN . . . . . . . . . . . . . 63.9 t30 58.47 15.7 3.71 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.908 0.385 . . . . 0.0 111.045 179.965 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 349' ' ' TYR . . . . . . . . . . . . . 73.9 t80 -117.76 144.53 45.22 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.886 -179.954 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 350' ' ' THR . . . . . . . . . . . . . 38.0 m -120.64 97.66 48.48 Favored Pre-proline 0 C--N 1.329 -0.297 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.038 -179.865 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 351' ' ' PRO . . . . . . . . . . . . . 45.9 Cg_exo -56.5 159.26 13.81 Favored 'Trans proline' 0 C--N 1.348 0.529 0 C-N-CA 122.503 2.136 . . . . 0.0 112.325 179.869 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 352' ' ' ALA . . . . . 0.462 ' HB3' ' HG3' ' B' ' 338' ' ' GLU . . . -70.11 -76.95 0.09 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.133 179.993 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 353' ' ' LEU . . . . . 0.608 ' HB3' ' HG2' ' B' ' 357' ' ' GLU . 0.3 OUTLIER -107.32 154.85 20.66 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 121.095 0.474 . . . . 0.0 111.726 179.965 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' B' B ' 354' ' ' THR . . . . . . . . . . . . . 59.6 p -114.85 -172.91 2.21 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.871 -0.604 . . . . 0.0 110.767 179.586 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 355' ' ' GLU . . . . . . . . . . . . . 7.8 pt-20 -58.92 -42.73 90.4 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 121.309 0.576 . . . . 0.0 110.072 179.577 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 356' ' ' GLN . . . . . . . . . . . . . 28.9 tt0 -64.56 -38.37 90.77 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.394 -0.821 . . . . 0.0 110.97 179.656 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 357' ' ' GLU . . . . . 0.608 ' HG2' ' HB3' ' B' ' 353' ' ' LEU . 4.6 tp10 -61.21 -50.03 74.75 Favored 'General case' 0 C--N 1.333 -0.138 0 CA-C-O 120.807 0.337 . . . . 0.0 110.506 179.948 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 358' ' ' VAL . . . . . 0.59 ' O ' HG23 ' B' ' 362' ' ' VAL . 93.5 t -59.09 -60.55 2.25 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.069 -0.514 . . . . 0.0 111.014 179.991 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 359' ' ' TYR . . . . . . . . . . . . . 2.2 t80 -52.0 -33.44 38.21 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.521 -0.309 . . . . 0.0 111.014 -179.325 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 360' ' ' ALA . . . . . . . . . . . . . . . -65.58 -60.59 2.76 Favored 'General case' 0 C--O 1.234 0.246 0 CA-C-N 116.502 -0.317 . . . . 0.0 111.242 179.896 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 361' ' ' GLN . . . . . 0.43 HE21 HD13 ' B' ' 331' ' ' ILE . 25.1 mt-30 -58.15 -36.23 72.7 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.98 0.419 . . . . 0.0 110.414 179.923 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 362' ' ' VAL . . . . . 0.59 HG23 ' O ' ' B' ' 358' ' ' VAL . 66.1 t -70.64 -32.05 48.17 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 115.902 -0.59 . . . . 0.0 109.988 179.246 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 363' ' ' ALA . . . . . 0.576 ' HA ' HD21 ' B' ' 373' ' ' LEU . . . -65.16 -38.87 91.96 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 115.914 -0.585 . . . . 0.0 109.876 179.124 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 364' ' ' ARG . . . . . . . . . . . . . 31.8 ttm180 -80.85 -23.41 39.12 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.574 -0.739 . . . . 0.0 110.109 179.011 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 365' ' ' LEU . . . . . . . . . . . . . 8.3 tp -58.12 -24.84 60.22 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.826 -0.625 . . . . 0.0 110.185 179.523 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 366' ' ' PHE . . . . . 0.474 ' HB3' ' HB2' ' B' ' 369' ' ' GLN . 38.1 m-85 -129.07 179.85 5.52 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.742 -0.663 . . . . 0.0 110.423 179.708 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 367' ' ' LYS . . . . . . . . . . . . . 98.4 mttt -138.49 -80.61 0.33 Allowed 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.584 -0.28 . . . . 0.0 111.246 179.904 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 368' ' ' ASN . . . . . . . . . . . . . 28.0 p30 -79.96 7.67 8.5 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.275 -0.421 . . . . 0.0 110.887 -179.886 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 369' ' ' GLN . . . . . 0.709 ' HB3' HD13 ' B' ' 372' ' ' LEU . 44.5 mt-30 -103.38 91.67 4.16 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.022 -0.536 . . . . 0.0 111.436 -179.788 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 370' ' ' GLU . . . . . . . . . . . . . 42.5 mt-10 -94.54 -20.24 19.81 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.875 179.504 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 371' ' ' ASP . . . . . . . . . . . . . 23.5 t70 -59.09 -45.3 91.2 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.69 179.748 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 372' ' ' LEU . . . . . 0.709 HD13 ' HB3' ' B' ' 369' ' ' GLN . 6.6 mp -62.5 -51.82 65.91 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.731 179.593 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 373' ' ' LEU . . . . . 0.576 HD21 ' HA ' ' B' ' 363' ' ' ALA . 1.1 mp -55.88 -37.47 68.87 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.797 -0.638 . . . . 0.0 111.282 -179.749 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 374' ' ' SER . . . . . . . . . . . . . 70.1 m -69.25 -53.39 20.07 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.676 179.754 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 375' ' ' GLU . . . . . . . . . . . . . 39.4 mm-40 -52.56 -36.76 56.5 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.259 179.485 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 376' ' ' PHE . . . . . . . . . . . . . 91.8 t80 -70.24 -41.09 73.99 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.28 179.429 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 377' ' ' GLY . . . . . . . . . . . . . . . -60.2 -32.59 76.93 Favored Glycine 0 N--CA 1.45 -0.379 0 C-N-CA 120.768 -0.729 . . . . 0.0 112.086 179.536 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 378' ' ' GLN . . . . . . . . . . . . . 23.4 mt-30 -60.31 -29.73 69.04 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.798 0.332 . . . . 0.0 110.614 179.656 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 379' ' ' PHE . . . . . . . . . . . . . 75.1 m-85 -69.9 -34.53 73.64 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.789 179.733 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 380' ' ' LEU . . . . . 0.427 ' HA ' ' HD2' ' B' ' 381' ' ' PRO . 90.8 mt -51.51 113.37 3.93 Favored Pre-proline 0 C--N 1.332 -0.164 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.612 179.861 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 381' ' ' PRO . . . . . 0.516 ' HA ' ' HG2' ' A' ' 377' ' ' ARG . 16.0 Cg_endo -57.35 115.58 2.61 Favored 'Trans proline' 0 C--N 1.349 0.568 0 C-N-CA 122.312 2.008 . . . . 0.0 112.338 -179.726 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 382' ' ' ASP . . . . . . . . . . . . . 4.7 p-10 -136.91 136.7 38.86 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.878 179.85 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 383' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.05 0 CA-C-O 118.21 -0.9 . . . . 0.0 111.211 179.903 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 358' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 . . . . . 0 N--CA 1.486 1.335 0 CA-C-O 120.869 0.366 . . . . 0.0 110.878 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 359' ' ' PHE . . . . . . . . . . . . . 87.9 t80 -124.22 101.63 7.29 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.765 179.898 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 360' ' ' THR . . . . . 0.596 ' HB ' ' HD3' ' A' ' 361' ' ' PRO . 68.6 m -157.93 -49.69 0.01 OUTLIER Pre-proline 0 CA--C 1.534 0.35 0 CA-C-N 116.065 -0.516 . . . . 0.0 111.666 -179.86 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 361' ' ' PRO . . . . . 0.596 ' HD3' ' HB ' ' A' ' 360' ' ' THR . 31.5 Cg_exo -59.32 -50.06 9.35 Favored 'Trans proline' 0 C--N 1.353 0.794 0 C-N-CA 122.105 1.87 . . . . 0.0 112.286 179.837 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 362' ' ' MET . . . . . 0.703 ' HG2' HD13 ' B' ' 329' ' ' LEU . 0.6 OUTLIER -73.47 1.08 10.58 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.35 -179.705 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 363' ' ' ASP . . . . . . . . . . . . . 22.3 t70 -89.05 -5.91 57.53 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.933 0.397 . . . . 0.0 110.521 179.638 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 364' ' ' SER . . . . . . . . . . . . . 78.4 p -145.56 -5.22 0.65 Allowed 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.912 179.94 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 365' ' ' SER . . . . . . . . . . . . . 46.5 t -92.87 -67.7 0.84 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.785 179.958 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 366' ' ' ALA . . . . . . . . . . . . . . . -63.77 -23.26 67.29 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.911 179.866 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 367' ' ' VAL . . . . . . . . . . . . . 18.9 t -67.6 -21.27 27.28 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.788 179.891 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 368' ' ' TYR . . . . . . . . . . . . . 57.9 t80 -73.25 -48.99 30.26 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.977 -179.898 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 369' ' ' VAL . . . . . . . . . . . . . 14.6 m -70.11 -36.48 68.34 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.448 -179.782 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 370' ' ' LEU . . . . . 0.563 HD23 ' HA ' ' B' ' 307' ' ' ALA . 6.5 mp -69.35 -47.43 64.35 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.427 -0.352 . . . . 0.0 111.052 179.721 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 371' ' ' SER . . . . . 0.478 ' HB3' ' HB3' ' B' ' 303' ' ' GLU . 72.1 m -64.27 -38.84 92.48 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.294 -179.962 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 372' ' ' SER . . . . . . . . . . . . . 67.9 m -71.22 -61.33 1.81 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.475 -179.662 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 373' ' ' MET . . . . . 0.456 ' HB3' ' HD3' ' B' ' 381' ' ' PRO . 73.9 mtm -50.38 -41.06 51.3 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.626 -179.459 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 374' ' ' ALA . . . . . . . . . . . . . . . -73.01 -41.8 63.89 Favored 'General case' 0 C--N 1.331 -0.223 0 N-CA-C 112.008 0.373 . . . . 0.0 112.008 -179.426 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 375' ' ' ARG . . . . . 0.417 ' HB2' ' HG2' ' B' ' 303' ' ' GLU . 30.3 tpt180 -70.29 -23.08 62.8 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.692 0.282 . . . . 0.0 111.395 -179.55 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 376' ' ' GLN . . . . . . . . . . . . . 85.4 mm-40 -89.45 13.14 14.48 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.424 -0.353 . . . . 0.0 111.119 -179.768 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 377' ' ' ARG . . . . . . . . . . . . . 73.8 ttt180 -71.02 -65.77 0.7 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.889 -179.971 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 378' ' ' ARG . . . . . . . . . . . . . 40.5 ttm180 -154.06 -78.47 0.1 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.251 -0.432 . . . . 0.0 111.099 -179.738 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 379' ' ' ALA . . . . . . . . . . . . . . . -149.76 -26.88 0.26 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.101 -179.869 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 380' ' ' SER . . . . . . . . . . . . . 49.0 m . . . . . 0 C--O 1.248 1.011 0 CA-C-O 118.31 -0.852 . . . . 0.0 111.08 179.936 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' B' B ' 295' ' ' SER . . . . . . . . . . . . . 47.3 t . . . . . 0 N--CA 1.485 1.306 0 CA-C-O 120.852 0.358 . . . . 0.0 110.964 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' B' B ' 296' ' ' LEU . . . . . . . . . . . . . 85.9 mt -131.54 -21.23 2.54 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.901 -179.985 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 297' ' ' GLN . . . . . . . . . . . . . 81.9 mm-40 -74.09 159.05 33.16 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.898 -179.887 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 298' ' ' ASN . . . . . . . . . . . . . 3.5 p-10 -128.81 175.68 8.43 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.93 179.958 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 299' ' ' ASN . . . . . . . . . . . . . 27.3 t-20 -103.83 123.33 46.9 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.101 -179.907 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 300' ' ' GLN . . . . . . . . . . . . . 29.6 mm-40 -117.55 109.97 41.23 Favored Pre-proline 0 C--N 1.33 -0.27 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.813 179.973 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 301' ' ' PRO . . . . . . . . . . . . . 50.2 Cg_exo -53.44 159.53 6.12 Favored 'Trans proline' 0 C--N 1.351 0.662 0 C-N-CA 122.295 1.997 . . . . 0.0 112.159 179.789 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 302' ' ' VAL . . . . . . . . . . . . . 15.0 p -92.01 -24.27 5.48 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.178 -179.797 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 303' ' ' GLU . . . . . 0.478 ' HB3' ' HB3' ' A' ' 371' ' ' SER . 44.2 mt-10 -57.88 -78.77 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.974 -0.557 . . . . 0.0 111.647 -179.661 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 304' ' ' PHE . . . . . . . . . . . . . 64.7 m-85 -59.06 -31.55 68.97 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.898 -0.592 . . . . 0.0 111.914 -179.217 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 305' ' ' ASN . . . . . . . . . . . . . 26.9 t-20 -62.95 -71.4 0.16 Allowed 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.672 0.272 . . . . 0.0 111.57 -179.417 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 306' ' ' HIS . . . . . . . . . . . . . 4.3 t-160 -53.99 -41.1 67.55 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.36 -0.382 . . . . 0.0 111.509 -179.116 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 307' ' ' ALA . . . . . 0.563 ' HA ' HD23 ' A' ' 370' ' ' LEU . . . -60.72 -54.99 38.53 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.473 -0.33 . . . . 0.0 111.679 -179.564 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 308' ' ' ILE . . . . . . . . . . . . . 21.2 mm -57.09 -52.34 57.46 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.195 0 CA-C-N 116.662 -0.245 . . . . 0.0 111.407 -179.736 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 309' ' ' ASN . . . . . . . . . . . . . 28.5 m-80 -55.52 -34.65 64.85 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.473 -0.331 . . . . 0.0 111.211 -179.74 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 310' ' ' TYR . . . . . . . . . . . . . 80.6 t80 -66.5 -56.54 10.41 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.424 -0.353 . . . . 0.0 111.109 179.971 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 311' ' ' VAL . . . . . . . . . . . . . 61.5 t -56.14 -49.07 77.98 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.213 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.129 -179.832 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 312' ' ' ASN . . . . . . . . . . . . . 28.0 t-20 -61.99 -39.12 91.12 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.77 179.896 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 313' ' ' LYS . . . . . . . . . . . . . 42.9 tttp -55.12 -61.16 2.5 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.687 179.846 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 314' ' ' ILE . . . . . . . . . . . . . 98.2 mt -62.48 -28.07 44.0 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.077 -0.51 . . . . 0.0 111.177 -179.9 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 315' ' ' LYS . . . . . . . . . . . . . 1.6 tmmt? -67.21 -33.84 76.24 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.356 -0.383 . . . . 0.0 110.973 -179.851 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 316' ' ' ASN . . . . . . . . . . . . . 7.1 t30 -87.56 -50.45 6.51 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.454 -179.76 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 317' ' ' ARG . . . . . . . . . . . . . 29.3 mmm180 -57.75 -57.49 12.53 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.088 -179.728 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 318' ' ' PHE . . . . . . . . . . . . . 44.0 m-85 -88.41 39.54 0.91 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.944 -179.913 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 319' ' ' GLN . . . . . . . . . . . . . 9.0 tt0 -65.74 -18.04 65.05 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.594 179.815 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 320' ' ' GLY . . . . . . . . . . . . . . . -91.82 -9.62 62.39 Favored Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.845 -0.693 . . . . 0.0 112.547 -179.979 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 321' ' ' GLN . . . . . 0.587 ' N ' HE21 ' B' ' 321' ' ' GLN . 0.0 OUTLIER -112.42 88.06 10.37 Favored Pre-proline 0 C--N 1.33 -0.25 0 CA-C-O 120.582 0.23 . . . . 0.0 110.877 179.777 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 322' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_endo -77.35 -33.6 2.44 Favored 'Trans proline' 0 C--N 1.347 0.473 0 C-N-CA 122.537 2.158 . . . . 0.0 112.414 -179.976 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 323' ' ' ASP . . . . . . . . . . . . . 5.2 m-20 -65.46 -56.26 13.43 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.13 -0.487 . . . . 0.0 111.167 -179.761 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 324' ' ' ILE . . . . . . . . . . . . . 53.3 mt -59.28 -53.27 50.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.455 -179.713 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 325' ' ' TYR . . . . . 0.458 ' CE2' HD11 ' B' ' 329' ' ' LEU . 16.8 t80 -54.01 -47.07 71.89 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.886 -179.832 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 326' ' ' LYS . . . . . . . . . . . . . 61.7 tttm -60.09 -40.8 90.86 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.879 -179.953 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 327' ' ' ALA . . . . . . . . . . . . . . . -59.02 -53.02 63.14 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.157 -179.88 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 328' ' ' PHE . . . . . . . . . . . . . 84.0 t80 -54.66 -52.36 62.57 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.785 179.962 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 329' ' ' LEU . . . . . 0.703 HD13 ' HG2' ' A' ' 362' ' ' MET . 77.3 mt -55.09 -39.17 69.03 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.986 -179.891 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 330' ' ' GLU . . . . . . . . . . . . . 16.4 mm-40 -63.81 -39.47 94.31 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.782 179.884 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 331' ' ' ILE . . . . . . . . . . . . . 90.4 mt -61.36 -45.71 98.06 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.17 0 CA-C-N 116.31 -0.405 . . . . 0.0 110.402 179.278 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 332' ' ' LEU . . . . . . . . . . . . . 7.7 mp -64.74 -34.7 78.93 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.867 179.533 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 333' ' ' HIS . . . . . . . . . . . . . 59.7 t-80 -62.09 -49.35 76.27 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.994 0.426 . . . . 0.0 110.111 179.502 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 334' ' ' THR . . . . . . . . . . . . . 53.1 m -63.09 -39.37 94.5 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.306 179.404 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 335' ' ' TYR . . . . . . . . . . . . . 55.7 t80 -62.72 -32.74 73.91 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.822 -0.626 . . . . 0.0 110.097 179.356 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 336' ' ' GLN . . . . . . . . . . . . . 8.8 tt0 -70.43 -45.5 65.74 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.593 -0.731 . . . . 0.0 110.64 179.808 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 337' ' ' LYS . . . . . . . . . . . . . 41.4 ttmt -60.88 -40.5 93.24 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.055 179.976 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 338' ' ' GLU . . . . . . . . . . . . . 20.8 mm-40 -67.29 -49.07 65.7 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.447 -179.753 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 339' ' ' GLN . . . . . . . . . . . . . 15.8 mm100 -61.06 -47.36 86.72 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.527 -0.306 . . . . 0.0 111.211 -179.85 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 340' ' ' ARG . . . . . . . . . . . . . 82.7 mtp180 -58.7 -51.98 67.66 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.209 -179.866 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 341' ' ' ASN . . . . . . . . . . . . . 5.6 t30 -59.76 -37.93 80.41 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.063 -179.751 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 342' ' ' ALA . . . . . . . . . . . . . . . -65.39 -35.74 81.87 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.043 179.938 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 343' ' ' LYS . . . . . . . . . . . . . 60.1 tttm -71.83 -38.59 70.13 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.923 179.976 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 344' ' ' GLU . . . . . . . . . . . . . 46.7 mt-10 -73.08 -28.51 62.34 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.145 -179.885 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 345' ' ' ALA . . . . . . . . . . . . . . . -74.34 -22.04 59.42 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.146 -179.88 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 346' ' ' GLY . . . . . . . . . . . . . . . 60.04 61.29 7.32 Favored Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.822 -0.704 . . . . 0.0 112.537 -179.895 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 347' ' ' GLY . . . . . . . . . . . . . . . 74.0 -175.31 48.07 Favored Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.846 -0.692 . . . . 0.0 112.418 -179.828 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 348' ' ' ASN . . . . . . . . . . . . . 63.6 t30 61.25 11.31 3.5 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-O 120.848 0.356 . . . . 0.0 111.155 179.785 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 349' ' ' TYR . . . . . . . . . . . . . 66.6 t80 -124.92 143.63 50.76 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.33 -0.396 . . . . 0.0 110.88 -179.952 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 350' ' ' THR . . . . . . . . . . . . . 22.9 m -116.01 105.32 51.33 Favored Pre-proline 0 CA--C 1.532 0.253 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.25 -179.816 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 351' ' ' PRO . . . . . . . . . . . . . 31.7 Cg_exo -59.7 -179.93 0.23 Allowed 'Trans proline' 0 C--N 1.349 0.581 0 C-N-CA 122.482 2.122 . . . . 0.0 112.425 179.834 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 352' ' ' ALA . . . . . . . . . . . . . . . -105.33 -71.17 0.75 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.38 -179.83 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 353' ' ' LEU . . . . . 0.424 ' HG ' ' HG2' ' B' ' 357' ' ' GLU . 7.3 mp -85.05 126.65 33.74 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 121.048 0.451 . . . . 0.0 111.332 -179.779 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 354' ' ' THR . . . . . 0.513 ' H ' ' HB2' ' B' ' 357' ' ' GLU . 81.4 p -111.61 -175.76 2.78 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.738 -0.664 . . . . 0.0 110.564 179.43 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 355' ' ' GLU . . . . . . . . . . . . . 8.9 pt-20 -53.06 -44.9 67.83 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.894 0.378 . . . . 0.0 110.933 179.861 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 356' ' ' GLN . . . . . . . . . . . . . 35.9 tt0 -69.53 -34.57 74.44 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.045 -0.525 . . . . 0.0 111.212 -179.701 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 357' ' ' GLU . . . . . 0.513 ' HB2' ' H ' ' B' ' 354' ' ' THR . 4.8 tp10 -60.28 -55.66 30.99 Favored 'General case' 0 C--O 1.233 0.203 0 CA-C-O 120.752 0.311 . . . . 0.0 110.655 -179.849 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 358' ' ' VAL . . . . . 0.555 ' O ' HG23 ' B' ' 362' ' ' VAL . 69.9 t -60.92 -54.51 34.34 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.872 179.825 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 359' ' ' TYR . . . . . . . . . . . . . 1.2 t80 -52.05 -34.36 43.09 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.774 0.321 . . . . 0.0 110.911 -179.661 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 360' ' ' ALA . . . . . . . . . . . . . . . -66.94 -60.43 2.65 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.357 -179.913 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 361' ' ' GLN . . . . . . . . . . . . . 49.1 mt-30 -55.52 -41.51 73.24 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.992 -179.949 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 362' ' ' VAL . . . . . 0.555 HG23 ' O ' ' B' ' 358' ' ' VAL . 50.1 t -67.59 -35.37 72.8 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.545 179.703 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 363' ' ' ALA . . . . . . . . . . . . . . . -62.06 -40.92 97.42 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.464 179.562 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 364' ' ' ARG . . . . . . . . . . . . . 67.3 ttt180 -81.34 -22.61 38.33 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.886 -0.597 . . . . 0.0 110.444 179.544 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 365' ' ' LEU . . . . . . . . . . . . . 6.4 tp -64.08 -23.14 67.21 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.75 179.989 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 366' ' ' PHE . . . . . . . . . . . . . 84.2 m-85 -125.72 165.72 18.09 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.643 179.811 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 367' ' ' LYS . . . . . . . . . . . . . 63.3 mttp -128.38 -77.32 0.56 Allowed 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.352 -0.386 . . . . 0.0 111.016 -179.859 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 368' ' ' ASN . . . . . . . . . . . . . 38.5 m-80 -85.17 7.9 20.21 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.847 179.951 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 369' ' ' GLN . . . . . . . . . . . . . 14.7 mm100 -112.22 56.33 0.66 Allowed 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.065 -179.842 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 370' ' ' GLU . . . . . . . . . . . . . 6.3 tm-20 -69.0 -23.23 64.08 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.511 179.753 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 371' ' ' ASP . . . . . . . . . . . . . 13.1 m-20 -52.66 -32.64 43.26 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.866 179.949 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 372' ' ' LEU . . . . . . . . . . . . . 78.1 mt -73.53 -35.74 65.59 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.68 179.717 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 373' ' ' LEU . . . . . . . . . . . . . 48.8 mt -65.5 -38.59 90.15 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.441 179.75 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 374' ' ' SER . . . . . . . . . . . . . 87.7 p -70.48 -54.45 12.21 Favored 'General case' 0 C--O 1.234 0.256 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.608 179.559 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 375' ' ' GLU . . . . . . . . . . . . . 16.4 mm-40 -53.24 -39.65 63.98 Favored 'General case' 0 C--N 1.333 -0.144 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.292 179.451 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 376' ' ' PHE . . . . . . . . . . . . . 88.4 t80 -69.29 -36.44 77.04 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.042 -0.526 . . . . 0.0 109.795 179.087 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 377' ' ' GLY . . . . . . . . . . . . . . . -61.87 -31.0 76.79 Favored Glycine 0 N--CA 1.448 -0.512 0 C-N-CA 120.896 -0.669 . . . . 0.0 111.607 179.234 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 378' ' ' GLN . . . . . . . . . . . . . 23.4 mt-30 -58.51 -32.0 68.42 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.836 0.35 . . . . 0.0 110.287 179.252 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 379' ' ' PHE . . . . . . . . . . . . . 97.6 m-85 -75.62 -31.0 59.71 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.221 179.244 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 380' ' ' LEU . . . . . . . . . . . . . 5.7 tp -59.05 127.67 84.05 Favored Pre-proline 0 C--N 1.328 -0.364 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.654 -179.97 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 381' ' ' PRO . . . . . 0.456 ' HD3' ' HB3' ' A' ' 373' ' ' MET . 51.4 Cg_exo -52.58 162.55 2.28 Favored 'Trans proline' 0 C--N 1.348 0.514 0 C-N-CA 122.348 2.032 . . . . 0.0 112.322 -179.71 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 382' ' ' ASP . . . . . . . . . . . . . 12.2 m-20 -142.3 154.96 45.13 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.345 -0.388 . . . . 0.0 110.951 179.947 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 383' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.047 0 CA-C-O 118.198 -0.906 . . . . 0.0 111.267 179.856 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 358' ' ' ASP . . . . . . . . . . . . . 4.4 p30 . . . . . 0 N--CA 1.484 1.266 0 CA-C-O 120.815 0.34 . . . . 0.0 110.744 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 359' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -158.58 -141.38 0.09 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.592 -179.885 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 360' ' ' THR . . . . . . . . . . . . . 13.7 m 67.05 128.03 0.03 OUTLIER Pre-proline 0 CA--C 1.53 0.197 0 CA-C-N 116.504 -0.316 . . . . 0.0 111.182 -179.927 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 361' ' ' PRO . . . . . 0.428 ' HA ' HG11 ' B' ' 311' ' ' VAL . 60.0 Cg_endo -71.65 -160.69 0.09 OUTLIER 'Trans proline' 0 C--N 1.349 0.604 0 C-N-CA 122.338 2.025 . . . . 0.0 112.181 -179.913 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 362' ' ' MET . . . . . 0.623 ' HB2' HD22 ' B' ' 329' ' ' LEU . 12.2 tpt -57.69 -71.56 0.1 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.548 179.868 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 363' ' ' ASP . . . . . . . . . . . . . 29.5 t70 -180.0 68.69 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.89 -0.596 . . . . 0.0 110.305 179.895 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 364' ' ' SER . . . . . . . . . . . . . 55.8 m 56.34 21.12 5.16 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.678 -179.609 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 365' ' ' SER . . . . . 0.41 ' O ' HG12 ' A' ' 369' ' ' VAL . 41.2 t -111.63 -61.18 1.74 Allowed 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 115.884 -0.598 . . . . 0.0 111.327 -179.657 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 366' ' ' ALA . . . . . . . . . . . . . . . -54.96 -43.29 73.32 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.811 -179.423 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 367' ' ' VAL . . . . . . . . . . . . . 20.8 m -65.35 -37.93 81.3 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 CA-C-N 116.465 -0.334 . . . . 0.0 111.558 -179.515 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 368' ' ' TYR . . . . . . . . . . . . . 80.4 t80 -68.75 -53.02 24.36 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.355 -0.384 . . . . 0.0 111.539 -179.422 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 369' ' ' VAL . . . . . 0.578 HG11 ' HB3' ' B' ' 332' ' ' LEU . 5.1 p -57.62 -50.2 78.12 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.203 0 CA-C-N 116.611 -0.268 . . . . 0.0 111.513 -179.58 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 370' ' ' LEU . . . . . 0.531 ' HB3' ' HB2' ' B' ' 307' ' ' ALA . 8.1 mp -63.55 -35.73 81.46 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.689 0.28 . . . . 0.0 111.22 -179.866 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 371' ' ' SER . . . . . 0.527 ' HA ' ' HB2' ' B' ' 303' ' ' GLU . 34.6 t -62.41 -61.78 2.21 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 120.828 0.347 . . . . 0.0 111.107 179.85 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 372' ' ' SER . . . . . . . . . . . . . 40.4 t -62.43 -25.6 68.05 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.283 -179.515 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 373' ' ' MET . . . . . . . . . . . . . 56.0 ttm -66.38 -52.14 49.91 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.318 -0.401 . . . . 0.0 111.492 -179.628 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 374' ' ' ALA . . . . . . . . . . . . . . . -88.06 -8.86 54.93 Favored 'General case' 0 C--N 1.33 -0.281 0 N-CA-C 112.419 0.526 . . . . 0.0 112.419 -179.051 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 375' ' ' ARG . . . . . . . . . . . . . 10.4 ttp180 -94.09 -30.14 14.82 Favored 'General case' 0 C--N 1.33 -0.268 0 C-N-CA 120.962 -0.295 . . . . 0.0 111.515 -179.855 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 376' ' ' GLN . . . . . . . . . . . . . 24.0 tp60 -62.53 -74.93 0.08 Allowed 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.615 0.245 . . . . 0.0 111.004 -179.837 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 377' ' ' ARG . . . . . . . . . . . . . 70.9 mtm180 61.35 108.87 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.159 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.264 179.873 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 378' ' ' ARG . . . . . . . . . . . . . 81.1 mtm180 57.47 94.56 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.1 179.758 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 379' ' ' ALA . . . . . . . . . . . . . . . -97.54 -174.23 2.86 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.215 179.983 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 380' ' ' SER . . . . . . . . . . . . . 46.4 t . . . . . 0 C--O 1.249 1.036 0 CA-C-O 118.223 -0.894 . . . . 0.0 110.838 179.967 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' B' B ' 295' ' ' SER . . . . . . . . . . . . . 53.0 m . . . . . 0 N--CA 1.486 1.362 0 CA-C-O 120.798 0.333 . . . . 0.0 110.849 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' B' B ' 296' ' ' LEU . . . . . 0.424 HD22 ' N ' ' B' ' 296' ' ' LEU . 3.7 mm? -101.81 117.68 35.36 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.908 179.991 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 297' ' ' GLN . . . . . 0.484 ' C ' HD22 ' B' ' 298' ' ' ASN . 54.4 tt0 -161.55 86.75 0.67 Allowed 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.852 179.872 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 298' ' ' ASN . . . . . 0.554 ' N ' HD22 ' B' ' 298' ' ' ASN . 0.9 OUTLIER -112.43 -42.26 3.71 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.738 179.892 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 299' ' ' ASN . . . . . . . . . . . . . 3.0 t-20 -135.64 131.58 35.96 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.725 -179.901 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 300' ' ' GLN . . . . . 0.404 ' H ' ' CD ' ' B' ' 300' ' ' GLN . 0.0 OUTLIER -78.13 148.78 75.4 Favored Pre-proline 0 C--N 1.33 -0.263 0 CA-C-N 116.507 -0.315 . . . . 0.0 110.967 -179.68 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 301' ' ' PRO . . . . . . . . . . . . . 52.4 Cg_exo -55.66 176.9 0.14 Allowed 'Trans proline' 0 C--N 1.348 0.526 0 C-N-CA 122.63 2.22 . . . . 0.0 112.611 179.968 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 302' ' ' VAL . . . . . 0.623 HG23 ' H ' ' B' ' 303' ' ' GLU . 3.3 m -85.78 -60.35 2.27 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.541 -179.848 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 303' ' ' GLU . . . . . 0.623 ' H ' HG23 ' B' ' 302' ' ' VAL . 0.0 OUTLIER -59.67 -16.0 23.34 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.412 -0.358 . . . . 0.0 111.073 -179.791 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 304' ' ' PHE . . . . . . . . . . . . . 82.3 t80 -64.13 -75.64 0.08 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.519 179.786 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 305' ' ' ASN . . . . . . . . . . . . . 25.7 t-20 -61.49 -29.44 69.98 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.995 -179.92 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 306' ' ' HIS . . . . . . . . . . . . . 2.3 m-70 -62.36 -69.33 0.26 Allowed 'General case' 0 C--O 1.233 0.202 0 CA-C-N 116.41 -0.359 . . . . 0.0 111.494 179.875 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 307' ' ' ALA . . . . . 0.531 ' HB2' ' HB3' ' A' ' 370' ' ' LEU . . . -55.56 -42.31 74.5 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.961 -179.217 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 308' ' ' ILE . . . . . . . . . . . . . 97.7 mt -60.34 -63.83 0.7 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.181 0 CA-C-O 120.672 0.272 . . . . 0.0 111.214 -179.853 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 309' ' ' ASN . . . . . . . . . . . . . 2.9 m-20 -54.76 -24.76 23.93 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.321 -0.399 . . . . 0.0 110.704 179.942 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 310' ' ' TYR . . . . . 0.444 ' O ' ' HG3' ' B' ' 313' ' ' LYS . 19.2 t80 -65.7 -57.18 8.67 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.31 179.51 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 311' ' ' VAL . . . . . 0.428 HG11 ' HA ' ' A' ' 361' ' ' PRO . 59.5 t -60.24 -31.05 47.34 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.748 179.557 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 312' ' ' ASN . . . . . . . . . . . . . 51.1 t-20 -66.26 -57.06 8.37 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.97 -0.559 . . . . 0.0 111.58 -179.696 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 313' ' ' LYS . . . . . 0.444 ' HG3' ' O ' ' B' ' 310' ' ' TYR . 0.0 OUTLIER -61.79 -30.56 70.89 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.61 -0.268 . . . . 0.0 111.633 -179.187 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 314' ' ' ILE . . . . . . . . . . . . . 89.3 mt -76.78 -31.69 19.64 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.206 0 CA-C-O 120.878 0.371 . . . . 0.0 110.998 179.542 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 315' ' ' LYS . . . . . . . . . . . . . 23.8 ttmm -78.49 -26.47 46.02 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.298 -179.717 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 316' ' ' ASN . . . . . . . . . . . . . 26.6 t-20 -88.95 -46.08 9.17 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.423 -0.353 . . . . 0.0 111.427 -179.607 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 317' ' ' ARG . . . . . . . . . . . . . 32.0 tpt180 -65.17 -60.41 3.03 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.432 -0.349 . . . . 0.0 111.203 -179.742 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 318' ' ' PHE . . . . . . . . . . . . . 95.4 m-85 -80.94 25.68 0.45 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.242 -0.435 . . . . 0.0 111.27 -179.655 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 319' ' ' GLN . . . . . . . . . . . . . 56.7 tt0 -62.6 -23.88 67.28 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.658 179.775 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 320' ' ' GLY . . . . . . . . . . . . . . . -72.8 -46.08 31.58 Favored Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 120.886 -0.673 . . . . 0.0 112.689 -179.915 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 321' ' ' GLN . . . . . . . . . . . . . 8.4 tt0 -108.0 92.95 9.96 Favored Pre-proline 0 C--N 1.329 -0.301 0 CA-C-O 120.462 0.172 . . . . 0.0 110.828 179.964 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 322' ' ' PRO . . . . . . . . . . . . . 57.9 Cg_endo -71.34 -4.43 14.95 Favored 'Trans proline' 0 C--N 1.348 0.507 0 C-N-CA 122.433 2.089 . . . . 0.0 112.333 179.931 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 323' ' ' ASP . . . . . . . . . . . . . 16.2 t70 -68.97 -56.09 8.87 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.914 179.876 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 324' ' ' ILE . . . . . . . . . . . . . 63.8 mt -60.98 -46.25 96.97 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.938 179.887 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 325' ' ' TYR . . . . . 0.435 ' CE2' HD11 ' B' ' 329' ' ' LEU . 30.0 t80 -57.72 -47.88 81.15 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.989 -0.551 . . . . 0.0 110.887 179.936 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 326' ' ' LYS . . . . . . . . . . . . . 23.6 ttmm -57.3 -52.39 65.52 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.022 -179.977 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 327' ' ' ALA . . . . . . . . . . . . . . . -51.21 -47.13 62.37 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.053 179.964 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 328' ' ' PHE . . . . . . . . . . . . . 59.6 t80 -56.09 -48.71 75.61 Favored 'General case' 0 C--O 1.235 0.296 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.387 179.672 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 329' ' ' LEU . . . . . 0.623 HD22 ' HB2' ' A' ' 362' ' ' MET . 77.9 mt -58.29 -34.67 70.79 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.844 -0.617 . . . . 0.0 110.813 179.584 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 330' ' ' GLU . . . . . . . . . . . . . 48.1 mt-10 -68.71 -37.07 79.22 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.934 -0.575 . . . . 0.0 110.825 -179.903 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 331' ' ' ILE . . . . . . . . . . . . . 75.8 mt -65.71 -45.28 92.35 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.229 0 CA-C-N 116.38 -0.373 . . . . 0.0 110.697 179.769 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 332' ' ' LEU . . . . . 0.578 ' HB3' HG11 ' A' ' 369' ' ' VAL . 25.0 mt -69.0 -32.44 71.99 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.972 -179.972 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 333' ' ' HIS . . . . . . . . . . . . . 49.7 t60 -66.58 -53.79 30.58 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.927 0.394 . . . . 0.0 110.543 179.649 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 334' ' ' THR . . . . . 0.403 HG22 HD13 ' B' ' 353' ' ' LEU . 89.3 m -62.03 -35.86 79.84 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.825 179.751 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 335' ' ' TYR . . . . . . . . . . . . . 71.7 t80 -64.74 -41.77 95.68 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.511 179.727 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 336' ' ' GLN . . . . . . . . . . . . . 6.8 tt0 -65.9 -38.04 87.68 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.881 -0.599 . . . . 0.0 110.798 179.816 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 337' ' ' LYS . . . . . . . . . . . . . 38.1 ttpt -64.88 -50.3 67.11 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.284 -0.416 . . . . 0.0 111.115 179.941 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 338' ' ' GLU . . . . . . . . . . . . . 21.5 mm-40 -63.3 -35.4 80.25 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.978 -179.854 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 339' ' ' GLN . . . . . . . . . . . . . 28.5 tt0 -64.17 -53.03 55.76 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.669 179.873 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 340' ' ' ARG . . . . . . . . . . . . . 99.1 mtt180 -57.94 -47.07 83.98 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.856 179.819 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 341' ' ' ASN . . . . . . . . . . . . . 49.2 t-20 -56.4 -46.04 80.34 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.481 179.513 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 342' ' ' ALA . . . . . . . . . . . . . . . -66.38 -27.2 67.68 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.064 -0.517 . . . . 0.0 110.707 179.757 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 343' ' ' LYS . . . . . . . . . . . . . 22.3 tptm -71.87 -46.52 57.59 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.809 179.781 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 344' ' ' GLU . . . . . . . . . . . . . 10.9 mm-40 -67.31 -34.84 78.2 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.868 -0.605 . . . . 0.0 110.919 -179.935 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 345' ' ' ALA . . . . . . . . . . . . . . . -71.16 -19.51 62.41 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.132 179.872 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 346' ' ' GLY . . . . . . . . . . . . . . . 104.61 -64.39 0.33 Allowed Glycine 0 N--CA 1.45 -0.376 0 C-N-CA 120.875 -0.678 . . . . 0.0 112.501 -179.97 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 347' ' ' GLY . . . . . . . . . . . . . . . 175.09 -13.77 0.04 OUTLIER Glycine 0 N--CA 1.452 -0.238 0 C-N-CA 120.78 -0.724 . . . . 0.0 112.485 179.898 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 348' ' ' ASN . . . . . . . . . . . . . 32.7 m-80 -77.8 3.22 14.79 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.865 0.364 . . . . 0.0 110.774 -179.975 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 349' ' ' TYR . . . . . . . . . . . . . 83.3 t80 -88.28 152.77 21.72 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.92 -179.906 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 350' ' ' THR . . . . . . . . . . . . . 84.9 m -110.2 94.66 18.87 Favored Pre-proline 0 C--N 1.329 -0.299 0 CA-C-N 115.971 -0.558 . . . . 0.0 111.023 179.797 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 351' ' ' PRO . . . . . . . . . . . . . 40.5 Cg_exo -57.26 169.93 1.9 Allowed 'Trans proline' 0 C--N 1.35 0.632 0 C-N-CA 122.44 2.093 . . . . 0.0 112.053 179.745 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 352' ' ' ALA . . . . . . . . . . . . . . . -103.27 -51.5 3.22 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.319 -0.4 . . . . 0.0 111.496 -179.606 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 353' ' ' LEU . . . . . 0.468 ' HG ' ' HG2' ' B' ' 357' ' ' GLU . 7.0 mp -108.87 126.28 52.89 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 121.106 0.479 . . . . 0.0 111.521 -179.529 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 354' ' ' THR . . . . . 0.422 ' H ' ' HB2' ' B' ' 357' ' ' GLU . 40.4 p -111.93 -176.85 3.03 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.703 -0.68 . . . . 0.0 110.382 179.264 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 355' ' ' GLU . . . . . . . . . . . . . 8.4 pt-20 -53.44 -41.71 66.36 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.112 0.482 . . . . 0.0 110.483 179.558 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 356' ' ' GLN . . . . . . . . . . . . . 53.5 tt0 -67.57 -39.36 84.9 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.698 -0.683 . . . . 0.0 110.964 179.904 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 357' ' ' GLU . . . . . 0.468 ' HG2' ' HG ' ' B' ' 353' ' ' LEU . 4.8 tp10 -60.43 -54.07 49.97 Favored 'General case' 0 C--N 1.333 -0.136 0 CA-C-O 120.826 0.346 . . . . 0.0 110.976 -179.895 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 358' ' ' VAL . . . . . 0.553 ' O ' HG23 ' B' ' 362' ' ' VAL . 75.6 t -59.36 -59.63 3.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.104 -179.988 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 359' ' ' TYR . . . . . . . . . . . . . 78.2 t80 -51.04 -31.9 19.94 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.565 -0.289 . . . . 0.0 111.326 -179.466 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 360' ' ' ALA . . . . . . . . . . . . . . . -67.39 -60.37 2.64 Favored 'General case' 0 C--O 1.234 0.285 0 CA-C-O 120.849 0.356 . . . . 0.0 110.987 179.688 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 361' ' ' GLN . . . . . . . . . . . . . 45.1 mt-30 -57.56 -35.25 70.1 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.682 179.948 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 362' ' ' VAL . . . . . 0.553 HG23 ' O ' ' B' ' 358' ' ' VAL . 67.7 t -70.71 -34.7 57.7 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.336 179.456 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 363' ' ' ALA . . . . . 0.589 ' HA ' HD21 ' B' ' 373' ' ' LEU . . . -64.01 -39.42 94.06 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.132 179.212 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 364' ' ' ARG . . . . . . . . . . . . . 80.8 mtp180 -82.37 -22.19 35.58 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.701 -0.682 . . . . 0.0 110.325 179.193 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 365' ' ' LEU . . . . . 0.447 ' HB2' ' HA ' ' B' ' 362' ' ' VAL . 2.4 tp -60.14 -26.98 66.7 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 115.936 -0.574 . . . . 0.0 110.335 179.883 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 366' ' ' PHE . . . . . . . . . . . . . 45.3 m-85 -122.68 -176.29 3.35 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.447 179.659 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 367' ' ' LYS . . . . . 0.459 ' NZ ' ' HB2' ' B' ' 367' ' ' LYS . 0.0 OUTLIER -141.0 -75.95 0.31 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.424 -0.353 . . . . 0.0 110.885 -179.98 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 368' ' ' ASN . . . . . . . . . . . . . 6.6 t30 -81.12 -16.77 52.07 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.528 179.893 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 369' ' ' GLN . . . . . 0.637 ' HB3' HD13 ' B' ' 372' ' ' LEU . 12.7 mm100 -83.69 84.78 7.42 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.866 -179.939 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 370' ' ' GLU . . . . . . . . . . . . . 38.2 tt0 -93.75 -17.88 22.68 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.874 0.369 . . . . 0.0 110.519 179.81 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 371' ' ' ASP . . . . . . . . . . . . . 25.2 t70 -56.81 -40.28 75.69 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.625 179.722 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 372' ' ' LEU . . . . . 0.637 HD13 ' HB3' ' B' ' 369' ' ' GLN . 6.5 mp -65.86 -44.81 84.32 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.597 179.483 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 373' ' ' LEU . . . . . 0.589 HD21 ' HA ' ' B' ' 363' ' ' ALA . 1.3 mp -57.44 -43.33 83.8 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.76 -0.655 . . . . 0.0 111.417 -179.718 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 374' ' ' SER . . . . . . . . . . . . . 80.9 p -69.2 -53.23 21.04 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.959 0.409 . . . . 0.0 110.518 179.818 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 375' ' ' GLU . . . . . . . . . . . . . 40.0 tt0 -59.54 -24.57 63.81 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.969 -0.559 . . . . 0.0 110.509 179.776 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 376' ' ' PHE . . . . . . . . . . . . . 76.0 t80 -83.34 -34.01 25.75 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.12 179.378 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 377' ' ' GLY . . . . . . . . . . . . . . . -67.72 -32.46 78.15 Favored Glycine 0 N--CA 1.449 -0.436 0 C-N-CA 120.812 -0.708 . . . . 0.0 111.867 179.463 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 378' ' ' GLN . . . . . . . . . . . . . 54.7 mt-30 -61.75 -24.63 66.95 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.819 0.342 . . . . 0.0 110.547 179.442 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 379' ' ' PHE . . . . . . . . . . . . . 22.3 m-85 -72.06 -40.36 68.37 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.541 179.663 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 380' ' ' LEU . . . . . . . . . . . . . 75.8 mt -49.64 144.13 9.95 Favored Pre-proline 0 C--N 1.33 -0.256 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.294 179.72 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 381' ' ' PRO . . . . . . . . . . . . . 72.5 Cg_exo -48.38 147.82 8.42 Favored 'Trans proline' 0 C--N 1.347 0.465 0 C-N-CA 122.418 2.079 . . . . 0.0 112.417 -179.462 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 382' ' ' ASP . . . . . . . . . . . . . 17.2 t70 -57.6 128.67 38.24 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.894 -179.97 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 383' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.103 0 CA-C-O 118.187 -0.911 . . . . 0.0 111.16 179.964 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 358' ' ' ASP . . . . . . . . . . . . . 16.0 m-20 . . . . . 0 N--CA 1.485 1.287 0 CA-C-O 120.864 0.364 . . . . 0.0 110.926 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 359' ' ' PHE . . . . . . . . . . . . . 32.0 p90 -160.56 135.94 7.98 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.921 -179.975 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 360' ' ' THR . . . . . 0.544 ' N ' ' HD3' ' A' ' 361' ' ' PRO . 80.3 p -140.88 50.96 2.21 Favored Pre-proline 0 CA--C 1.532 0.27 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.774 179.631 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 361' ' ' PRO . . . . . 0.544 ' HD3' ' N ' ' A' ' 360' ' ' THR . 73.1 Cg_endo -86.74 -75.8 0.0 OUTLIER 'Trans proline' 0 N--CA 1.457 -0.657 0 C-N-CA 122.306 2.004 . . . . 0.0 112.22 179.594 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 362' ' ' MET . . . . . 0.534 ' HG2' HD22 ' B' ' 329' ' ' LEU . 0.0 OUTLIER -118.66 11.46 12.79 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.641 179.56 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 363' ' ' ASP . . . . . . . . . . . . . 17.8 t70 -67.34 -11.19 57.01 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.659 179.867 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 364' ' ' SER . . . . . . . . . . . . . 80.3 p -135.74 21.17 3.31 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.635 179.816 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 365' ' ' SER . . . . . . . . . . . . . 48.1 t -131.87 -59.95 0.93 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.841 -179.928 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 366' ' ' ALA . . . . . . . . . . . . . . . -69.27 -18.54 63.87 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.973 179.922 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 367' ' ' VAL . . . . . . . . . . . . . 16.5 m -58.74 -35.62 56.54 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 116.03 -0.532 . . . . 0.0 111.115 179.913 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 368' ' ' TYR . . . . . . . . . . . . . 94.1 m-85 -64.65 -40.85 96.16 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.389 -0.368 . . . . 0.0 110.624 179.745 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 369' ' ' VAL . . . . . 0.585 HG22 ' HB2' ' B' ' 336' ' ' GLN . 21.9 t -63.99 -59.6 4.01 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-N 116.002 -0.544 . . . . 0.0 111.075 -179.897 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 370' ' ' LEU . . . . . 0.506 ' HB2' ' HB1' ' B' ' 307' ' ' ALA . 88.0 mt -57.81 -35.95 71.56 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.999 -0.546 . . . . 0.0 111.413 -179.604 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 371' ' ' SER . . . . . . . . . . . . . 47.3 t -61.83 -60.86 3.02 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.295 -0.412 . . . . 0.0 111.32 -179.558 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 372' ' ' SER . . . . . . . . . . . . . 79.4 p -56.93 -42.95 80.92 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.772 -179.368 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 373' ' ' MET . . . . . . . . . . . . . 90.2 mtp -57.29 -47.37 81.65 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.381 -0.372 . . . . 0.0 111.818 -179.355 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 374' ' ' ALA . . . . . 0.541 ' HB3' ' HB3' ' B' ' 303' ' ' GLU . . . -84.22 -17.93 38.21 Favored 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 112.044 0.387 . . . . 0.0 112.044 -179.341 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 375' ' ' ARG . . . . . . . . . . . . . 29.8 tpt180 -80.39 -26.49 38.52 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.769 0.319 . . . . 0.0 110.787 -179.881 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 376' ' ' GLN . . . . . . . . . . . . . 8.5 tt0 -62.62 -83.14 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.132 -179.748 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 377' ' ' ARG . . . . . . . . . . . . . 99.7 mtt180 60.19 -85.06 0.02 OUTLIER 'General case' 0 C--O 1.231 0.131 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.197 -179.732 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 378' ' ' ARG . . . . . . . . . . . . . 23.8 mmm180 -96.15 -167.61 1.61 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.452 -0.34 . . . . 0.0 110.943 -179.924 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 379' ' ' ALA . . . . . . . . . . . . . . . 60.11 25.17 14.46 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.067 179.883 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 380' ' ' SER . . . . . . . . . . . . . 71.1 p . . . . . 0 C--O 1.247 0.971 0 CA-C-O 118.235 -0.888 . . . . 0.0 110.941 179.966 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' B' B ' 295' ' ' SER . . . . . . . . . . . . . 83.5 p . . . . . 0 N--CA 1.486 1.339 0 CA-C-O 120.792 0.33 . . . . 0.0 110.895 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' B' B ' 296' ' ' LEU . . . . . . . . . . . . . 78.9 mt -134.69 114.37 12.63 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.756 179.986 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 297' ' ' GLN . . . . . . . . . . . . . 8.9 tt0 -82.59 -29.35 30.27 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.099 -0.5 . . . . 0.0 111.078 -179.771 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 298' ' ' ASN . . . . . . . . . . . . . 39.2 m-80 -121.45 124.4 44.39 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.341 -0.391 . . . . 0.0 111.064 179.971 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 299' ' ' ASN . . . . . . . . . . . . . 63.0 t30 -123.14 3.96 9.26 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.492 179.719 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 300' ' ' GLN . . . . . . . . . . . . . 6.1 tp-100 60.21 75.96 0.45 Allowed Pre-proline 0 C--N 1.331 -0.232 0 CA-C-N 115.879 -0.6 . . . . 0.0 111.174 179.842 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 301' ' ' PRO . . . . . 0.43 ' HB2' ' HB3' ' B' ' 304' ' ' PHE . 91.8 Cg_endo -86.49 96.65 0.52 Allowed 'Trans proline' 0 N--CA 1.458 -0.583 0 C-N-CA 122.459 2.106 . . . . 0.0 112.185 179.615 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 302' ' ' VAL . . . . . 0.632 HG23 ' H ' ' B' ' 303' ' ' GLU . 3.9 m -92.13 -59.77 2.8 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.353 -179.917 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 303' ' ' GLU . . . . . 0.632 ' H ' HG23 ' B' ' 302' ' ' VAL . 3.3 mm-40 -69.12 -23.73 64.02 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.611 -179.749 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 304' ' ' PHE . . . . . 0.43 ' HB3' ' HB2' ' B' ' 301' ' ' PRO . 68.9 t80 -67.5 -54.48 19.76 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.188 179.433 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 305' ' ' ASN . . . . . . . . . . . . . 24.6 t-20 -60.29 -48.7 80.61 Favored 'General case' 0 C--O 1.233 0.228 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.471 179.408 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 306' ' ' HIS . . . . . . . . . . . . . 18.5 t-80 -54.72 -42.99 72.18 Favored 'General case' 0 C--O 1.234 0.264 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.24 179.494 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 307' ' ' ALA . . . . . 0.506 ' HB1' ' HB2' ' A' ' 370' ' ' LEU . . . -59.4 -44.98 92.72 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.635 179.548 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 308' ' ' ILE . . . . . 0.407 HG13 ' O ' ' B' ' 304' ' ' PHE . 85.3 mt -54.87 -51.96 47.56 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.215 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.593 179.358 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 309' ' ' ASN . . . . . . . . . . . . . 19.1 m120 -55.48 -38.17 68.78 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.731 179.788 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 310' ' ' TYR . . . . . 0.425 ' O ' ' HG3' ' B' ' 313' ' ' LYS . 15.0 t80 -61.49 -48.49 80.84 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.093 -0.503 . . . . 0.0 111.056 179.785 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 311' ' ' VAL . . . . . . . . . . . . . 40.0 t -62.57 -32.37 55.15 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.224 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.041 179.931 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 312' ' ' ASN . . . . . . . . . . . . . 31.4 t30 -67.68 -55.44 13.21 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.559 -179.652 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 313' ' ' LYS . . . . . 0.425 ' HG3' ' O ' ' B' ' 310' ' ' TYR . 0.0 OUTLIER -59.65 -36.94 77.4 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.382 -0.372 . . . . 0.0 111.784 -179.109 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 314' ' ' ILE . . . . . 0.404 HD11 ' CZ ' ' B' ' 310' ' ' TYR . 68.3 mt -70.27 -40.1 77.53 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.162 0 C-N-CA 120.85 -0.34 . . . . 0.0 110.866 179.601 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 315' ' ' LYS . . . . . . . . . . . . . 12.9 ttpp -61.11 -47.29 86.95 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.324 -179.715 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 316' ' ' ASN . . . . . . . . . . . . . 57.6 t30 -67.51 -50.99 56.33 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.414 -179.329 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 317' ' ' ARG . . . . . . . . . . . . . 6.8 tpm_? -56.18 -61.26 2.52 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.186 -179.571 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 318' ' ' PHE . . . . . . . . . . . . . 66.9 m-85 -88.61 37.58 0.84 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.362 -179.686 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 319' ' ' GLN . . . . . . . . . . . . . 9.0 tt0 -68.66 -28.83 67.22 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.365 -0.38 . . . . 0.0 110.782 179.981 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 320' ' ' GLY . . . . . . . . . . . . . . . -82.84 -14.69 74.78 Favored Glycine 0 N--CA 1.452 -0.289 0 C-N-CA 120.847 -0.692 . . . . 0.0 112.451 179.856 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 321' ' ' GLN . . . . . . . . . . . . . 25.8 mp0 -110.21 88.53 7.29 Favored Pre-proline 0 C--N 1.33 -0.258 0 CA-C-O 120.451 0.167 . . . . 0.0 110.754 179.948 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 322' ' ' PRO . . . . . . . . . . . . . 70.2 Cg_endo -73.89 -30.8 8.84 Favored 'Trans proline' 0 C--N 1.348 0.537 0 C-N-CA 122.374 2.049 . . . . 0.0 112.391 -179.996 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 323' ' ' ASP . . . . . . . . . . . . . 8.7 m-20 -63.7 -50.74 68.0 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.03 -179.884 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 324' ' ' ILE . . . . . . . . . . . . . 58.7 mt -67.03 -49.16 76.11 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.266 -179.798 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 325' ' ' TYR . . . . . 0.403 ' O ' ' HG ' ' B' ' 329' ' ' LEU . 11.3 t80 -52.91 -50.79 63.23 Favored 'General case' 0 C--O 1.234 0.26 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.694 179.956 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 326' ' ' LYS . . . . . 0.463 ' O ' ' HG3' ' B' ' 330' ' ' GLU . 47.5 mttp -57.46 -53.95 52.31 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.774 179.423 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 327' ' ' ALA . . . . . 0.429 ' O ' HG13 ' B' ' 331' ' ' ILE . . . -46.31 -49.16 17.9 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.36 -179.935 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 328' ' ' PHE . . . . . . . . . . . . . 70.8 t80 -57.46 -55.26 37.09 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.747 179.844 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 329' ' ' LEU . . . . . 0.534 HD22 ' HG2' ' A' ' 362' ' ' MET . 62.1 mt -58.65 -26.97 64.31 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.723 179.853 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 330' ' ' GLU . . . . . 0.463 ' HG3' ' O ' ' B' ' 326' ' ' LYS . 45.5 mt-10 -73.91 -36.5 64.72 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.409 179.583 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 331' ' ' ILE . . . . . 0.429 HG13 ' O ' ' B' ' 327' ' ' ALA . 91.7 mt -64.44 -50.5 75.91 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.204 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.135 179.235 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 332' ' ' LEU . . . . . . . . . . . . . 8.9 mp -65.58 -34.33 77.99 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.58 179.411 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 333' ' ' HIS . . . . . . . . . . . . . 50.2 t-80 -59.96 -57.41 13.0 Favored 'General case' 0 C--O 1.233 0.216 0 CA-C-O 120.975 0.417 . . . . 0.0 110.312 179.155 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 334' ' ' THR . . . . . . . . . . . . . 58.0 m -59.18 -33.13 70.58 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.855 -0.611 . . . . 0.0 110.555 179.421 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 335' ' ' TYR . . . . . . . . . . . . . 59.3 t80 -59.84 -51.46 69.62 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.732 179.883 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 336' ' ' GLN . . . . . 0.585 ' HB2' HG22 ' A' ' 369' ' ' VAL . 0.0 OUTLIER -62.33 -40.51 96.58 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.605 179.87 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 337' ' ' LYS . . . . . . . . . . . . . 25.0 ttmm -57.19 -47.82 80.29 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.747 179.712 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 338' ' ' GLU . . . . . 0.442 ' HG3' ' HB3' ' B' ' 352' ' ' ALA . 22.5 mm-40 -64.92 -37.58 88.12 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.795 179.797 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 339' ' ' GLN . . . . . . . . . . . . . 59.1 tp60 -61.7 -41.58 97.78 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.465 179.751 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 340' ' ' ARG . . . . . . . . . . . . . 72.6 mtp180 -64.17 -52.9 56.77 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.335 179.462 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 341' ' ' ASN . . . . . . . . . . . . . 3.2 m-20 -56.93 -31.01 64.51 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.002 -0.544 . . . . 0.0 110.276 179.237 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 342' ' ' ALA . . . . . . . . . . . . . . . -70.19 -40.25 74.75 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.581 179.453 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 343' ' ' LYS . . . . . . . . . . . . . 59.7 tttm -70.78 -28.74 64.89 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.723 179.62 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 344' ' ' GLU . . . . . . . . . . . . . 20.1 mm-40 -79.27 -33.6 43.32 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.105 -179.776 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 345' ' ' ALA . . . . . . . . . . . . . . . -59.28 -28.69 66.99 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.379 -179.825 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 346' ' ' GLY . . . . . . . . . . . . . . . 87.45 -17.33 44.47 Favored Glycine 0 N--CA 1.452 -0.237 0 C-N-CA 120.715 -0.755 . . . . 0.0 112.544 179.991 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 347' ' ' GLY . . . . . . . . . . . . . . . 146.75 177.21 21.17 Favored Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.79 -0.719 . . . . 0.0 112.449 -179.964 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 348' ' ' ASN . . . . . . . . . . . . . 19.7 t-20 60.28 17.88 7.45 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.842 0.353 . . . . 0.0 110.771 179.947 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 349' ' ' TYR . . . . . . . . . . . . . 59.2 t80 -117.06 124.88 50.34 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.908 179.967 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 350' ' ' THR . . . . . . . . . . . . . 88.5 m -100.56 111.73 63.3 Favored Pre-proline 0 C--N 1.329 -0.306 0 CA-C-N 116.059 -0.518 . . . . 0.0 110.923 179.698 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 351' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_exo -52.06 147.88 25.53 Favored 'Trans proline' 0 C--N 1.351 0.669 0 C-N-CA 122.354 2.036 . . . . 0.0 112.258 179.815 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 352' ' ' ALA . . . . . 0.442 ' HB3' ' HG3' ' B' ' 338' ' ' GLU . . . -67.05 -55.03 16.07 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.389 -179.64 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 353' ' ' LEU . . . . . 0.531 HD22 ' HG2' ' B' ' 357' ' ' GLU . 22.0 mt -106.12 130.92 53.92 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.86 0.362 . . . . 0.0 111.192 -179.709 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 354' ' ' THR . . . . . . . . . . . . . 73.8 p -113.79 -170.63 1.74 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.905 179.69 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 355' ' ' GLU . . . . . . . . . . . . . 37.5 mt-10 -60.77 -44.3 96.94 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.97 179.912 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 356' ' ' GLN . . . . . . . . . . . . . 27.7 mm-40 -68.17 -38.18 81.8 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.028 -0.533 . . . . 0.0 111.335 -179.661 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 357' ' ' GLU . . . . . 0.531 ' HG2' HD22 ' B' ' 353' ' ' LEU . 8.8 tp10 -63.05 -54.37 39.17 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.535 -0.302 . . . . 0.0 111.018 -179.714 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 358' ' ' VAL . . . . . 0.48 ' O ' HG23 ' B' ' 362' ' ' VAL . 54.2 t -59.07 -54.05 39.48 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 116.449 -0.341 . . . . 0.0 110.909 179.817 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 359' ' ' TYR . . . . . . . . . . . . . 72.8 t80 -54.66 -32.86 59.87 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.467 -0.333 . . . . 0.0 110.885 -179.819 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 360' ' ' ALA . . . . . . . . . . . . . . . -68.03 -59.58 3.15 Favored 'General case' 0 C--N 1.332 -0.196 0 CA-C-N 116.376 -0.374 . . . . 0.0 111.012 179.701 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 361' ' ' GLN . . . . . . . . . . . . . 24.4 mt-30 -55.63 -35.21 65.64 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.81 179.822 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 362' ' ' VAL . . . . . 0.48 HG23 ' O ' ' B' ' 358' ' ' VAL . 98.3 t -74.65 -34.49 34.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.509 179.541 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 363' ' ' ALA . . . . . . . . . . . . . . . -64.21 -33.9 76.87 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.059 -0.518 . . . . 0.0 110.232 179.484 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 364' ' ' ARG . . . . . . . . . . . . . 71.1 ttt180 -90.54 -22.03 21.5 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.188 179.374 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 365' ' ' LEU . . . . . . . . . . . . . 18.4 tp -55.17 -31.67 61.55 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.708 -0.678 . . . . 0.0 110.716 179.775 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 366' ' ' PHE . . . . . . . . . . . . . 52.3 m-85 -111.81 179.99 3.86 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.954 -0.567 . . . . 0.0 110.496 179.85 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 367' ' ' LYS . . . . . . . . . . . . . 64.9 tttm -123.44 -75.63 0.6 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.701 0.286 . . . . 0.0 111.313 -179.722 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 368' ' ' ASN . . . . . . . . . . . . . 20.1 m120 -98.91 6.31 46.83 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.254 -179.669 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 369' ' ' GLN . . . . . 0.559 ' HB3' HD13 ' B' ' 372' ' ' LEU . 21.8 mp0 -100.26 87.8 3.53 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.38 -0.373 . . . . 0.0 110.754 179.842 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 370' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -93.56 -16.37 24.48 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.749 179.962 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 371' ' ' ASP . . . . . . . . . . . . . 17.4 t70 -55.96 -37.15 68.64 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.766 179.856 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 372' ' ' LEU . . . . . 0.559 HD13 ' HB3' ' B' ' 369' ' ' GLN . 6.4 mp -69.98 -36.7 75.38 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.307 179.945 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 373' ' ' LEU . . . . . . . . . . . . . 24.4 mt -65.1 -38.27 90.16 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.442 -0.344 . . . . 0.0 110.26 179.811 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 374' ' ' SER . . . . . . . . . . . . . 57.9 m -69.15 -53.31 20.82 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.477 179.359 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 375' ' ' GLU . . . . . . . . . . . . . 22.6 mm-40 -54.21 -44.39 71.58 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.305 179.638 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 376' ' ' PHE . . . . . . . . . . . . . 70.5 t80 -68.8 -33.81 74.47 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.063 179.232 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 377' ' ' GLY . . . . . . . . . . . . . . . -61.11 -34.84 89.52 Favored Glycine 0 N--CA 1.451 -0.364 0 C-N-CA 120.78 -0.724 . . . . 0.0 111.663 179.38 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 378' ' ' GLN . . . . . . . . . . . . . 27.1 mt-30 -62.14 -31.22 71.67 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.692 0.282 . . . . 0.0 110.596 179.427 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 379' ' ' PHE . . . . . . . . . . . . . 60.7 m-85 -66.42 -31.1 71.65 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.773 179.74 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 380' ' ' LEU . . . . . . . . . . . . . 97.6 mt -60.48 134.52 91.45 Favored Pre-proline 0 C--N 1.329 -0.322 0 CA-C-N 116.356 -0.384 . . . . 0.0 110.657 179.91 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 381' ' ' PRO . . . . . . . . . . . . . 79.6 Cg_exo -46.46 125.08 8.74 Favored 'Trans proline' 0 C--N 1.351 0.673 0 C-N-CA 122.638 2.226 . . . . 0.0 112.933 -179.641 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 382' ' ' ASP . . . . . . . . . . . . . 7.5 m-20 -78.25 175.32 10.32 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.972 -179.98 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 383' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.056 0 CA-C-O 118.286 -0.864 . . . . 0.0 111.095 179.969 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 358' ' ' ASP . . . . . . . . . . . . . 8.1 m-20 . . . . . 0 N--CA 1.485 1.325 0 CA-C-O 120.673 0.273 . . . . 0.0 110.889 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 359' ' ' PHE . . . . . . . . . . . . . 83.3 t80 -74.1 122.78 23.25 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.613 179.862 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 360' ' ' THR . . . . . . . . . . . . . 4.9 t -113.29 142.03 26.78 Favored Pre-proline 0 C--N 1.331 -0.235 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.249 -179.95 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 361' ' ' PRO . . . . . . . . . . . . . 96.9 Cg_endo -78.03 -156.71 0.07 OUTLIER 'Trans proline' 0 C--N 1.349 0.591 0 C-N-CA 122.479 2.12 . . . . 0.0 112.02 179.892 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 362' ' ' MET . . . . . 0.618 ' HG3' HD13 ' B' ' 329' ' ' LEU . 22.5 ttt -55.66 -71.51 0.09 Allowed 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.806 179.795 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 363' ' ' ASP . . . . . . . . . . . . . 17.7 t70 -174.44 -22.27 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.971 -0.558 . . . . 0.0 110.482 179.952 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 364' ' ' SER . . . . . . . . . . . . . 34.8 p -129.28 -74.53 0.56 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.832 -179.992 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 365' ' ' SER . . . . . . . . . . . . . 69.0 m -161.67 76.66 0.51 Allowed 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.426 -0.352 . . . . 0.0 111.335 -179.956 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 366' ' ' ALA . . . . . . . . . . . . . . . -78.48 -34.96 47.17 Favored 'General case' 0 C--O 1.234 0.259 0 CA-C-O 121.015 0.436 . . . . 0.0 110.7 179.472 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 367' ' ' VAL . . . . . . . . . . . . . 39.4 t -55.97 -34.47 38.05 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.214 0 CA-C-N 115.733 -0.667 . . . . 0.0 110.653 179.495 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 368' ' ' TYR . . . . . . . . . . . . . 62.6 t80 -65.66 -37.14 85.68 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.561 179.735 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 369' ' ' VAL . . . . . 0.495 HG22 ' HB2' ' B' ' 336' ' ' GLN . 11.1 t -65.89 -56.52 14.49 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.201 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.511 179.671 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 370' ' ' LEU . . . . . . . . . . . . . 95.0 mt -61.64 -31.74 71.85 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.817 -0.629 . . . . 0.0 110.939 179.958 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 371' ' ' SER . . . . . 0.447 ' HA ' ' HB2' ' B' ' 303' ' ' GLU . 40.7 t -64.76 -52.76 55.26 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.299 -0.409 . . . . 0.0 110.379 179.517 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 372' ' ' SER . . . . . . . . . . . . . 50.3 m -60.59 -32.01 71.13 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.33 179.517 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 373' ' ' MET . . . . . 0.506 ' HG3' ' HD3' ' B' ' 381' ' ' PRO . 54.9 tpp -61.35 -60.63 3.43 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.804 -0.635 . . . . 0.0 110.837 179.622 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 374' ' ' ALA . . . . . . . . . . . . . . . -60.12 -34.17 73.14 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.596 -179.641 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 375' ' ' ARG . . . . . . . . . . . . . 18.9 tpt180 -75.76 -22.43 56.48 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.47 -0.332 . . . . 0.0 110.882 -179.688 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 376' ' ' GLN . . . . . . . . . . . . . 6.2 tp-100 -70.75 -9.44 57.3 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 121.029 0.442 . . . . 0.0 110.431 179.566 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 377' ' ' ARG . . . . . 0.582 ' HG3' ' H ' ' B' ' 382' ' ' ASP . 61.3 ttp180 -60.47 -29.03 68.79 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.862 -0.608 . . . . 0.0 110.92 179.908 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 378' ' ' ARG . . . . . . . . . . . . . 35.2 mmt180 -72.4 -25.26 61.42 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.016 -179.856 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 379' ' ' ALA . . . . . . . . . . . . . . . 58.95 -171.68 0.11 Allowed 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.284 179.975 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 380' ' ' SER . . . . . . . . . . . . . 47.3 t . . . . . 0 C--O 1.25 1.103 0 CA-C-O 118.164 -0.922 . . . . 0.0 110.843 -179.985 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' B' B ' 295' ' ' SER . . . . . . . . . . . . . 47.0 t . . . . . 0 N--CA 1.484 1.267 0 CA-C-O 120.739 0.304 . . . . 0.0 110.845 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' B' B ' 296' ' ' LEU . . . . . . . . . . . . . 5.1 mp 57.48 96.61 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.201 -179.886 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 297' ' ' GLN . . . . . . . . . . . . . 7.5 tp60 59.65 98.65 0.02 OUTLIER 'General case' 0 C--N 1.333 -0.147 0 CA-C-N 116.027 -0.533 . . . . 0.0 111.015 -179.913 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 298' ' ' ASN . . . . . . . . . . . . . 2.9 p-10 -135.96 157.83 45.89 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.066 -179.884 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 299' ' ' ASN . . . . . . . . . . . . . 17.3 m120 -136.86 179.71 6.21 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.086 -0.507 . . . . 0.0 110.969 -179.915 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 300' ' ' GLN . . . . . 0.541 ' HB3' ' HD3' ' B' ' 301' ' ' PRO . 8.9 tt0 -95.46 -48.31 0.26 Allowed Pre-proline 0 CA--C 1.534 0.347 0 CA-C-N 116.277 -0.42 . . . . 0.0 111.646 -179.907 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 301' ' ' PRO . . . . . 0.541 ' HD3' ' HB3' ' B' ' 300' ' ' GLN . 6.2 Cg_exo -78.69 36.74 0.61 Allowed 'Trans proline' 0 C--N 1.352 0.763 0 C-N-CA 122.493 2.129 . . . . 0.0 112.149 179.913 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 302' ' ' VAL . . . . . . . . . . . . . 27.7 m -64.26 -40.63 89.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.596 -179.885 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 303' ' ' GLU . . . . . 0.447 ' HB2' ' HA ' ' A' ' 371' ' ' SER . 5.1 pt-20 -69.42 -46.98 65.51 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.533 -179.505 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 304' ' ' PHE . . . . . . . . . . . . . 89.4 m-85 -64.36 -49.2 72.59 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.776 0.322 . . . . 0.0 111.309 -179.629 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 305' ' ' ASN . . . . . . . . . . . . . 3.4 t-20 -59.89 -53.17 61.05 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.768 -179.322 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 306' ' ' HIS . . . . . 0.41 ' O ' ' HB2' ' B' ' 310' ' ' TYR . 10.5 m-70 -60.7 -56.48 20.79 Favored 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 111.781 0.289 . . . . 0.0 111.781 -179.33 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 307' ' ' ALA . . . . . . . . . . . . . . . -51.9 -61.09 2.48 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 112.16 0.429 . . . . 0.0 112.16 -179.286 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 308' ' ' ILE . . . . . . . . . . . . . 46.9 mm -53.0 -56.68 6.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.504 -0.316 . . . . 0.0 111.841 -179.258 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 309' ' ' ASN . . . . . . . . . . . . . 2.7 t-20 -57.55 -29.22 64.22 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.483 -0.326 . . . . 0.0 111.482 -179.573 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 310' ' ' TYR . . . . . 0.451 ' O ' ' HG3' ' B' ' 313' ' ' LYS . 11.8 t80 -69.34 -59.94 2.67 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.359 -0.382 . . . . 0.0 111.266 -179.451 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 311' ' ' VAL . . . . . . . . . . . . . 36.2 t -62.17 -26.79 41.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.289 -179.483 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 312' ' ' ASN . . . . . . . . . . . . . 6.8 t30 -72.46 -56.68 5.03 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.477 -179.537 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 313' ' ' LYS . . . . . 0.457 ' NZ ' ' HB2' ' B' ' 313' ' ' LYS . 0.0 OUTLIER -61.31 -32.34 72.2 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.38 -0.373 . . . . 0.0 111.551 -179.452 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 314' ' ' ILE . . . . . . . . . . . . . 98.0 mt -76.89 -39.72 30.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.563 -0.29 . . . . 0.0 111.639 -179.74 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 315' ' ' LYS . . . . . 0.408 ' HE3' ' HB3' ' B' ' 315' ' ' LYS . 1.4 tmmt? -65.64 -38.62 89.87 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.522 -0.308 . . . . 0.0 110.937 -179.853 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 316' ' ' ASN . . . . . . . . . . . . . 42.6 t30 -76.31 -51.8 11.24 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.518 -179.466 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 317' ' ' ARG . . . . . . . . . . . . . 19.0 tpp180 -60.27 -62.93 1.5 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.368 -179.6 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 318' ' ' PHE . . . . . . . . . . . . . 66.7 m-85 -86.38 38.43 0.78 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.209 -179.672 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 319' ' ' GLN . . . . . . . . . . . . . 58.1 tt0 -65.54 -29.61 70.26 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.9 179.933 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 320' ' ' GLY . . . . . . . . . . . . . . . -84.82 -2.31 88.62 Favored Glycine 0 N--CA 1.453 -0.23 0 C-N-CA 120.763 -0.732 . . . . 0.0 112.624 -179.732 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 321' ' ' GLN . . . . . . . . . . . . . 24.2 mp0 -109.98 91.73 11.56 Favored Pre-proline 0 C--N 1.33 -0.245 0 CA-C-O 120.502 0.191 . . . . 0.0 110.884 179.944 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 322' ' ' PRO . . . . . . . . . . . . . 97.6 Cg_endo -78.6 -29.03 3.9 Favored 'Trans proline' 0 C--N 1.348 0.511 0 C-N-CA 122.41 2.074 . . . . 0.0 112.59 -179.857 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 323' ' ' ASP . . . . . . . . . . . . . 25.4 t70 -69.15 -46.0 68.66 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.413 -0.358 . . . . 0.0 111.053 -179.829 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 324' ' ' ILE . . . . . . . . . . . . . 75.5 mt -70.87 -42.04 77.26 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.013 179.928 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 325' ' ' TYR . . . . . . . . . . . . . 46.0 t80 -62.96 -50.62 70.06 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.042 -0.527 . . . . 0.0 110.92 179.955 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 326' ' ' LYS . . . . . 0.435 ' HB3' ' NZ ' ' B' ' 326' ' ' LYS . 6.5 ttpm? -61.55 -49.94 74.66 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.101 -179.862 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 327' ' ' ALA . . . . . 0.415 ' HB3' HD11 ' B' ' 365' ' ' LEU . . . -54.33 -47.23 72.73 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.365 -0.379 . . . . 0.0 110.987 179.937 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 328' ' ' PHE . . . . . . . . . . . . . 53.0 t80 -56.5 -51.1 69.79 Favored 'General case' 0 C--O 1.236 0.357 0 CA-C-N 115.969 -0.56 . . . . 0.0 110.633 179.875 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 329' ' ' LEU . . . . . 0.618 HD13 ' HG3' ' A' ' 362' ' ' MET . 92.8 mt -56.45 -34.54 66.95 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.541 179.534 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 330' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -67.65 -37.89 83.04 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.711 179.652 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 331' ' ' ILE . . . . . . . . . . . . . 79.9 mt -62.96 -51.62 69.64 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.161 0 CA-C-N 116.407 -0.36 . . . . 0.0 110.427 179.552 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 332' ' ' LEU . . . . . . . . . . . . . 17.7 mt -66.87 -26.7 67.02 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.73 179.784 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 333' ' ' HIS . . . . . . . . . . . . . 57.0 t-80 -64.12 -60.02 3.73 Favored 'General case' 0 C--O 1.234 0.256 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.199 179.481 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 334' ' ' THR . . . . . . . . . . . . . 80.0 m -58.94 -37.25 76.28 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.253 179.285 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 335' ' ' TYR . . . . . . . . . . . . . 56.4 t80 -60.59 -36.83 79.51 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.091 179.312 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 336' ' ' GLN . . . . . 0.495 ' HB2' HG22 ' A' ' 369' ' ' VAL . 24.7 tt0 -67.9 -51.44 47.99 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.781 179.771 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 337' ' ' LYS . . . . . . . . . . . . . 39.5 ttpt -51.8 -51.67 54.69 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.14 -179.824 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 338' ' ' GLU . . . . . 0.493 ' HG3' ' HB3' ' B' ' 352' ' ' ALA . 27.2 mm-40 -62.75 -39.86 95.45 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.986 -179.886 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 339' ' ' GLN . . . . . 0.467 ' HG3' ' HE2' ' B' ' 343' ' ' LYS . 8.7 tp-100 -61.45 -39.39 90.67 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 121.023 0.439 . . . . 0.0 110.652 179.718 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 340' ' ' ARG . . . . . . . . . . . . . 64.9 mtp180 -64.1 -54.16 38.37 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.589 179.757 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 341' ' ' ASN . . . . . . . . . . . . . 43.7 t-20 -56.7 -32.42 65.47 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.356 179.555 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 342' ' ' ALA . . . . . . . . . . . . . . . -66.3 -46.6 76.37 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.801 179.75 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 343' ' ' LYS . . . . . 0.467 ' HE2' ' HG3' ' B' ' 339' ' ' GLN . 68.5 mttm -66.53 -29.2 69.23 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.845 179.763 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 344' ' ' GLU . . . . . . . . . . . . . 23.9 mm-40 -69.99 -62.01 1.55 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.085 179.941 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 345' ' ' ALA . . . . . . . . . . . . . . . -57.87 -41.78 83.18 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.016 179.943 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 346' ' ' GLY . . . . . . . . . . . . . . . 47.62 38.05 14.35 Favored Glycine 0 C--N 1.331 0.271 0 C-N-CA 121.122 -0.561 . . . . 0.0 112.553 -179.965 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 347' ' ' GLY . . . . . . . . . . . . . . . -134.61 -117.97 1.8 Allowed Glycine 0 N--CA 1.451 -0.334 0 C-N-CA 120.594 -0.812 . . . . 0.0 112.955 -179.638 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 348' ' ' ASN . . . . . . . . . . . . . 18.1 m120 -92.91 2.39 56.81 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.677 0.275 . . . . 0.0 111.444 -179.466 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 349' ' ' TYR . . . . . . . . . . . . . 64.6 t80 -60.95 118.1 6.3 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.411 -0.358 . . . . 0.0 110.961 -179.774 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 350' ' ' THR . . . . . . . . . . . . . 49.1 m -101.76 117.15 62.3 Favored Pre-proline 0 C--N 1.329 -0.311 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.966 179.931 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 351' ' ' PRO . . . . . . . . . . . . . 32.3 Cg_exo -57.74 161.22 12.96 Favored 'Trans proline' 0 C--N 1.349 0.586 0 C-N-CA 122.317 2.011 . . . . 0.0 112.074 179.822 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 352' ' ' ALA . . . . . 0.493 ' HB3' ' HG3' ' B' ' 338' ' ' GLU . . . -86.2 -55.89 3.71 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.211 179.994 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 353' ' ' LEU . . . . . 0.451 HD22 ' HG2' ' B' ' 357' ' ' GLU . 13.6 mt -91.34 125.33 36.06 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.957 0.408 . . . . 0.0 111.241 -179.854 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 354' ' ' THR . . . . . . . . . . . . . 75.2 p -113.27 -173.44 2.26 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.855 -0.612 . . . . 0.0 110.593 179.668 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 355' ' ' GLU . . . . . . . . . . . . . 7.1 pt-20 -60.61 -41.42 94.75 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.951 0.405 . . . . 0.0 110.613 179.585 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 356' ' ' GLN . . . . . . . . . . . . . 14.5 mm100 -71.61 -38.87 70.79 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.866 -0.607 . . . . 0.0 111.225 -179.98 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 357' ' ' GLU . . . . . 0.451 ' HG2' HD22 ' B' ' 353' ' ' LEU . 9.2 tp10 -60.65 -53.85 52.4 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.518 -0.31 . . . . 0.0 110.851 -179.859 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 358' ' ' VAL . . . . . 0.434 ' O ' HG23 ' B' ' 362' ' ' VAL . 59.8 t -62.52 -50.57 79.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.112 -179.936 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 359' ' ' TYR . . . . . . . . . . . . . 65.4 t80 -58.2 -31.01 66.91 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.63 0.253 . . . . 0.0 111.178 -179.719 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 360' ' ' ALA . . . . . . . . . . . . . . . -69.57 -59.7 2.8 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.369 -0.378 . . . . 0.0 111.044 -179.976 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 361' ' ' GLN . . . . . . . . . . . . . 21.7 mt-30 -56.78 -40.59 76.16 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.579 179.861 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 362' ' ' VAL . . . . . 0.434 HG23 ' O ' ' B' ' 358' ' ' VAL . 74.0 t -66.82 -35.43 74.74 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 115.892 -0.595 . . . . 0.0 110.602 179.708 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 363' ' ' ALA . . . . . 0.643 ' HA ' HD21 ' B' ' 373' ' ' LEU . . . -62.39 -50.2 72.49 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.766 179.742 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 364' ' ' ARG . . . . . . . . . . . . . 57.5 mtp180 -73.54 -21.91 60.24 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.523 179.655 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 365' ' ' LEU . . . . . 0.415 HD11 ' HB3' ' B' ' 327' ' ' ALA . 13.9 tp -61.12 -60.89 3.06 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.86 179.978 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 366' ' ' PHE . . . . . 0.613 ' HB3' ' HB2' ' B' ' 369' ' ' GLN . 47.8 m-85 -74.34 -44.85 50.65 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.989 -179.927 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 367' ' ' LYS . . . . . 0.488 ' C ' ' H ' ' B' ' 369' ' ' GLN . 58.9 tttm 65.37 120.9 0.02 OUTLIER 'General case' 0 N--CA 1.465 0.277 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.706 179.359 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 368' ' ' ASN . . . . . . . . . . . . . 12.1 m120 70.3 -34.04 0.28 Allowed 'General case' 0 N--CA 1.463 0.19 0 CA-C-N 116.048 -0.523 . . . . 0.0 111.31 179.707 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 369' ' ' GLN . . . . . 0.613 ' HB2' ' HB3' ' B' ' 366' ' ' PHE . 15.3 mm100 -66.52 90.57 0.16 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.885 0.374 . . . . 0.0 110.532 179.635 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 370' ' ' GLU . . . . . . . . . . . . . 44.1 mt-10 -90.01 -6.21 55.83 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.996 -0.547 . . . . 0.0 111.012 -179.673 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 371' ' ' ASP . . . . . . . . . . . . . 21.4 t70 -67.09 -47.3 71.63 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.073 0.463 . . . . 0.0 110.258 179.494 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 372' ' ' LEU . . . . . 0.479 ' N ' HD12 ' B' ' 372' ' ' LEU . 5.6 mp -72.82 -40.53 65.71 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.779 -0.646 . . . . 0.0 110.111 179.358 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 373' ' ' LEU . . . . . 0.643 HD21 ' HA ' ' B' ' 363' ' ' ALA . 1.1 mp -62.3 -36.1 81.09 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.605 -0.725 . . . . 0.0 110.61 179.647 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 374' ' ' SER . . . . . . . . . . . . . 92.0 p -71.02 -48.93 50.19 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.086 179.433 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 375' ' ' GLU . . . . . . . . . . . . . 43.3 mt-10 -62.97 -23.15 67.29 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.143 179.011 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 376' ' ' PHE . . . . . . . . . . . . . 76.9 t80 -85.13 -29.05 25.13 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.696 -0.684 . . . . 0.0 110.163 179.529 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 377' ' ' GLY . . . . . . . . . . . . . . . -71.45 -41.89 57.26 Favored Glycine 0 C--N 1.331 0.257 0 C-N-CA 120.836 -0.697 . . . . 0.0 112.006 179.465 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 378' ' ' GLN . . . . . . . . . . . . . 4.3 pt20 -70.69 -28.01 64.44 Favored 'General case' 0 C--N 1.331 -0.196 0 N-CA-C 109.224 -0.658 . . . . 0.0 109.224 179.22 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 379' ' ' PHE . . . . . . . . . . . . . 3.7 t80 -82.34 -22.03 35.74 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 114.926 -1.034 . . . . 0.0 109.744 179.05 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 380' ' ' LEU . . . . . . . . . . . . . 18.8 tp -67.79 141.78 95.16 Favored Pre-proline 0 C--N 1.329 -0.306 0 CA-C-N 115.307 -0.86 . . . . 0.0 110.333 179.483 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 381' ' ' PRO . . . . . 0.506 ' HD3' ' HG3' ' A' ' 373' ' ' MET . 74.0 Cg_exo -48.26 149.34 6.44 Favored 'Trans proline' 0 C--N 1.35 0.637 0 C-N-CA 122.187 1.925 . . . . 0.0 112.115 179.911 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 382' ' ' ASP . . . . . 0.582 ' H ' ' HG3' ' A' ' 377' ' ' ARG . 15.6 t70 -82.84 137.99 34.1 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.893 -179.898 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 383' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 1.001 0 CA-C-O 118.248 -0.882 . . . . 0.0 111.069 179.963 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 358' ' ' ASP . . . . . . . . . . . . . 20.7 t70 . . . . . 0 N--CA 1.486 1.325 0 CA-C-O 120.799 0.333 . . . . 0.0 111.065 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 359' ' ' PHE . . . . . . . . . . . . . 71.9 t80 -110.63 142.2 42.81 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.042 -179.801 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 360' ' ' THR . . . . . 0.62 ' H ' ' HD2' ' A' ' 361' ' ' PRO . 62.6 m -155.53 -53.68 0.02 OUTLIER Pre-proline 0 CA--C 1.534 0.341 0 CA-C-N 116.048 -0.524 . . . . 0.0 111.431 179.716 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 361' ' ' PRO . . . . . 0.62 ' HD2' ' H ' ' A' ' 360' ' ' THR . 90.0 Cg_endo -80.7 126.04 5.77 Favored 'Trans proline' 0 C--N 1.353 0.767 0 C-N-CA 122.06 1.84 . . . . 0.0 112.418 179.878 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 362' ' ' MET . . . . . . . . . . . . . 18.3 ttt -68.11 -71.49 0.21 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.758 179.962 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 363' ' ' ASP . . . . . . . . . . . . . 15.6 t70 -173.97 -39.49 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.304 -179.804 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 364' ' ' SER . . . . . . . . . . . . . 54.3 m -106.8 -73.47 0.69 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.792 -0.64 . . . . 0.0 110.463 179.665 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 365' ' ' SER . . . . . 0.446 ' HB2' ' HB2' ' A' ' 368' ' ' TYR . 80.3 p -173.36 77.26 0.04 OUTLIER 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.141 179.737 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 366' ' ' ALA . . . . . . . . . . . . . . . -78.5 -41.26 32.89 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.81 179.646 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 367' ' ' VAL . . . . . . . . . . . . . 23.5 t -65.58 -20.76 27.98 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.697 179.747 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 368' ' ' TYR . . . . . 0.446 ' HB2' ' HB2' ' A' ' 365' ' ' SER . 25.7 t80 -71.01 -49.64 42.88 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.017 -179.808 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 369' ' ' VAL . . . . . 0.461 ' HB ' ' HB2' ' B' ' 336' ' ' GLN . 6.5 p -68.46 -44.46 83.2 Favored 'Isoleucine or valine' 0 C--O 1.233 0.217 0 CA-C-N 116.433 -0.349 . . . . 0.0 110.881 179.908 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 370' ' ' LEU . . . . . 0.41 ' N ' HG13 ' A' ' 369' ' ' VAL . 90.4 mt -60.43 -42.34 95.88 Favored 'General case' 0 C--O 1.233 0.236 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.887 179.807 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 371' ' ' SER . . . . . . . . . . . . . 87.6 p -72.64 -34.94 67.63 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.772 179.863 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 372' ' ' SER . . . . . . . . . . . . . 45.8 t -61.14 -42.81 99.23 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.341 -0.39 . . . . 0.0 111.185 -179.679 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 373' ' ' MET . . . . . 0.435 ' HB2' ' HD3' ' B' ' 381' ' ' PRO . 22.4 ptp -76.71 -38.4 54.41 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.432 -0.349 . . . . 0.0 111.722 -179.419 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 374' ' ' ALA . . . . . 0.483 ' HB3' ' OE1' ' B' ' 303' ' ' GLU . . . -78.62 -13.15 59.97 Favored 'General case' 0 C--N 1.33 -0.25 0 N-CA-C 112.015 0.376 . . . . 0.0 112.015 -179.421 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 375' ' ' ARG . . . . . . . . . . . . . 22.3 ttp180 -100.5 -32.62 10.7 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.823 0.345 . . . . 0.0 110.768 179.635 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 376' ' ' GLN . . . . . . . . . . . . . 6.5 tp-100 -58.69 -24.84 62.1 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.121 -0.491 . . . . 0.0 111.181 -179.94 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 377' ' ' ARG . . . . . 0.645 ' HB3' ' HA ' ' B' ' 381' ' ' PRO . 16.5 ptm180 -62.04 -34.39 76.14 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.885 0.374 . . . . 0.0 110.695 -179.955 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 378' ' ' ARG . . . . . . . . . . . . . 20.5 tpp180 -156.75 107.19 2.33 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.641 179.862 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 379' ' ' ALA . . . . . . . . . . . . . . . -130.5 130.6 44.4 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.082 -0.508 . . . . 0.0 111.129 -179.835 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 380' ' ' SER . . . . . . . . . . . . . 50.9 m . . . . . 0 C--O 1.248 1.023 0 CA-C-O 118.256 -0.878 . . . . 0.0 110.922 179.866 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' B' B ' 295' ' ' SER . . . . . . . . . . . . . 44.8 t . . . . . 0 N--CA 1.486 1.334 0 CA-C-O 120.798 0.332 . . . . 0.0 110.943 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' B' B ' 296' ' ' LEU . . . . . . . . . . . . . 61.7 tp -155.37 -30.41 0.1 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.977 -179.806 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 297' ' ' GLN . . . . . . . . . . . . . 48.2 tt0 -73.41 -36.42 65.99 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.904 179.951 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 298' ' ' ASN . . . . . . . . . . . . . 38.3 m-80 -130.98 101.87 5.8 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.964 -179.976 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 299' ' ' ASN . . . . . . . . . . . . . 2.9 t-20 -166.02 -74.33 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.75 179.874 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 300' ' ' GLN . . . . . . . . . . . . . 3.5 pt20 -169.71 69.45 0.63 Allowed Pre-proline 0 C--N 1.331 -0.215 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.363 179.839 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 301' ' ' PRO . . . . . . . . . . . . . 63.5 Cg_endo -73.35 116.86 4.85 Favored 'Trans proline' 0 C--N 1.346 0.409 0 C-N-CA 122.451 2.101 . . . . 0.0 112.07 179.718 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 302' ' ' VAL . . . . . . . . . . . . . 15.0 p -88.07 -39.52 12.85 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.232 0 CA-C-N 116.323 -0.398 . . . . 0.0 111.293 -179.727 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 303' ' ' GLU . . . . . 0.483 ' OE1' ' HB3' ' A' ' 374' ' ' ALA . 55.3 mm-40 -65.04 -51.13 63.27 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.169 -0.468 . . . . 0.0 111.402 -179.465 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 304' ' ' PHE . . . . . . . . . . . . . 85.6 m-85 -59.99 -57.39 13.07 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.329 -179.815 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 305' ' ' ASN . . . . . . . . . . . . . 6.6 t30 -51.07 -55.16 19.0 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.874 -179.279 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 306' ' ' HIS . . . . . . . . . . . . . 12.2 m-70 -61.24 -64.1 1.07 Allowed 'General case' 0 C--N 1.33 -0.267 0 N-CA-C 112.357 0.503 . . . . 0.0 112.357 -178.947 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 307' ' ' ALA . . . . . . . . . . . . . . . -53.08 -57.13 11.47 Favored 'General case' 0 N--CA 1.464 0.245 0 N-CA-C 112.468 0.544 . . . . 0.0 112.468 -178.736 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 308' ' ' ILE . . . . . 0.578 HG23 HG23 ' A' ' 360' ' ' THR . 87.4 mt -53.58 -53.57 24.5 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 N-CA-C 111.985 0.365 . . . . 0.0 111.985 -179.298 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 309' ' ' ASN . . . . . . . . . . . . . 3.0 t-20 -59.46 -30.44 68.52 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.811 0.338 . . . . 0.0 110.951 -179.706 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 310' ' ' TYR . . . . . . . . . . . . . 74.8 t80 -66.99 -51.57 53.43 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.021 -179.78 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 311' ' ' VAL . . . . . . . . . . . . . 46.2 t -61.19 -52.14 64.89 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.224 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.065 -179.832 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 312' ' ' ASN . . . . . . . . . . . . . 27.6 t-20 -59.37 -34.3 72.24 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.339 -0.392 . . . . 0.0 110.976 -179.951 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 313' ' ' LYS . . . . . . . . . . . . . 39.8 tttp -62.41 -63.14 1.32 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.978 179.957 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 314' ' ' ILE . . . . . . . . . . . . . 97.9 mt -60.28 -27.79 40.35 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.352 -179.792 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 315' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -66.5 -46.34 76.6 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.413 -0.358 . . . . 0.0 110.741 -179.969 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 316' ' ' ASN . . . . . . . . . . . . . 6.7 t30 -72.48 -47.45 48.58 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.264 -179.732 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 317' ' ' ARG . . . . . . . . . . . . . 1.4 tmt_? -62.8 -63.9 1.08 Allowed 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.031 -179.836 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 318' ' ' PHE . . . . . . . . . . . . . 87.0 m-85 -85.11 40.93 0.85 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.121 -0.49 . . . . 0.0 111.043 -179.991 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 319' ' ' GLN . . . . . . . . . . . . . 35.0 tt0 -70.07 -22.61 63.04 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.885 -179.981 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 320' ' ' GLY . . . . . . . . . . . . . . . -86.59 -13.61 67.23 Favored Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.833 -0.699 . . . . 0.0 112.726 -179.793 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 321' ' ' GLN . . . . . . . . . . . . . 22.3 mp0 -110.28 93.41 15.69 Favored Pre-proline 0 C--N 1.329 -0.324 0 CA-C-O 120.416 0.151 . . . . 0.0 110.921 -179.928 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 322' ' ' PRO . . . . . . . . . . . . . 92.1 Cg_endo -79.73 -22.86 7.41 Favored 'Trans proline' 0 C--N 1.348 0.517 0 C-N-CA 122.548 2.165 . . . . 0.0 112.38 179.833 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 323' ' ' ASP . . . . . . . . . . . . . 6.0 m-20 -71.09 -48.01 54.89 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.29 -179.569 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 324' ' ' ILE . . . . . . . . . . . . . 64.0 mt -70.23 -43.07 78.98 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.415 -0.357 . . . . 0.0 111.251 -179.881 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 325' ' ' TYR . . . . . . . . . . . . . 30.8 t80 -62.1 -48.14 81.47 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 120.902 0.382 . . . . 0.0 110.75 179.984 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 326' ' ' LYS . . . . . 0.403 ' O ' ' HG2' ' B' ' 330' ' ' GLU . 87.3 tttt -62.02 -50.11 73.35 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.824 179.896 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 327' ' ' ALA . . . . . 0.412 ' O ' ' HB2' ' B' ' 330' ' ' GLU . . . -54.45 -43.55 71.74 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.185 179.946 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 328' ' ' PHE . . . . . . . . . . . . . 84.5 t80 -59.39 -57.03 14.79 Favored 'General case' 0 C--O 1.235 0.331 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.569 179.927 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 329' ' ' LEU . . . . . . . . . . . . . 91.3 mt -56.85 -28.52 61.78 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.428 179.658 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 330' ' ' GLU . . . . . 0.412 ' HB2' ' O ' ' B' ' 327' ' ' ALA . 22.5 mm-40 -66.52 -44.47 82.37 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.175 179.217 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 331' ' ' ILE . . . . . . . . . . . . . 71.1 mt -61.33 -39.8 83.94 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.12 0 N-CA-C 109.78 -0.452 . . . . 0.0 109.78 178.828 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 332' ' ' LEU . . . . . . . . . . . . . 1.1 mm? -66.61 -36.22 82.07 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.533 -0.758 . . . . 0.0 110.646 179.5 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 333' ' ' HIS . . . . . . . . . . . . . 47.2 t-80 -67.52 -56.44 9.51 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.671 179.731 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 334' ' ' THR . . . . . . . . . . . . . 35.0 m -59.36 -37.78 78.74 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.805 179.697 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 335' ' ' TYR . . . . . . . . . . . . . 32.2 t80 -60.35 -48.34 82.17 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.473 179.554 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 336' ' ' GLN . . . . . 0.461 ' HB2' ' HB ' ' A' ' 369' ' ' VAL . 54.8 tp60 -60.94 -40.22 92.47 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.477 179.535 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 337' ' ' LYS . . . . . 0.459 ' HB3' ' NZ ' ' B' ' 337' ' ' LYS . 4.7 ttpm? -60.11 -47.7 84.8 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.643 179.683 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 338' ' ' GLU . . . . . 0.428 ' HG3' ' HB3' ' B' ' 352' ' ' ALA . 61.6 mm-40 -58.78 -42.02 88.03 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.627 179.572 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 339' ' ' GLN . . . . . . . . . . . . . 29.1 tt0 -61.94 -44.79 96.03 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.707 179.844 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 340' ' ' ARG . . . . . 0.403 ' HE ' HE21 ' B' ' 336' ' ' GLN . 99.7 mtt180 -57.05 -53.78 54.25 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.673 179.825 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 341' ' ' ASN . . . . . . . . . . . . . 45.5 t-20 -55.52 -39.89 71.1 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.557 179.86 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 342' ' ' ALA . . . . . . . . . . . . . . . -60.23 -41.99 94.3 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.843 179.863 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 343' ' ' LYS . . . . . . . . . . . . . 14.5 mptt -74.7 -27.19 60.29 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.847 179.706 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 344' ' ' GLU . . . . . . . . . . . . . 20.2 mm-40 -67.94 -40.05 83.37 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.69 179.556 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 345' ' ' ALA . . . . . . . . . . . . . . . -72.38 -10.03 59.27 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.008 179.748 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 346' ' ' GLY . . . . . . . . . . . . . . . 69.78 32.7 70.47 Favored Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.878 -0.677 . . . . 0.0 112.547 179.947 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 347' ' ' GLY . . . . . . . . . . . . . . . 101.88 -176.98 26.4 Favored Glycine 0 N--CA 1.452 -0.249 0 C-N-CA 120.751 -0.737 . . . . 0.0 112.499 179.997 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 348' ' ' ASN . . . . . . . . . . . . . 56.2 t30 64.39 3.01 1.7 Allowed 'General case' 0 N--CA 1.464 0.238 0 CA-C-O 120.701 0.286 . . . . 0.0 111.335 179.87 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 349' ' ' TYR . . . . . . . . . . . . . 61.8 t80 -103.1 147.71 26.64 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.769 0.319 . . . . 0.0 110.692 179.896 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 350' ' ' THR . . . . . . . . . . . . . 30.5 m -115.38 101.99 54.41 Favored Pre-proline 0 C--N 1.33 -0.279 0 CA-C-N 116.233 -0.439 . . . . 0.0 111.121 -179.919 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 351' ' ' PRO . . . . . . . . . . . . . 58.7 Cg_exo -52.67 141.6 53.07 Favored 'Trans proline' 0 C--N 1.347 0.486 0 C-N-CA 122.52 2.147 . . . . 0.0 112.297 179.75 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 352' ' ' ALA . . . . . 0.428 ' HB3' ' HG3' ' B' ' 338' ' ' GLU . . . -68.12 -23.17 64.87 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.894 179.848 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 353' ' ' LEU . . . . . 0.522 ' HG ' ' HG2' ' B' ' 357' ' ' GLU . 4.7 mp -131.93 124.11 28.77 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.119 -0.492 . . . . 0.0 111.225 179.848 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 354' ' ' THR . . . . . . . . . . . . . 75.6 p -114.76 -170.73 1.8 Allowed 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.716 -0.675 . . . . 0.0 109.594 178.66 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 355' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 -57.87 -35.98 71.71 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.093 0.473 . . . . 0.0 110.063 179.271 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 356' ' ' GLN . . . . . . . . . . . . . 5.9 tp-100 -73.1 -42.6 62.78 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 115.719 -0.673 . . . . 0.0 111.127 179.97 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 357' ' ' GLU . . . . . 0.522 ' HG2' ' HG ' ' B' ' 353' ' ' LEU . 9.4 tp10 -58.97 -56.14 26.14 Favored 'General case' 0 C--O 1.232 0.176 0 CA-C-N 116.479 -0.328 . . . . 0.0 110.893 -179.779 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 358' ' ' VAL . . . . . 0.509 ' O ' HG23 ' B' ' 362' ' ' VAL . 47.1 t -59.61 -55.1 26.11 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.115 179.912 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 359' ' ' TYR . . . . . . . . . . . . . 67.2 t80 -54.92 -29.71 56.86 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.566 -0.288 . . . . 0.0 111.457 -179.551 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 360' ' ' ALA . . . . . . . . . . . . . . . -70.38 -60.83 2.04 Favored 'General case' 0 C--O 1.234 0.281 0 CA-C-N 116.439 -0.346 . . . . 0.0 111.494 -179.745 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 361' ' ' GLN . . . . . . . . . . . . . 97.6 mt-30 -55.79 -40.48 72.73 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.925 0.393 . . . . 0.0 110.792 -179.892 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 362' ' ' VAL . . . . . 0.509 HG23 ' O ' ' B' ' 358' ' ' VAL . 91.2 t -66.38 -38.25 81.39 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.71 179.616 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 363' ' ' ALA . . . . . . . . . . . . . . . -59.42 -42.73 92.53 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 116.257 -0.428 . . . . 0.0 110.383 179.296 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 364' ' ' ARG . . . . . . . . . . . . . 36.3 ttm180 -77.78 -21.99 50.82 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.834 -0.621 . . . . 0.0 110.367 179.264 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 365' ' ' LEU . . . . . . . . . . . . . 10.4 tp -64.26 -29.81 70.89 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.75 -0.659 . . . . 0.0 110.919 179.909 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 366' ' ' PHE . . . . . 0.653 ' HB3' ' HB2' ' B' ' 369' ' ' GLN . 69.4 m-85 -118.32 -59.41 1.89 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.174 -179.824 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 367' ' ' LYS . . . . . . . . . . . . . 39.7 ttpt 68.55 -80.53 0.04 OUTLIER 'General case' 0 N--CA 1.463 0.184 0 CA-C-N 115.948 -0.569 . . . . 0.0 111.595 179.79 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 368' ' ' ASN . . . . . . . . . . . . . 31.2 p-10 -58.47 -17.63 22.44 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.223 -179.477 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 369' ' ' GLN . . . . . 0.653 ' HB2' ' HB3' ' B' ' 366' ' ' PHE . 15.3 mm100 -109.58 97.54 7.08 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.964 -179.999 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 370' ' ' GLU . . . . . . . . . . . . . 44.9 mt-10 -93.91 -11.53 30.81 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.057 179.714 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 371' ' ' ASP . . . . . . . . . . . . . 13.6 m-20 -57.93 -64.12 1.02 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.935 -179.758 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 372' ' ' LEU . . . . . 0.553 HD12 ' N ' ' B' ' 373' ' ' LEU . 0.4 OUTLIER -61.98 -22.57 65.77 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.965 179.824 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' B' B ' 373' ' ' LEU . . . . . 0.553 ' N ' HD12 ' B' ' 372' ' ' LEU . 4.3 tp -68.76 -43.15 76.42 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.3 179.918 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 374' ' ' SER . . . . . . . . . . . . . 53.1 m -69.12 -48.25 62.97 Favored 'General case' 0 C--O 1.236 0.373 0 N-CA-C 109.676 -0.491 . . . . 0.0 109.676 179.053 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 375' ' ' GLU . . . . . . . . . . . . . 42.0 tt0 -56.47 -32.53 65.07 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 115.747 -0.66 . . . . 0.0 109.701 178.989 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 376' ' ' PHE . . . . . . . . . . . . . 93.3 t80 -78.12 -33.44 50.54 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 115.804 -0.635 . . . . 0.0 110.066 179.014 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 377' ' ' GLY . . . . . . . . . . . . . . . -60.52 -36.49 91.45 Favored Glycine 0 N--CA 1.449 -0.467 0 C-N-CA 120.725 -0.75 . . . . 0.0 111.632 179.506 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 378' ' ' GLN . . . . . . . . . . . . . 54.5 mt-30 -56.55 -30.76 63.48 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.666 0.269 . . . . 0.0 110.823 179.464 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 379' ' ' PHE . . . . . . . . . . . . . 78.6 m-85 -66.87 -45.06 79.3 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.392 -0.367 . . . . 0.0 110.85 179.871 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 380' ' ' LEU . . . . . . . . . . . . . 92.5 mt -53.63 132.57 55.4 Favored Pre-proline 0 C--N 1.33 -0.268 0 CA-C-N 116.373 -0.376 . . . . 0.0 110.193 179.451 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 381' ' ' PRO . . . . . 0.645 ' HA ' ' HB3' ' A' ' 377' ' ' ARG . 53.4 Cg_exo -52.33 171.06 0.21 Allowed 'Trans proline' 0 C--N 1.348 0.528 0 C-N-CA 122.263 1.975 . . . . 0.0 112.55 -179.581 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 382' ' ' ASP . . . . . . . . . . . . . 28.5 m-20 -64.18 169.29 4.62 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.943 -179.998 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 383' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.087 0 CA-C-O 118.284 -0.865 . . . . 0.0 111.341 -179.89 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 358' ' ' ASP . . . . . . . . . . . . . 5.3 p-10 . . . . . 0 N--CA 1.487 1.378 0 CA-C-O 120.817 0.341 . . . . 0.0 110.82 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 359' ' ' PHE . . . . . . . . . . . . . 24.7 m-85 -100.22 104.79 16.31 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.145 -179.975 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 360' ' ' THR . . . . . 0.485 ' N ' ' HB2' ' A' ' 364' ' ' SER . 35.7 p -62.31 161.15 27.14 Favored Pre-proline 0 C--N 1.329 -0.305 0 CA-C-N 115.894 -0.594 . . . . 0.0 110.918 179.848 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 361' ' ' PRO . . . . . 0.451 ' HD2' ' HB ' ' A' ' 360' ' ' THR . 89.6 Cg_exo -42.95 -67.16 0.13 Allowed 'Trans proline' 0 C--N 1.35 0.625 0 C-N-CA 122.965 2.444 . . . . 0.0 113.613 -179.667 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 362' ' ' MET . . . . . . . . . . . . . 22.6 ptt? -118.59 -26.46 6.16 Favored 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 111.724 0.268 . . . . 0.0 111.724 -179.474 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 363' ' ' ASP . . . . . 0.455 ' HB2' ' OG1' ' A' ' 360' ' ' THR . 5.7 m-20 -67.62 0.04 3.52 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.571 -0.286 . . . . 0.0 111.175 -179.699 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 364' ' ' SER . . . . . 0.485 ' HB2' ' N ' ' A' ' 360' ' ' THR . 65.8 m -158.15 -23.48 0.08 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.365 -0.38 . . . . 0.0 111.057 179.685 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 365' ' ' SER . . . . . 0.432 ' HB3' ' O ' ' A' ' 361' ' ' PRO . 32.7 t -120.22 44.68 2.38 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.495 -0.32 . . . . 0.0 111.593 -179.498 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 366' ' ' ALA . . . . . 0.55 ' H ' HG11 ' B' ' 311' ' ' VAL . . . -62.47 -10.96 13.38 Favored 'General case' 0 C--O 1.234 0.268 0 CA-C-O 121.127 0.489 . . . . 0.0 110.551 179.036 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 367' ' ' VAL . . . . . 0.654 HG23 ' HB3' ' B' ' 307' ' ' ALA . 8.5 p -47.58 -22.99 0.56 Allowed 'Isoleucine or valine' 0 C--O 1.226 -0.178 0 CA-C-N 115.519 -0.764 . . . . 0.0 111.464 -179.969 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 368' ' ' TYR . . . . . . . . . . . . . 85.6 t80 -61.34 -66.09 0.59 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.896 0.379 . . . . 0.0 110.568 179.548 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 369' ' ' VAL . . . . . 0.51 HG11 ' HB3' ' B' ' 332' ' ' LEU . 4.3 p -58.42 -39.21 73.91 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.622 179.609 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 370' ' ' LEU . . . . . 0.462 HD23 ' HA ' ' B' ' 307' ' ' ALA . 2.7 mp -64.78 -35.91 82.63 Favored 'General case' 0 C--O 1.233 0.222 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.152 179.918 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 371' ' ' SER . . . . . . . . . . . . . 37.6 m -66.56 -44.99 80.82 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.387 -0.369 . . . . 0.0 110.856 -179.935 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 372' ' ' SER . . . . . . . . . . . . . 43.6 t -65.19 -36.28 83.69 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.389 -0.369 . . . . 0.0 110.869 179.724 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 373' ' ' MET . . . . . 0.417 ' SD ' HD23 ' B' ' 380' ' ' LEU . 51.4 ttm -66.0 -43.78 86.74 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.888 -179.42 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 374' ' ' ALA . . . . . . . . . . . . . . . -79.56 -42.16 25.65 Favored 'General case' 0 C--N 1.33 -0.245 0 N-CA-C 112.591 0.589 . . . . 0.0 112.591 -179.023 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 375' ' ' ARG . . . . . 0.501 ' HG2' ' HG2' ' B' ' 303' ' ' GLU . 18.1 mmm180 -66.96 -35.72 80.61 Favored 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 111.905 0.335 . . . . 0.0 111.905 -179.163 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 376' ' ' GLN . . . . . 0.454 ' HG3' ' H ' ' A' ' 378' ' ' ARG . 24.1 tp60 -51.34 -82.45 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.617 -0.265 . . . . 0.0 111.478 -179.554 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 377' ' ' ARG . . . . . 0.518 ' H ' ' HB3' ' B' ' 381' ' ' PRO . 99.5 mtt180 52.24 44.95 29.25 Favored 'General case' 0 C--O 1.232 0.159 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.928 -179.607 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 378' ' ' ARG . . . . . 0.454 ' H ' ' HG3' ' A' ' 376' ' ' GLN . 31.3 tpt180 63.07 -85.15 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 115.804 -0.635 . . . . 0.0 111.175 179.989 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 379' ' ' ALA . . . . . . . . . . . . . . . -145.59 170.7 15.93 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.821 0.343 . . . . 0.0 111.327 -179.843 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 380' ' ' SER . . . . . . . . . . . . . 39.8 t . . . . . 0 C--O 1.25 1.124 0 CA-C-O 118.258 -0.877 . . . . 0.0 111.076 179.903 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' B' B ' 295' ' ' SER . . . . . . . . . . . . . 50.6 m . . . . . 0 N--CA 1.485 1.28 0 CA-C-O 120.597 0.236 . . . . 0.0 110.882 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' B' B ' 296' ' ' LEU . . . . . . . . . . . . . 60.6 tp 62.28 105.47 0.03 OUTLIER 'General case' 0 C--N 1.332 -0.162 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.09 179.987 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 297' ' ' GLN . . . . . . . . . . . . . 14.8 mm100 60.35 -174.58 0.11 Allowed 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.979 179.926 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 298' ' ' ASN . . . . . . . . . . . . . 27.4 t-20 -85.34 108.62 17.91 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.878 179.936 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 299' ' ' ASN . . . . . . . . . . . . . 64.1 t30 -163.63 137.61 5.79 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.666 -179.95 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 300' ' ' GLN . . . . . 0.486 ' N ' ' HD2' ' B' ' 301' ' ' PRO . 15.2 mm100 -80.91 -52.21 0.88 Allowed Pre-proline 0 CA--C 1.534 0.329 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.606 -179.822 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 301' ' ' PRO . . . . . 0.488 ' HB2' ' HB2' ' B' ' 304' ' ' PHE . 56.2 Cg_endo -69.78 127.62 14.84 Favored 'Trans proline' 0 C--N 1.352 0.754 0 C-N-CA 122.068 1.845 . . . . 0.0 112.217 179.983 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 302' ' ' VAL . . . . . 0.499 HG13 ' N ' ' B' ' 303' ' ' GLU . 4.0 p -91.41 -53.15 9.23 Favored 'Isoleucine or valine' 0 C--O 1.234 0.286 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.319 -179.776 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 303' ' ' GLU . . . . . 0.501 ' HG2' ' HG2' ' A' ' 375' ' ' ARG . 0.0 OUTLIER -58.78 -21.84 56.82 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.675 -179.499 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' B' B ' 304' ' ' PHE . . . . . 0.488 ' HB2' ' HB2' ' B' ' 301' ' ' PRO . 73.4 t80 -55.96 -82.22 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.518 -0.31 . . . . 0.0 110.839 -179.763 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 305' ' ' ASN . . . . . . . . . . . . . 8.7 p30 -62.21 -33.58 74.83 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.459 -179.48 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 306' ' ' HIS . . . . . . . . . . . . . 7.8 t-160 -63.31 -71.02 0.18 Allowed 'General case' 0 C--O 1.233 0.221 0 CA-C-O 120.661 0.267 . . . . 0.0 111.651 -179.163 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 307' ' ' ALA . . . . . 0.654 ' HB3' HG23 ' A' ' 367' ' ' VAL . . . -55.51 -47.93 75.45 Favored 'General case' 0 C--N 1.33 -0.266 0 N-CA-C 112.003 0.372 . . . . 0.0 112.003 -179.062 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 308' ' ' ILE . . . . . . . . . . . . . 22.4 mm -53.07 -57.57 4.41 Favored 'Isoleucine or valine' 0 C--O 1.233 0.226 0 CA-C-O 120.669 0.271 . . . . 0.0 111.444 -179.759 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 309' ' ' ASN . . . . . . . . . . . . . 14.0 m120 -61.27 -26.19 67.6 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.404 -0.362 . . . . 0.0 111.236 -179.623 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 310' ' ' TYR . . . . . 0.476 ' OH ' ' HB2' ' B' ' 375' ' ' GLU . 0.3 OUTLIER -71.4 -50.52 31.18 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.567 -0.288 . . . . 0.0 111.327 -179.838 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' B' B ' 311' ' ' VAL . . . . . 0.55 HG11 ' H ' ' A' ' 366' ' ' ALA . 15.2 t -63.46 -39.0 83.69 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.225 0 CA-C-N 116.506 -0.315 . . . . 0.0 111.071 -179.546 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 312' ' ' ASN . . . . . . . . . . . . . 6.7 t30 -69.39 -41.93 75.82 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.145 -179.95 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 313' ' ' LYS . . . . . 0.46 ' NZ ' ' HB3' ' B' ' 313' ' ' LYS . 0.0 OUTLIER -61.32 -46.42 90.36 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.018 -0.537 . . . . 0.0 111.746 -179.631 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' B' B ' 314' ' ' ILE . . . . . . . . . . . . . 79.9 mt -74.71 -36.45 40.37 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 N-CA-C 111.827 0.306 . . . . 0.0 111.827 -179.248 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 315' ' ' LYS . . . . . . . . . . . . . 1.6 tmmt? -67.24 -30.56 70.5 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.551 -0.295 . . . . 0.0 111.243 -179.656 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 316' ' ' ASN . . . . . . . . . . . . . 46.9 t-20 -88.85 -45.04 10.05 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.52 -0.309 . . . . 0.0 111.086 -179.854 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 317' ' ' ARG . . . . . . . . . . . . . 22.5 tpp180 -68.79 -63.86 0.98 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.423 -0.353 . . . . 0.0 111.124 -179.757 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 318' ' ' PHE . . . . . . . . . . . . . 97.2 m-85 -80.13 27.87 0.31 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.139 -179.827 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 319' ' ' GLN . . . . . . . . . . . . . 7.8 tt0 -61.46 -32.23 72.22 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.914 179.992 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 320' ' ' GLY . . . . . . . . . . . . . . . -74.35 -15.85 80.09 Favored Glycine 0 N--CA 1.45 -0.385 0 C-N-CA 120.873 -0.68 . . . . 0.0 112.637 -179.877 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 321' ' ' GLN . . . . . 0.502 HE21 ' H ' ' B' ' 323' ' ' ASP . 24.2 tp60 -109.75 92.68 12.81 Favored Pre-proline 0 C--N 1.33 -0.239 0 CA-C-O 120.401 0.143 . . . . 0.0 110.803 179.914 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 322' ' ' PRO . . . . . . . . . . . . . 90.9 Cg_endo -79.66 -19.01 10.25 Favored 'Trans proline' 0 C--N 1.346 0.426 0 C-N-CA 122.604 2.203 . . . . 0.0 112.723 -179.921 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 323' ' ' ASP . . . . . 0.502 ' H ' HE21 ' B' ' 321' ' ' GLN . 25.9 m-20 -70.05 -54.51 12.78 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.389 -0.369 . . . . 0.0 111.217 -179.652 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 324' ' ' ILE . . . . . 0.474 HD12 ' HG2' ' B' ' 321' ' ' GLN . 56.0 mt -62.05 -47.82 91.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.253 -0.43 . . . . 0.0 111.338 -179.871 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 325' ' ' TYR . . . . . 0.408 ' O ' ' HG ' ' B' ' 329' ' ' LEU . 18.0 t80 -59.35 -51.6 69.24 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.275 -0.42 . . . . 0.0 111.278 -179.51 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 326' ' ' LYS . . . . . . . . . . . . . 87.8 tttt -55.7 -50.41 70.38 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.37 -0.377 . . . . 0.0 111.28 -179.868 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 327' ' ' ALA . . . . . . . . . . . . . . . -52.75 -50.13 64.08 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.083 -179.998 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 328' ' ' PHE . . . . . . . . . . . . . 51.4 t80 -54.59 -43.72 72.37 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.481 179.893 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 329' ' ' LEU . . . . . 0.408 ' HG ' ' O ' ' B' ' 325' ' ' TYR . 86.4 mt -63.07 -36.32 83.18 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.862 -0.608 . . . . 0.0 110.865 179.635 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 330' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -65.09 -37.7 88.35 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.702 179.74 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 331' ' ' ILE . . . . . 0.41 HG22 HG22 ' B' ' 358' ' ' VAL . 72.9 mt -66.91 -52.24 46.41 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.12 179.818 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 332' ' ' LEU . . . . . 0.51 ' HB3' HG11 ' A' ' 369' ' ' VAL . 8.4 mp -64.45 -32.89 74.71 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.233 -0.439 . . . . 0.0 111.339 -179.86 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 333' ' ' HIS . . . . . . . . . . . . . 56.7 t-80 -66.02 -57.81 6.93 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.059 0.457 . . . . 0.0 110.032 179.38 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 334' ' ' THR . . . . . . . . . . . . . 10.8 m -60.1 -26.23 66.05 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.252 179.402 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 335' ' ' TYR . . . . . . . . . . . . . 77.4 t80 -65.98 -49.6 67.28 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.011 179.205 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 336' ' ' GLN . . . . . 0.41 HE21 HG23 ' A' ' 369' ' ' VAL . 47.6 mm-40 -62.53 -33.57 75.17 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.203 179.088 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 337' ' ' LYS . . . . . . . . . . . . . 37.2 ttpt -63.35 -58.98 5.33 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.986 -0.552 . . . . 0.0 111.251 179.682 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 338' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -63.97 -28.91 70.14 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.35 -0.386 . . . . 0.0 111.383 -179.535 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 339' ' ' GLN . . . . . . . . . . . . . 65.5 tt0 -68.16 -49.83 58.44 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.938 0.399 . . . . 0.0 110.573 179.885 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 340' ' ' ARG . . . . . . . . . . . . . 83.1 mtp180 -63.94 -51.72 63.09 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.74 179.781 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 341' ' ' ASN . . . . . . . . . . . . . 4.6 m-20 -52.32 -47.45 65.99 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.076 -0.511 . . . . 0.0 111.06 179.757 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 342' ' ' ALA . . . . . . . . . . . . . . . -67.84 -31.22 70.9 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.892 179.857 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 343' ' ' LYS . . . . . . . . . . . . . 87.3 tttt -75.9 -20.51 57.97 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.611 179.896 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 344' ' ' GLU . . . . . . . . . . . . . 18.5 mm-40 -84.25 -44.26 14.06 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.966 -0.561 . . . . 0.0 111.06 179.949 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 345' ' ' ALA . . . . . . . . . . . . . . . -63.38 -41.93 98.81 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.982 179.929 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 346' ' ' GLY . . . . . . . . . . . . . . . 42.8 47.95 6.11 Favored Glycine 0 C--N 1.333 0.385 0 CA-C-N 115.989 -0.55 . . . . 0.0 112.826 179.874 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 347' ' ' GLY . . . . . . . . . . . . . . . -150.1 -123.74 1.2 Allowed Glycine 0 N--CA 1.45 -0.372 0 C-N-CA 120.585 -0.817 . . . . 0.0 112.974 -179.742 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 348' ' ' ASN . . . . . . . . . . . . . 7.8 t30 -82.34 -14.42 55.34 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.621 0.248 . . . . 0.0 111.488 -179.475 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 349' ' ' TYR . . . . . . . . . . . . . 59.6 t80 -54.52 140.25 35.21 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.84 0.353 . . . . 0.0 111.097 -179.812 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 350' ' ' THR . . . . . . . . . . . . . 43.2 m -117.65 128.86 25.73 Favored Pre-proline 0 C--N 1.329 -0.297 0 CA-C-N 116.055 -0.521 . . . . 0.0 110.593 179.563 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 351' ' ' PRO . . . . . . . . . . . . . 36.2 Cg_exo -59.17 176.31 0.53 Allowed 'Trans proline' 0 C--N 1.349 0.589 0 C-N-CA 122.332 2.021 . . . . 0.0 112.228 -179.624 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 352' ' ' ALA . . . . . . . . . . . . . . . -111.97 -55.66 2.48 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.683 -179.612 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 353' ' ' LEU . . . . . . . . . . . . . 5.3 mp -105.99 111.04 23.51 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.902 0.382 . . . . 0.0 111.491 -179.542 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 354' ' ' THR . . . . . . . . . . . . . 60.9 p -95.94 -170.05 2.05 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.259 179.259 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 355' ' ' GLU . . . . . . . . . . . . . 41.2 mt-10 -62.03 -30.05 70.7 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 120.999 0.428 . . . . 0.0 110.38 179.659 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 356' ' ' GLN . . . . . . . . . . . . . 1.6 mp0 -72.9 -43.29 62.64 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.785 -0.643 . . . . 0.0 111.361 -179.889 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 357' ' ' GLU . . . . . . . . . . . . . 8.4 tp10 -55.98 -48.5 75.72 Favored 'General case' 0 C--O 1.233 0.194 0 CA-C-O 120.903 0.382 . . . . 0.0 110.839 -179.636 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 358' ' ' VAL . . . . . 0.492 ' O ' HG23 ' B' ' 362' ' ' VAL . 86.5 t -68.19 -59.0 4.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.019 -0.537 . . . . 0.0 111.559 -179.63 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 359' ' ' TYR . . . . . . . . . . . . . 40.2 t80 -52.43 -29.67 25.62 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.632 -0.258 . . . . 0.0 111.655 -179.01 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 360' ' ' ALA . . . . . . . . . . . . . . . -74.09 -60.68 2.15 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.847 0.356 . . . . 0.0 111.178 -179.943 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 361' ' ' GLN . . . . . . . . . . . . . 49.9 mt-30 -54.25 -36.96 64.15 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.466 179.842 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 362' ' ' VAL . . . . . 0.492 HG23 ' O ' ' B' ' 358' ' ' VAL . 87.9 t -72.06 -37.79 61.38 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-N 115.868 -0.605 . . . . 0.0 110.341 179.332 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 363' ' ' ALA . . . . . 0.741 ' HA ' HD21 ' B' ' 373' ' ' LEU . . . -57.86 -38.36 75.56 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.572 179.694 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 364' ' ' ARG . . . . . . . . . . . . . 63.3 mtm180 -90.73 -19.35 23.64 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.861 -0.609 . . . . 0.0 110.779 179.519 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 365' ' ' LEU . . . . . . . . . . . . . 24.4 tp -58.16 -37.76 75.32 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.049 -0.523 . . . . 0.0 111.511 -179.705 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 366' ' ' PHE . . . . . . . . . . . . . 75.5 m-85 -98.13 164.25 12.41 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.918 0.39 . . . . 0.0 111.425 -179.504 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 367' ' ' LYS . . . . . 0.422 ' C ' ' H ' ' B' ' 369' ' ' GLN . 65.7 mttm -96.06 87.71 4.64 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.951 -179.893 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 368' ' ' ASN . . . . . . . . . . . . . 2.4 m-20 62.05 -0.49 0.46 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.683 179.675 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 369' ' ' GLN . . . . . 0.422 ' H ' ' C ' ' B' ' 367' ' ' LYS . 8.5 tp60 -63.69 102.84 0.49 Allowed 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.827 0.346 . . . . 0.0 110.158 179.752 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 370' ' ' GLU . . . . . . . . . . . . . 46.3 tt0 -91.82 -25.56 18.94 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.132 -0.485 . . . . 0.0 111.823 -179.048 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 371' ' ' ASP . . . . . . . . . . . . . 19.0 m-20 -49.36 -63.51 1.08 Allowed 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.879 0.371 . . . . 0.0 110.812 -179.989 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 372' ' ' LEU . . . . . 0.446 ' H ' HD12 ' B' ' 372' ' ' LEU . 7.4 mp -55.44 -45.66 76.78 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.695 179.273 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 373' ' ' LEU . . . . . 0.741 HD21 ' HA ' ' B' ' 363' ' ' ALA . 1.2 mp -59.22 -27.13 65.46 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.74 -0.664 . . . . 0.0 111.459 -179.729 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 374' ' ' SER . . . . . . . . . . . . . 67.4 m -77.92 -57.84 3.58 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.84 0.352 . . . . 0.0 110.82 -179.83 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 375' ' ' GLU . . . . . 0.476 ' HB2' ' OH ' ' B' ' 310' ' ' TYR . 10.8 mm-40 -59.87 -28.67 67.74 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.077 -0.511 . . . . 0.0 110.309 179.807 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 376' ' ' PHE . . . . . 0.529 ' HA ' ' HB2' ' B' ' 379' ' ' PHE . 79.2 t80 -83.1 -33.44 26.35 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.144 179.3 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 377' ' ' GLY . . . . . . . . . . . . . . . -60.1 -43.16 98.58 Favored Glycine 0 N--CA 1.45 -0.417 0 C-N-CA 120.747 -0.739 . . . . 0.0 111.384 179.249 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 378' ' ' GLN . . . . . . . . . . . . . 25.2 mm-40 -79.53 -18.04 52.73 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.105 0.479 . . . . 0.0 109.988 179.075 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 379' ' ' PHE . . . . . 0.529 ' HB2' ' HA ' ' B' ' 376' ' ' PHE . 0.6 OUTLIER -63.78 -29.33 70.55 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.642 -0.708 . . . . 0.0 110.287 179.621 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' B' B ' 380' ' ' LEU . . . . . 0.417 HD23 ' SD ' ' A' ' 373' ' ' MET . 42.2 mt -62.93 153.0 81.95 Favored Pre-proline 0 C--N 1.33 -0.242 0 CA-C-N 115.715 -0.675 . . . . 0.0 110.989 -179.87 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 381' ' ' PRO . . . . . 0.518 ' HB3' ' H ' ' A' ' 377' ' ' ARG . 55.0 Cg_endo -70.0 116.27 4.51 Favored 'Trans proline' 0 C--N 1.347 0.474 0 C-N-CA 122.544 2.163 . . . . 0.0 112.301 179.97 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 382' ' ' ASP . . . . . . . . . . . . . 17.5 t70 -87.18 121.61 29.86 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.814 179.983 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 383' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.087 0 CA-C-O 118.219 -0.896 . . . . 0.0 111.054 -179.957 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 358' ' ' ASP . . . . . . . . . . . . . 19.7 t70 . . . . . 0 N--CA 1.486 1.344 0 CA-C-O 120.827 0.346 . . . . 0.0 111.008 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 359' ' ' PHE . . . . . . . . . . . . . 83.6 t80 -135.64 134.62 39.43 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.905 179.909 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 360' ' ' THR . . . . . 0.421 ' HA ' ' HD2' ' A' ' 361' ' ' PRO . 69.2 p -129.75 104.69 17.15 Favored Pre-proline 0 C--N 1.33 -0.27 0 CA-C-N 116.112 -0.495 . . . . 0.0 111.066 -179.991 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 361' ' ' PRO . . . . . 0.421 ' HD2' ' HA ' ' A' ' 360' ' ' THR . 23.4 Cg_endo -61.06 -177.04 0.17 Allowed 'Trans proline' 0 C--N 1.347 0.484 0 C-N-CA 122.558 2.172 . . . . 0.0 112.506 179.971 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 362' ' ' MET . . . . . 0.502 ' SD ' HD13 ' B' ' 329' ' ' LEU . 6.9 tpt -60.67 -71.31 0.14 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.868 179.978 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 363' ' ' ASP . . . . . . . . . . . . . 15.0 t70 -172.45 -55.39 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.606 -179.914 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 364' ' ' SER . . . . . . . . . . . . . 47.2 t -102.08 -76.45 0.57 Allowed 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.978 -0.555 . . . . 0.0 110.709 179.828 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 365' ' ' SER . . . . . . . . . . . . . 70.4 m -160.71 82.64 0.67 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.083 179.852 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 366' ' ' ALA . . . . . . . . . . . . . . . -78.3 -42.65 30.2 Favored 'General case' 0 C--O 1.234 0.269 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.735 179.637 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 367' ' ' VAL . . . . . . . . . . . . . 41.4 t -57.88 -30.2 37.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 115.797 -0.638 . . . . 0.0 110.648 179.688 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 368' ' ' TYR . . . . . . . . . . . . . 84.1 t80 -67.36 -37.11 82.71 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.099 -0.501 . . . . 0.0 110.464 179.578 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 369' ' ' VAL . . . . . . . . . . . . . 10.9 t -68.63 -56.57 11.82 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 115.87 -0.605 . . . . 0.0 110.788 179.704 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 370' ' ' LEU . . . . . 0.534 ' HB2' ' HB1' ' B' ' 307' ' ' ALA . 94.5 mt -58.21 -40.42 81.55 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.925 -0.58 . . . . 0.0 111.092 -179.854 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 371' ' ' SER . . . . . 0.534 ' HA ' ' HB3' ' B' ' 303' ' ' GLU . 84.1 p -60.97 -59.12 5.88 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.092 -179.913 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 372' ' ' SER . . . . . . . . . . . . . 47.1 t -54.54 -33.87 60.82 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.789 0.328 . . . . 0.0 111.201 -179.835 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 373' ' ' MET . . . . . . . . . . . . . 53.9 ttm -64.14 -48.31 76.54 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.515 -179.811 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 374' ' ' ALA . . . . . 0.574 ' HB3' ' HG3' ' B' ' 303' ' ' GLU . . . -87.05 -6.14 58.82 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.488 -0.324 . . . . 0.0 111.852 -179.519 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 375' ' ' ARG . . . . . 0.539 ' HB2' ' HG2' ' B' ' 303' ' ' GLU . 29.6 ttt180 -91.94 -31.17 15.74 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.874 0.369 . . . . 0.0 110.932 -179.861 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 376' ' ' GLN . . . . . . . . . . . . . 52.4 tt0 -67.82 -21.41 65.21 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.004 -0.544 . . . . 0.0 111.779 -179.31 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 377' ' ' ARG . . . . . 0.531 ' HB3' ' HA ' ' B' ' 381' ' ' PRO . 16.1 ptm180 -57.73 -22.45 46.63 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.868 0.366 . . . . 0.0 110.849 -179.95 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 378' ' ' ARG . . . . . . . . . . . . . 41.5 ttm180 -124.82 -66.79 0.95 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.61 179.797 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 379' ' ' ALA . . . . . . . . . . . . . . . 54.82 92.55 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.011 -0.54 . . . . 0.0 111.315 179.926 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 380' ' ' SER . . . . . . . . . . . . . 46.9 t . . . . . 0 C--O 1.25 1.113 0 CA-C-O 118.239 -0.886 . . . . 0.0 110.899 -179.951 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' B' B ' 295' ' ' SER . . . . . . . . . . . . . 44.9 t . . . . . 0 N--CA 1.486 1.369 0 CA-C-O 120.83 0.348 . . . . 0.0 110.911 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' B' B ' 296' ' ' LEU . . . . . 0.418 HD22 ' N ' ' B' ' 296' ' ' LEU . 3.7 mm? -89.89 -40.09 12.63 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.809 179.95 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 297' ' ' GLN . . . . . . . . . . . . . 49.3 mt-30 -115.0 151.33 34.37 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.95 179.974 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 298' ' ' ASN . . . . . . . . . . . . . 6.2 t30 -133.36 99.96 4.68 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.906 -179.893 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 299' ' ' ASN . . . . . . . . . . . . . 6.4 t30 58.64 92.83 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.752 -179.762 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 300' ' ' GLN . . . . . . . . . . . . . 27.7 mt-30 -63.22 139.3 97.53 Favored Pre-proline 0 C--N 1.33 -0.261 0 CA-C-N 116.13 -0.487 . . . . 0.0 111.2 -179.717 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 301' ' ' PRO . . . . . 0.617 ' HB2' ' HB2' ' B' ' 304' ' ' PHE . 73.7 Cg_endo -75.83 138.81 21.52 Favored 'Trans proline' 0 C--N 1.348 0.534 0 C-N-CA 122.381 2.054 . . . . 0.0 112.244 179.786 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 302' ' ' VAL . . . . . 0.434 HG13 ' N ' ' B' ' 303' ' ' GLU . 2.5 p -92.13 -51.72 11.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.108 -0.497 . . . . 0.0 111.4 -179.865 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 303' ' ' GLU . . . . . 0.574 ' HG3' ' HB3' ' A' ' 374' ' ' ALA . 2.4 mp0 -73.7 -43.75 58.41 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.259 -0.428 . . . . 0.0 112.134 -179.244 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 304' ' ' PHE . . . . . 0.617 ' HB2' ' HB2' ' B' ' 301' ' ' PRO . 54.6 m-85 -62.18 -39.92 94.29 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.712 0.292 . . . . 0.0 111.365 -179.589 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 305' ' ' ASN . . . . . . . . . . . . . 6.8 t30 -71.54 -47.31 55.91 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.48 -179.626 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 306' ' ' HIS . . . . . . . . . . . . . 18.5 t-160 -65.51 -40.76 93.38 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.792 0.33 . . . . 0.0 111.214 -179.559 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 307' ' ' ALA . . . . . 0.534 ' HB1' ' HB2' ' A' ' 370' ' ' LEU . . . -65.95 -51.8 55.36 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.685 -179.406 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 308' ' ' ILE . . . . . 0.426 ' O ' HD13 ' B' ' 308' ' ' ILE . 0.0 OUTLIER -58.93 -43.08 87.81 Favored 'Isoleucine or valine' 0 C--O 1.233 0.23 0 CA-C-O 120.724 0.297 . . . . 0.0 110.685 -179.827 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' B' B ' 309' ' ' ASN . . . . . . . . . . . . . 27.0 t-20 -67.32 -30.04 69.77 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.619 179.622 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 310' ' ' TYR . . . . . . . . . . . . . 56.8 t80 -66.11 -52.01 52.65 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.806 179.872 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 311' ' ' VAL . . . . . . . . . . . . . 47.3 t -61.53 -44.0 97.86 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.2 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.83 179.798 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 312' ' ' ASN . . . . . . . . . . . . . 23.5 t-20 -63.74 -33.8 76.47 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.817 179.777 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 313' ' ' LYS . . . . . . . . . . . . . 1.1 tmmt? -64.96 -50.7 65.37 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.895 -179.975 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 314' ' ' ILE . . . . . . . . . . . . . 66.4 mt -71.76 -25.2 23.94 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.264 -179.881 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 315' ' ' LYS . . . . . . . . . . . . . 1.5 tmmt? -71.73 -39.74 69.89 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.875 -179.884 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 316' ' ' ASN . . . . . . . . . . . . . 27.2 t-20 -80.67 -41.68 23.34 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.293 -179.882 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 317' ' ' ARG . . . . . . . . . . . . . 29.1 tpt180 -68.68 -61.89 1.62 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.04 -179.806 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 318' ' ' PHE . . . . . . . . . . . . . 76.4 m-85 -83.67 31.56 0.47 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.089 -179.938 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 319' ' ' GLN . . . . . . . . . . . . . 6.5 tp-100 -62.1 -20.63 64.25 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.264 -0.426 . . . . 0.0 110.646 179.779 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 320' ' ' GLY . . . . . . . . . . . . . . . -92.52 -13.33 57.2 Favored Glycine 0 C--N 1.33 0.204 0 C-N-CA 120.928 -0.653 . . . . 0.0 112.502 179.968 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 321' ' ' GLN . . . . . . . . . . . . . 15.9 mm100 -108.79 92.75 10.96 Favored Pre-proline 0 C--N 1.329 -0.292 0 CA-C-O 120.548 0.213 . . . . 0.0 110.637 179.819 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 322' ' ' PRO . . . . . . . . . . . . . 98.3 Cg_endo -78.97 -26.57 5.24 Favored 'Trans proline' 0 C--N 1.347 0.48 0 C-N-CA 122.537 2.158 . . . . 0.0 112.603 -179.792 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 323' ' ' ASP . . . . . . . . . . . . . 15.7 t70 -68.9 -54.9 12.96 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.123 -179.715 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 324' ' ' ILE . . . . . . . . . . . . . 80.2 mt -64.18 -43.74 97.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.37 -179.949 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 325' ' ' TYR . . . . . . . . . . . . . 16.3 t80 -60.4 -44.67 95.45 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.718 -179.975 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 326' ' ' LYS . . . . . 0.4 ' O ' ' HG2' ' B' ' 330' ' ' GLU . 63.8 tttp -63.29 -50.89 68.33 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.969 179.977 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 327' ' ' ALA . . . . . . . . . . . . . . . -51.86 -49.77 62.25 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.134 -179.951 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 328' ' ' PHE . . . . . . . . . . . . . 69.8 t80 -56.02 -52.92 62.51 Favored 'General case' 0 C--O 1.237 0.401 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.519 179.826 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 329' ' ' LEU . . . . . 0.502 HD13 ' SD ' ' A' ' 362' ' ' MET . 89.9 mt -61.12 -24.19 66.07 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.815 -0.629 . . . . 0.0 110.754 179.8 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 330' ' ' GLU . . . . . 0.4 ' HG2' ' O ' ' B' ' 326' ' ' LYS . 16.3 mm-40 -75.92 -34.27 59.89 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.562 179.49 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 331' ' ' ILE . . . . . . . . . . . . . 80.9 mt -68.89 -44.2 81.84 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.207 0 CA-C-N 116.204 -0.453 . . . . 0.0 109.995 179.183 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 332' ' ' LEU . . . . . . . . . . . . . 45.7 mt -69.31 -39.32 78.33 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.802 -0.636 . . . . 0.0 111.007 179.684 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 333' ' ' HIS . . . . . . . . . . . . . 68.9 t60 -63.69 -51.61 64.29 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.762 179.96 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 334' ' ' THR . . . . . 0.454 ' HA ' ' HZ2' ' B' ' 337' ' ' LYS . 42.1 m -62.28 -35.58 79.46 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.732 179.793 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 335' ' ' TYR . . . . . . . . . . . . . 61.0 t80 -59.31 -62.36 1.94 Allowed 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.075 -0.512 . . . . 0.0 110.825 179.731 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 336' ' ' GLN . . . . . . . . . . . . . 26.0 tp60 -54.15 -42.93 70.14 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.121 -0.49 . . . . 0.0 111.391 -179.683 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 337' ' ' LYS . . . . . 0.454 ' HZ2' ' HA ' ' B' ' 334' ' ' THR . 6.4 ttpm? -53.83 -54.62 35.86 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.892 0.377 . . . . 0.0 111.005 -179.816 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 338' ' ' GLU . . . . . . . . . . . . . 41.6 mt-10 -62.76 -31.58 72.56 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.032 -179.8 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 339' ' ' GLN . . . . . . . . . . . . . 15.8 mm100 -64.99 -47.67 76.7 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.846 0.355 . . . . 0.0 110.546 179.55 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 340' ' ' ARG . . . . . . . . . . . . . 96.0 mtt180 -59.59 -51.39 70.03 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.269 179.38 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 341' ' ' ASN . . . . . . . . . . . . . 2.3 m-20 -59.51 -31.94 69.84 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.366 179.568 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 342' ' ' ALA . . . . . . . . . . . . . . . -70.68 -33.32 70.79 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.938 179.896 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 343' ' ' LYS . . . . . . . . . . . . . 61.3 mttp -79.03 -27.81 43.24 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.882 179.843 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 344' ' ' GLU . . . . . . . . . . . . . 19.9 mm-40 -74.99 -45.31 42.84 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.048 -179.924 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 345' ' ' ALA . . . . . . . . . . . . . . . -66.61 -42.11 87.34 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.991 179.989 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 346' ' ' GLY . . . . . . . . . . . . . . . 46.53 32.68 5.65 Favored Glycine 0 C--N 1.333 0.374 0 C-N-CA 121.135 -0.555 . . . . 0.0 112.81 179.883 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 347' ' ' GLY . . . . . . . . . . . . . . . -127.65 -107.36 1.42 Allowed Glycine 0 N--CA 1.45 -0.368 0 C-N-CA 120.692 -0.766 . . . . 0.0 112.949 -179.701 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 348' ' ' ASN . . . . . . . . . . . . . 62.0 t30 -106.29 -0.75 24.14 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.673 0.273 . . . . 0.0 111.208 -179.459 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 349' ' ' TYR . . . . . . . . . . . . . 41.5 t80 -55.9 116.99 3.28 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.817 -179.887 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 350' ' ' THR . . . . . . . . . . . . . 89.6 m -115.43 114.38 42.76 Favored Pre-proline 0 C--N 1.329 -0.312 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.137 -179.815 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 351' ' ' PRO . . . . . . . . . . . . . 51.6 Cg_exo -53.7 157.8 9.33 Favored 'Trans proline' 0 C--N 1.35 0.657 0 C-N-CA 122.364 2.042 . . . . 0.0 112.218 179.76 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 352' ' ' ALA . . . . . 0.482 ' HB3' HD23 ' B' ' 353' ' ' LEU . . . -81.1 -61.4 1.97 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.564 -179.539 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 353' ' ' LEU . . . . . 0.5 ' HB3' ' HG2' ' B' ' 357' ' ' GLU . 0.2 OUTLIER -106.68 131.6 53.63 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 121.012 0.434 . . . . 0.0 111.414 -179.588 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' B' B ' 354' ' ' THR . . . . . . . . . . . . . 65.2 p -113.84 -160.84 0.74 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.827 -0.624 . . . . 0.0 110.662 179.868 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 355' ' ' GLU . . . . . . . . . . . . . 41.5 mt-10 -57.17 -28.02 62.43 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.412 -0.358 . . . . 0.0 110.876 179.755 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 356' ' ' GLN . . . . . . . . . . . . . 23.6 tm0? -69.86 -50.01 46.82 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.044 -0.525 . . . . 0.0 111.008 -179.77 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 357' ' ' GLU . . . . . 0.5 ' HG2' ' HB3' ' B' ' 353' ' ' LEU . 7.1 tp10 -64.43 -36.97 85.91 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.484 -0.325 . . . . 0.0 110.979 -179.673 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 358' ' ' VAL . . . . . 0.508 ' O ' HG23 ' B' ' 362' ' ' VAL . 48.7 t -64.12 -59.85 3.63 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.981 179.973 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 359' ' ' TYR . . . . . . . . . . . . . 37.3 t80 -59.59 -30.1 68.43 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.474 -0.33 . . . . 0.0 111.331 -179.534 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 360' ' ' ALA . . . . . . . . . . . . . . . -69.75 -60.49 2.28 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.69 0.281 . . . . 0.0 111.324 -179.646 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 361' ' ' GLN . . . . . . . . . . . . . 76.8 mt-30 -56.19 -44.88 79.86 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.235 -0.438 . . . . 0.0 110.903 179.99 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 362' ' ' VAL . . . . . 0.508 HG23 ' O ' ' B' ' 358' ' ' VAL . 64.2 t -64.63 -35.39 74.62 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.716 179.759 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 363' ' ' ALA . . . . . 0.61 ' HA ' HD11 ' B' ' 373' ' ' LEU . . . -61.69 -42.83 99.46 Favored 'General case' 0 CA--C 1.521 -0.171 0 CA-C-O 120.955 0.407 . . . . 0.0 110.263 179.327 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 364' ' ' ARG . . . . . . . . . . . . . 68.2 ttt180 -81.55 -18.23 45.65 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.877 -0.601 . . . . 0.0 110.201 179.42 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 365' ' ' LEU . . . . . 0.402 ' HB2' ' HA ' ' B' ' 362' ' ' VAL . 8.1 tp -60.96 -25.52 66.88 Favored 'General case' 0 C--O 1.232 0.164 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.381 179.659 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 366' ' ' PHE . . . . . . . . . . . . . 60.4 m-85 -125.97 162.21 25.75 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.142 179.546 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 367' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -115.61 -87.8 0.59 Allowed 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 120.753 0.311 . . . . 0.0 111.596 -179.408 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 368' ' ' ASN . . . . . 0.559 HD22 ' N ' ' B' ' 368' ' ' ASN . 0.8 OUTLIER -79.74 -0.95 36.42 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.443 -0.344 . . . . 0.0 111.276 -179.513 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' B' B ' 369' ' ' GLN . . . . . . . . . . . . . 46.9 mt-30 -98.44 84.24 3.17 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.393 -0.367 . . . . 0.0 111.218 -179.896 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 370' ' ' GLU . . . . . . . . . . . . . 44.7 mt-10 -93.9 -6.01 46.6 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.759 179.671 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 371' ' ' ASP . . . . . . . . . . . . . 19.9 t70 -57.71 -62.03 2.09 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.004 -179.812 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 372' ' ' LEU . . . . . 0.564 HD12 ' N ' ' B' ' 373' ' ' LEU . 0.3 OUTLIER -64.32 -22.51 66.97 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.257 -0.428 . . . . 0.0 111.114 179.87 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' B' B ' 373' ' ' LEU . . . . . 0.61 HD11 ' HA ' ' B' ' 363' ' ' ALA . 5.3 tp -71.53 -38.12 71.11 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.535 -179.793 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 374' ' ' SER . . . . . . . . . . . . . 48.9 m -73.66 -48.27 33.59 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.08 -0.509 . . . . 0.0 109.767 179.074 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 375' ' ' GLU . . . . . . . . . . . . . 8.5 tp10 -55.58 -38.52 69.48 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.677 -0.692 . . . . 0.0 109.813 179.133 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 376' ' ' PHE . . . . . 0.444 ' O ' ' HB2' ' B' ' 379' ' ' PHE . 76.0 t80 -75.2 -32.73 61.29 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 115.861 -0.609 . . . . 0.0 109.903 179.15 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 377' ' ' GLY . . . . . . . . . . . . . . . -60.11 -33.11 78.18 Favored Glycine 0 N--CA 1.449 -0.486 0 C-N-CA 120.606 -0.807 . . . . 0.0 111.259 179.054 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 378' ' ' GLN . . . . . . . . . . . . . 26.8 mm-40 -67.98 -31.92 71.96 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.751 0.31 . . . . 0.0 110.881 179.318 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 379' ' ' PHE . . . . . 0.444 ' HB2' ' O ' ' B' ' 376' ' ' PHE . 15.1 m-85 -56.57 -41.13 76.39 Favored 'General case' 0 C--N 1.334 -0.105 0 CA-C-N 116.319 -0.4 . . . . 0.0 110.943 179.71 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 380' ' ' LEU . . . . . . . . . . . . . 96.0 mt -56.38 131.1 76.16 Favored Pre-proline 0 C--N 1.329 -0.302 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.633 179.824 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 381' ' ' PRO . . . . . 0.531 ' HA ' ' HB3' ' A' ' 377' ' ' ARG . 54.3 Cg_exo -51.3 144.51 30.32 Favored 'Trans proline' 0 C--N 1.347 0.473 0 C-N-CA 122.355 2.037 . . . . 0.0 112.337 -179.955 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 382' ' ' ASP . . . . . . . . . . . . . 15.4 t70 -96.56 122.19 39.21 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.742 179.977 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 383' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.031 0 CA-C-O 118.263 -0.875 . . . . 0.0 111.098 -179.932 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 358' ' ' ASP . . . . . . . . . . . . . 17.0 t70 . . . . . 0 N--CA 1.487 1.383 0 CA-C-O 120.804 0.335 . . . . 0.0 110.923 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 359' ' ' PHE . . . . . . . . . . . . . 69.4 m-85 -82.28 117.99 22.8 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.04 179.982 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 360' ' ' THR . . . . . 0.515 ' HB ' ' HD3' ' A' ' 361' ' ' PRO . 91.1 m -91.67 -47.17 0.34 Allowed Pre-proline 0 C--N 1.328 -0.328 0 CA-C-N 115.972 -0.558 . . . . 0.0 111.698 179.932 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 361' ' ' PRO . . . . . 0.515 ' HD3' ' HB ' ' A' ' 360' ' ' THR . 73.4 Cg_exo -50.28 -50.22 14.13 Favored 'Trans proline' 0 C--N 1.354 0.865 0 C-N-CA 122.204 1.936 . . . . 0.0 112.663 -179.988 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 362' ' ' MET . . . . . 0.582 ' SD ' HD23 ' B' ' 329' ' ' LEU . 4.4 tpt -57.45 -71.92 0.09 Allowed 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 120.937 0.399 . . . . 0.0 110.517 179.764 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 363' ' ' ASP . . . . . . . . . . . . . 16.9 t70 175.08 -60.34 0.01 OUTLIER 'General case' 0 C--N 1.333 -0.135 0 CA-C-N 115.667 -0.697 . . . . 0.0 109.949 -179.809 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 364' ' ' SER . . . . . . . . . . . . . 79.7 p -134.75 -60.26 0.79 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.603 -0.726 . . . . 0.0 110.296 179.445 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 365' ' ' SER . . . . . . . . . . . . . 48.2 t -175.24 100.9 0.08 Allowed 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.026 -0.534 . . . . 0.0 111.045 179.674 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 366' ' ' ALA . . . . . 0.53 ' HB2' ' HG2' ' A' ' 362' ' ' MET . . . -74.09 -13.55 60.85 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 121.013 0.435 . . . . 0.0 110.686 179.59 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 367' ' ' VAL . . . . . . . . . . . . . 61.8 t -53.7 -31.23 19.71 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 115.706 -0.679 . . . . 0.0 111.452 -179.885 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 368' ' ' TYR . . . . . . . . . . . . . 65.8 m-85 -60.39 -50.4 73.75 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.758 0.313 . . . . 0.0 111.32 -179.929 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 369' ' ' VAL . . . . . 0.643 HG13 ' HG2' ' B' ' 336' ' ' GLN . 24.0 t -67.93 -52.35 40.27 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.568 -179.534 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 370' ' ' LEU . . . . . 0.547 HD13 ' HA ' ' B' ' 307' ' ' ALA . 86.9 mt -55.93 -46.51 78.45 Favored 'General case' 0 C--O 1.235 0.341 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.215 -179.808 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 371' ' ' SER . . . . . . . . . . . . . 45.8 t -60.04 -59.42 5.45 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.089 -179.949 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 372' ' ' SER . . . . . . . . . . . . . 50.6 m -51.06 -35.02 32.48 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.459 -0.337 . . . . 0.0 111.468 -179.616 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 373' ' ' MET . . . . . . . . . . . . . 54.1 tpp -65.0 -56.18 14.63 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.419 -0.355 . . . . 0.0 111.599 -179.441 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 374' ' ' ALA . . . . . 0.52 ' HB3' ' OE1' ' B' ' 303' ' ' GLU . . . -80.96 -6.15 58.38 Favored 'General case' 0 C--N 1.33 -0.267 0 N-CA-C 112.256 0.465 . . . . 0.0 112.256 -178.885 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 375' ' ' ARG . . . . . . . . . . . . . 32.7 tpt180 -96.65 -27.31 14.85 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 120.611 0.243 . . . . 0.0 111.263 -179.688 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 376' ' ' GLN . . . . . . . . . . . . . 7.5 mm100 -65.02 -9.55 22.78 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.466 -0.334 . . . . 0.0 111.435 -179.961 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 377' ' ' ARG . . . . . . . . . . . . . 14.9 ptp180 -59.14 -38.26 79.23 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.463 -0.335 . . . . 0.0 110.854 179.905 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 378' ' ' ARG . . . . . . . . . . . . . 99.3 mtt180 -144.25 143.89 31.25 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.74 179.791 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 379' ' ' ALA . . . . . . . . . . . . . . . -89.5 -47.97 7.63 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.105 179.98 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 380' ' ' SER . . . . . . . . . . . . . 59.3 p . . . . . 0 C--O 1.249 1.067 0 CA-C-O 118.201 -0.904 . . . . 0.0 110.941 -179.965 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' B' B ' 295' ' ' SER . . . . . . . . . . . . . 78.8 p . . . . . 0 N--CA 1.486 1.375 0 CA-C-O 120.822 0.344 . . . . 0.0 110.834 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' B' B ' 296' ' ' LEU . . . . . 0.443 HD22 ' N ' ' B' ' 296' ' ' LEU . 3.4 mm? -80.35 -33.4 37.39 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.77 -179.979 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 297' ' ' GLN . . . . . . . . . . . . . 24.2 mt-30 57.28 -169.03 0.11 Allowed 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.075 -179.969 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 298' ' ' ASN . . . . . . . . . . . . . 16.1 m120 -119.87 -52.07 2.23 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.144 -179.891 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 299' ' ' ASN . . . . . . . . . . . . . 17.1 m120 -87.39 169.38 12.31 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.27 -179.915 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 300' ' ' GLN . . . . . . . . . . . . . 83.9 mm-40 -137.23 149.91 67.4 Favored Pre-proline 0 C--N 1.33 -0.269 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.905 179.96 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 301' ' ' PRO . . . . . 0.467 ' HB2' ' HB2' ' B' ' 304' ' ' PHE . 31.2 Cg_exo -61.01 130.93 34.57 Favored 'Trans proline' 0 C--N 1.348 0.528 0 C-N-CA 122.439 2.093 . . . . 0.0 111.898 179.788 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 302' ' ' VAL . . . . . . . . . . . . . 7.3 p -89.76 -41.0 13.46 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.296 -179.728 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 303' ' ' GLU . . . . . 0.52 ' OE1' ' HB3' ' A' ' 374' ' ' ALA . 55.8 mm-40 -70.33 -45.58 65.9 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.178 -0.464 . . . . 0.0 111.41 -179.44 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 304' ' ' PHE . . . . . 0.467 ' HB2' ' HB2' ' B' ' 301' ' ' PRO . 89.7 m-85 -64.35 -50.24 68.52 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.098 -179.7 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 305' ' ' ASN . . . . . . . . . . . . . 27.7 t-20 -58.18 -54.47 46.58 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.436 -179.613 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 306' ' ' HIS . . . . . . . . . . . . . 9.8 m-70 -59.48 -61.26 2.76 Favored 'General case' 0 C--N 1.331 -0.234 0 N-CA-C 112.012 0.375 . . . . 0.0 112.012 -179.327 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 307' ' ' ALA . . . . . 0.547 ' HA ' HD13 ' A' ' 370' ' ' LEU . . . -52.7 -60.52 3.15 Favored 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 112.492 0.553 . . . . 0.0 112.492 -178.798 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 308' ' ' ILE . . . . . . . . . . . . . 90.9 mt -51.55 -54.28 12.9 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.218 0 N-CA-C 111.647 0.24 . . . . 0.0 111.647 -179.26 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 309' ' ' ASN . . . . . 0.578 ' N ' HD22 ' B' ' 309' ' ' ASN . 0.8 OUTLIER -62.52 -24.07 67.3 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.456 -0.338 . . . . 0.0 111.09 -179.744 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' B' B ' 310' ' ' TYR . . . . . . . . . . . . . 34.3 t80 -69.3 -58.92 3.4 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.424 -0.353 . . . . 0.0 111.093 -179.693 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 311' ' ' VAL . . . . . 0.431 ' O ' ' HG3' ' B' ' 315' ' ' LYS . 27.1 t -58.94 -44.83 91.84 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.117 0 CA-C-O 120.816 0.341 . . . . 0.0 110.514 179.9 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 312' ' ' ASN . . . . . . . . . . . . . 2.9 t-20 -57.96 -41.59 83.19 Favored 'General case' 0 C--O 1.232 0.179 0 CA-C-O 121.005 0.431 . . . . 0.0 110.631 179.641 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 313' ' ' LYS . . . . . . . . . . . . . 37.4 tttt -59.06 -60.01 4.55 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.771 -0.649 . . . . 0.0 111.123 179.703 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 314' ' ' ILE . . . . . . . . . . . . . 19.9 mt -59.61 -27.47 37.68 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 115.778 -0.646 . . . . 0.0 111.708 -179.04 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 315' ' ' LYS . . . . . 0.481 ' HZ2' ' HB2' ' B' ' 315' ' ' LYS . 8.7 mtmp? -71.59 -40.4 69.9 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.805 0.335 . . . . 0.0 110.805 179.681 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 316' ' ' ASN . . . . . . . . . . . . . 58.8 t30 -84.75 -12.88 52.81 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.772 179.912 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 317' ' ' ARG . . . . . 0.452 HH21 HE22 ' B' ' 369' ' ' GLN . 29.8 tpt180 -90.3 -66.63 0.91 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.798 179.814 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 318' ' ' PHE . . . . . . . . . . . . . 96.7 m-85 -88.28 39.68 0.92 Allowed 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.788 179.862 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 319' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -61.13 -9.17 4.23 Favored 'General case' 0 N--CA 1.45 -0.467 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.532 -179.785 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 320' ' ' GLY . . . . . . . . . . . . . . . -96.23 -40.25 4.04 Favored Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.83 -0.7 . . . . 0.0 112.901 179.968 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 321' ' ' GLN . . . . . . . . . . . . . 6.2 tp-100 -105.88 98.08 17.19 Favored Pre-proline 0 C--N 1.33 -0.242 0 CA-C-O 120.418 0.151 . . . . 0.0 110.925 -179.82 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 322' ' ' PRO . . . . . . . . . . . . . 93.2 Cg_endo -80.43 -13.36 12.27 Favored 'Trans proline' 0 C--N 1.348 0.552 0 C-N-CA 122.472 2.115 . . . . 0.0 112.533 179.913 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 323' ' ' ASP . . . . . . . . . . . . . 14.7 t70 -65.87 -55.11 18.73 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.007 179.992 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 324' ' ' ILE . . . . . . . . . . . . . 61.1 mt -63.32 -37.93 80.81 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.936 179.899 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 325' ' ' TYR . . . . . 0.415 ' O ' HD13 ' B' ' 329' ' ' LEU . 55.7 t80 -60.21 -58.39 8.71 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.657 179.766 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 326' ' ' LYS . . . . . 0.407 ' HG2' ' OE1' ' B' ' 330' ' ' GLU . 38.2 ttmt -58.89 -40.76 85.39 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.835 -0.62 . . . . 0.0 110.993 179.994 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 327' ' ' ALA . . . . . . . . . . . . . . . -55.47 -50.48 69.76 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-O 120.891 0.376 . . . . 0.0 110.991 -179.917 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 328' ' ' PHE . . . . . . . . . . . . . 24.4 t80 -57.42 -57.46 12.56 Favored 'General case' 0 C--O 1.239 0.504 0 CA-C-O 121.334 0.587 . . . . 0.0 110.189 179.637 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 329' ' ' LEU . . . . . 0.582 HD23 ' SD ' ' A' ' 362' ' ' MET . 10.5 mp -59.13 -20.31 52.55 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.523 -0.762 . . . . 0.0 110.904 -179.989 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 330' ' ' GLU . . . . . 0.407 ' OE1' ' HG2' ' B' ' 326' ' ' LYS . 21.8 mt-10 -77.84 -35.68 50.85 Favored 'General case' 0 C--N 1.332 -0.158 0 N-CA-C 109.829 -0.434 . . . . 0.0 109.829 178.825 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 331' ' ' ILE . . . . . . . . . . . . . 96.8 mt -64.93 -44.25 96.16 Favored 'Isoleucine or valine' 0 C--O 1.233 0.189 0 N-CA-C 109.312 -0.625 . . . . 0.0 109.312 178.524 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 332' ' ' LEU . . . . . 0.526 ' HB3' HG11 ' A' ' 369' ' ' VAL . 8.9 mp -68.62 -41.03 80.06 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.621 -0.718 . . . . 0.0 110.783 179.225 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 333' ' ' HIS . . . . . . . . . . . . . 42.5 t-80 -59.68 -53.93 52.3 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.309 179.752 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 334' ' ' THR . . . . . . . . . . . . . 93.1 m -60.92 -33.16 72.72 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.277 179.143 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 335' ' ' TYR . . . . . 0.441 ' HB3' ' O ' ' B' ' 332' ' ' LEU . 74.2 t80 -55.65 -65.35 0.61 Allowed 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.646 179.463 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 336' ' ' GLN . . . . . 0.643 ' HG2' HG13 ' A' ' 369' ' ' VAL . 63.9 mm-40 -65.18 -22.3 66.88 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.36 -0.382 . . . . 0.0 111.018 179.846 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 337' ' ' LYS . . . . . . . . . . . . . 61.0 tttp -61.32 -65.67 0.66 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.382 -0.372 . . . . 0.0 110.424 179.695 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 338' ' ' GLU . . . . . . . . . . . . . 42.9 mt-10 -63.51 -33.88 76.55 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.53 179.53 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 339' ' ' GLN . . . . . . . . . . . . . 7.7 tp60 -57.38 -53.91 52.75 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.532 179.609 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 340' ' ' ARG . . . . . . . . . . . . . 99.7 mtt180 -59.28 -50.87 72.33 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.372 179.484 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 341' ' ' ASN . . . . . . . . . . . . . 13.8 m120 -56.09 -26.82 51.15 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.861 179.637 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 342' ' ' ALA . . . . . . . . . . . . . . . -74.44 -46.7 38.23 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.056 179.948 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 343' ' ' LYS . . . . . . . . . . . . . 14.2 mptt -76.37 -12.63 60.09 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.068 179.738 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 344' ' ' GLU . . . . . . . . . . . . . 23.2 mm-40 -89.08 -40.92 12.61 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.925 179.742 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 345' ' ' ALA . . . . . . . . . . . . . . . -71.96 -41.54 67.62 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.936 179.937 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 346' ' ' GLY . . . . . . . . . . . . . . . 53.33 31.4 42.5 Favored Glycine 0 C--N 1.331 0.288 0 C-N-CA 121.003 -0.618 . . . . 0.0 112.591 179.906 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 347' ' ' GLY . . . . . . . . . . . . . . . -129.89 -119.82 2.18 Favored Glycine 0 N--CA 1.45 -0.407 0 C-N-CA 120.737 -0.744 . . . . 0.0 112.805 -179.927 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 348' ' ' ASN . . . . . . . . . . . . . 14.8 m120 -90.65 -8.25 50.51 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.555 0.217 . . . . 0.0 111.423 -179.532 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 349' ' ' TYR . . . . . . . . . . . . . 31.2 t80 -58.73 128.32 36.62 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 120.828 0.347 . . . . 0.0 110.912 -179.719 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 350' ' ' THR . . . . . 0.409 ' HA ' ' HD3' ' B' ' 351' ' ' PRO . 30.6 m -132.42 130.19 21.76 Favored Pre-proline 0 C--N 1.329 -0.307 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.773 179.83 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 351' ' ' PRO . . . . . 0.409 ' HD3' ' HA ' ' B' ' 350' ' ' THR . 26.3 Cg_exo -62.33 174.98 2.3 Favored 'Trans proline' 0 C--N 1.35 0.622 0 C-N-CA 122.433 2.089 . . . . 0.0 112.334 -179.733 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 352' ' ' ALA . . . . . . . . . . . . . . . -104.38 -71.11 0.75 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.486 -179.911 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 353' ' ' LEU . . . . . 0.571 ' HB3' ' HG2' ' B' ' 357' ' ' GLU . 0.3 OUTLIER -92.6 145.7 24.23 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 121.464 0.649 . . . . 0.0 112.398 -179.392 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' B' B ' 354' ' ' THR . . . . . . . . . . . . . 81.4 p -115.14 -166.65 1.14 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.447 -0.797 . . . . 0.0 110.333 179.34 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 355' ' ' GLU . . . . . . . . . . . . . 37.5 mt-10 -59.89 -33.09 71.38 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 121.155 0.503 . . . . 0.0 110.271 179.418 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 356' ' ' GLN . . . . . . . . . . . . . 26.2 mp0 -70.17 -44.81 67.99 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.695 -0.684 . . . . 0.0 111.176 -179.78 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 357' ' ' GLU . . . . . 0.571 ' HG2' ' HB3' ' B' ' 353' ' ' LEU . 6.5 tp10 -61.68 -44.0 97.78 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-O 120.706 0.289 . . . . 0.0 110.534 -179.984 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 358' ' ' VAL . . . . . . . . . . . . . 87.0 t -59.76 -54.57 32.79 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.633 179.499 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 359' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -60.99 -28.03 68.73 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.864 -179.869 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 360' ' ' ALA . . . . . . . . . . . . . . . -72.4 -60.98 1.96 Allowed 'General case' 0 C--O 1.233 0.22 0 CA-C-N 116.41 -0.359 . . . . 0.0 111.273 -179.767 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 361' ' ' GLN . . . . . 0.41 ' O ' ' HB2' ' B' ' 365' ' ' LEU . 47.3 mt-30 -58.96 -34.0 71.28 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.438 179.855 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 362' ' ' VAL . . . . . . . . . . . . . 11.5 t -69.99 -40.16 78.26 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 115.826 -0.625 . . . . 0.0 110.785 179.577 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 363' ' ' ALA . . . . . 0.587 ' HA ' HD21 ' B' ' 373' ' ' LEU . . . -62.14 -38.73 90.09 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.39 179.488 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 364' ' ' ARG . . . . . . . . . . . . . 64.9 ttt180 -83.63 -19.35 35.59 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.252 179.141 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 365' ' ' LEU . . . . . 0.41 ' HB2' ' O ' ' B' ' 361' ' ' GLN . 13.2 tp -58.89 -34.62 71.87 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.853 -179.959 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 366' ' ' PHE . . . . . 0.49 ' HB3' ' HB2' ' B' ' 369' ' ' GLN . 59.7 m-85 -117.25 164.66 14.48 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.732 179.983 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 367' ' ' LYS . . . . . . . . . . . . . 60.9 mttp -116.54 -75.15 0.58 Allowed 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.931 179.915 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 368' ' ' ASN . . . . . . . . . . . . . 15.9 m120 -87.48 -3.98 59.0 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.78 -179.956 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 369' ' ' GLN . . . . . 0.49 ' HB2' ' HB3' ' B' ' 366' ' ' PHE . 17.7 mm-40 -97.3 83.01 3.22 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.025 -179.867 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 370' ' ' GLU . . . . . . . . . . . . . 40.2 tt0 -93.41 -15.61 25.47 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.629 179.648 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 371' ' ' ASP . . . . . . . . . . . . . 7.3 m-20 -55.36 -39.13 69.71 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.94 -0.573 . . . . 0.0 111.122 -179.9 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 372' ' ' LEU . . . . . 0.405 ' N ' HD12 ' B' ' 372' ' ' LEU . 6.1 mp -71.3 -38.88 71.73 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.772 179.844 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 373' ' ' LEU . . . . . 0.587 HD21 ' HA ' ' B' ' 363' ' ' ALA . 3.0 mp -56.74 -50.52 71.99 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.997 -0.547 . . . . 0.0 111.028 179.885 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 374' ' ' SER . . . . . . . . . . . . . 41.7 t -69.6 -48.0 61.58 Favored 'General case' 0 C--O 1.235 0.329 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.616 179.651 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 375' ' ' GLU . . . . . 0.427 ' O ' ' HG2' ' B' ' 378' ' ' GLN . 40.9 tt0 -54.67 -29.63 53.29 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 115.857 -0.611 . . . . 0.0 110.108 179.642 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 376' ' ' PHE . . . . . 0.446 ' O ' ' HB2' ' B' ' 379' ' ' PHE . 90.4 t80 -87.18 -27.68 22.88 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.934 -0.576 . . . . 0.0 110.004 178.71 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 377' ' ' GLY . . . . . . . . . . . . . . . -61.41 -38.67 96.12 Favored Glycine 0 N--CA 1.45 -0.376 0 C-N-CA 120.884 -0.674 . . . . 0.0 112.342 179.749 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 378' ' ' GLN . . . . . 0.427 ' HG2' ' O ' ' B' ' 375' ' ' GLU . 13.4 pt20 -63.31 -26.6 68.84 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.524 0.202 . . . . 0.0 111.053 179.731 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 379' ' ' PHE . . . . . 0.446 ' HB2' ' O ' ' B' ' 376' ' ' PHE . 29.3 m-85 -62.02 -33.96 75.32 Favored 'General case' 0 C--N 1.333 -0.122 0 CA-C-N 116.607 -0.269 . . . . 0.0 110.855 179.681 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 380' ' ' LEU . . . . . . . . . . . . . 79.3 mt -53.95 133.77 58.04 Favored Pre-proline 0 C--N 1.33 -0.26 0 CA-C-N 116.334 -0.393 . . . . 0.0 110.328 179.938 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 381' ' ' PRO . . . . . . . . . . . . . 64.1 Cg_exo -51.13 127.13 20.87 Favored 'Trans proline' 0 C--N 1.347 0.483 0 C-N-CA 122.434 2.089 . . . . 0.0 112.353 -179.596 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 382' ' ' ASP . . . . . . . . . . . . . 5.7 m-20 -96.83 128.78 44.12 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.875 -179.945 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 383' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.115 0 CA-C-O 118.34 -0.838 . . . . 0.0 111.258 179.947 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 358' ' ' ASP . . . . . . . . . . . . . 22.6 t70 . . . . . 0 N--CA 1.486 1.347 0 CA-C-O 120.714 0.292 . . . . 0.0 111.026 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 359' ' ' PHE . . . . . . . . . . . . . 11.0 p90 -86.26 -171.03 3.36 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.811 -179.897 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 360' ' ' THR . . . . . . . . . . . . . 80.7 p -120.35 117.69 31.59 Favored Pre-proline 0 C--N 1.33 -0.246 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.152 179.97 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 361' ' ' PRO . . . . . . . . . . . . . 28.5 Cg_exo -62.07 169.43 7.61 Favored 'Trans proline' 0 C--N 1.348 0.54 0 C-N-CA 122.326 2.018 . . . . 0.0 112.026 179.746 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 362' ' ' MET . . . . . 0.573 ' HG3' ' HB3' ' B' ' 329' ' ' LEU . 1.6 tmt? -74.85 -71.94 0.32 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.306 -0.406 . . . . 0.0 111.053 -179.947 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 363' ' ' ASP . . . . . . . . . . . . . 21.8 t70 177.25 142.02 0.08 Allowed 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 115.664 -0.698 . . . . 0.0 109.886 -179.899 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 364' ' ' SER . . . . . . . . . . . . . 49.8 m 56.8 23.23 7.79 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.966 0.412 . . . . 0.0 110.209 -179.495 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 365' ' ' SER . . . . . . . . . . . . . 39.7 t 63.73 93.35 0.06 Allowed 'General case' 0 C--O 1.232 0.172 0 CA-C-N 115.646 -0.706 . . . . 0.0 111.309 -179.996 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 366' ' ' ALA . . . . . 0.439 ' HB2' ' HB3' ' A' ' 362' ' ' MET . . . -74.47 -26.27 59.92 Favored 'General case' 0 C--O 1.234 0.289 0 CA-C-O 121.095 0.474 . . . . 0.0 110.538 179.434 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 367' ' ' VAL . . . . . 0.403 HG13 ' HB3' ' B' ' 307' ' ' ALA . 18.4 t -57.97 -28.38 33.5 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 115.707 -0.679 . . . . 0.0 110.541 179.521 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 368' ' ' TYR . . . . . . . . . . . . . 46.1 t80 -70.16 -33.95 72.41 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.452 179.747 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 369' ' ' VAL . . . . . 0.558 HG22 ' HB2' ' B' ' 336' ' ' GLN . 20.7 t -71.48 -52.8 23.75 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.784 179.795 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 370' ' ' LEU . . . . . 0.43 HD13 ' HA ' ' B' ' 307' ' ' ALA . 87.7 mt -62.74 -41.2 99.07 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.831 -0.622 . . . . 0.0 111.183 -179.848 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 371' ' ' SER . . . . . . . . . . . . . 84.3 p -62.81 -55.78 23.29 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.768 179.901 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 372' ' ' SER . . . . . . . . . . . . . 69.1 m -53.03 -39.65 63.34 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.921 179.998 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 373' ' ' MET . . . . . . . . . . . . . 55.3 ttm -62.42 -43.07 99.7 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.768 179.779 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 374' ' ' ALA . . . . . . . . . . . . . . . -83.18 -8.44 59.49 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.557 -179.972 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 375' ' ' ARG . . . . . 0.567 ' HA ' ' HE ' ' A' ' 375' ' ' ARG . 4.1 mmp_? -102.62 -13.73 17.01 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.491 -0.322 . . . . 0.0 111.174 -179.854 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 376' ' ' GLN . . . . . 0.451 ' HB3' ' HG3' ' B' ' 381' ' ' PRO . 44.4 tt0 -82.34 18.45 1.44 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.321 -0.4 . . . . 0.0 110.727 -179.956 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 377' ' ' ARG . . . . . . . . . . . . . 78.5 mtp180 -54.62 134.46 46.9 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.088 179.886 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 378' ' ' ARG . . . . . . . . . . . . . 65.1 mtm180 63.79 156.78 0.07 Allowed 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 115.958 -0.564 . . . . 0.0 111.375 -179.993 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 379' ' ' ALA . . . . . . . . . . . . . . . -154.13 -168.01 2.82 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.895 -179.958 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 380' ' ' SER . . . . . . . . . . . . . 50.7 p . . . . . 0 C--O 1.249 1.063 0 CA-C-O 118.281 -0.866 . . . . 0.0 110.864 -179.993 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' B' B ' 295' ' ' SER . . . . . . . . . . . . . 49.3 m . . . . . 0 N--CA 1.487 1.395 0 CA-C-O 120.853 0.358 . . . . 0.0 110.858 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' B' B ' 296' ' ' LEU . . . . . . . . . . . . . 57.3 tp -69.97 144.74 52.25 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.859 -179.991 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 297' ' ' GLN . . . . . . . . . . . . . 35.4 tt0 -154.14 -40.23 0.09 Allowed 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.879 179.903 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 298' ' ' ASN . . . . . . . . . . . . . 3.4 p-10 -144.18 171.11 14.74 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.795 -179.969 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 299' ' ' ASN . . . . . . . . . . . . . 66.4 m-20 -111.04 -7.6 14.51 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.037 -179.957 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 300' ' ' GLN . . . . . . . . . . . . . 7.6 tp60 -138.69 85.4 17.07 Favored Pre-proline 0 C--N 1.33 -0.27 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.878 179.904 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 301' ' ' PRO . . . . . . . . . . . . . 51.4 Cg_exo -54.43 150.9 32.23 Favored 'Trans proline' 0 C--N 1.347 0.468 0 C-N-CA 122.5 2.133 . . . . 0.0 112.363 179.833 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 302' ' ' VAL . . . . . . . . . . . . . 28.5 m -81.29 -20.25 11.08 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.95 179.935 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 303' ' ' GLU . . . . . . . . . . . . . 40.5 mt-10 -55.6 -82.88 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.75 -0.659 . . . . 0.0 111.877 -179.212 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 304' ' ' PHE . . . . . . . . . . . . . 79.6 m-85 -57.56 -39.71 77.33 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.788 -179.067 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 305' ' ' ASN . . . . . . . . . . . . . 22.5 t-20 -53.68 -69.34 0.12 Allowed 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 111.86 0.318 . . . . 0.0 111.86 -179.1 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 306' ' ' HIS . . . . . . . . . . . . . 13.4 m-70 -61.94 -53.97 48.32 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.185 -0.461 . . . . 0.0 112.243 -178.697 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 307' ' ' ALA . . . . . 0.43 ' HA ' HD13 ' A' ' 370' ' ' LEU . . . -52.3 -61.96 1.94 Allowed 'General case' 0 C--N 1.33 -0.242 0 N-CA-C 112.372 0.508 . . . . 0.0 112.372 -178.904 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 308' ' ' ILE . . . . . . . . . . . . . 86.1 mt -55.4 -54.54 24.1 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.231 0 N-CA-C 111.809 0.3 . . . . 0.0 111.809 -179.346 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 309' ' ' ASN . . . . . . . . . . . . . 39.2 t-20 -54.05 -29.91 45.92 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-O 120.899 0.38 . . . . 0.0 111.042 -179.554 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 310' ' ' TYR . . . . . 0.456 ' O ' ' HG3' ' B' ' 313' ' ' LYS . 8.6 t80 -70.86 -61.77 1.64 Allowed 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.073 -179.729 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 311' ' ' VAL . . . . . . . . . . . . . 38.4 t -59.09 -22.09 21.17 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-O 120.922 0.392 . . . . 0.0 110.656 179.875 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 312' ' ' ASN . . . . . . . . . . . . . 41.1 t30 -73.53 -57.38 4.04 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.534 -179.893 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 313' ' ' LYS . . . . . 0.456 ' HG3' ' O ' ' B' ' 310' ' ' TYR . 0.0 OUTLIER -62.46 -27.98 69.49 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 116.323 -0.399 . . . . 0.0 111.327 -179.55 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' B' B ' 314' ' ' ILE . . . . . . . . . . . . . 92.8 mt -77.43 -44.98 29.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.497 -0.32 . . . . 0.0 111.177 179.737 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 315' ' ' LYS . . . . . . . . . . . . . 27.4 ttpp -69.25 -24.74 64.03 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.223 -179.65 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 316' ' ' ASN . . . . . . . . . . . . . 6.7 t30 -85.8 -57.59 2.99 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.321 -0.399 . . . . 0.0 111.247 -179.694 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 317' ' ' ARG . . . . . . . . . . . . . 21.4 tpp180 -65.33 -59.56 3.91 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.058 -179.801 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 318' ' ' PHE . . . . . . . . . . . . . 90.3 m-85 -83.49 40.26 0.71 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.213 -0.448 . . . . 0.0 110.853 -179.89 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 319' ' ' GLN . . . . . . . . . . . . . 17.7 tt0 -71.76 -7.38 47.82 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.042 -0.527 . . . . 0.0 110.884 -179.864 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 320' ' ' GLY . . . . . . . . . . . . . . . -107.23 1.14 35.1 Favored Glycine 0 N--CA 1.452 -0.26 0 C-N-CA 120.658 -0.782 . . . . 0.0 112.83 -179.758 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 321' ' ' GLN . . . . . . . . . . . . . 27.7 mm-40 -112.5 88.49 11.13 Favored Pre-proline 0 C--N 1.33 -0.261 0 CA-C-O 120.491 0.186 . . . . 0.0 110.89 179.969 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 322' ' ' PRO . . . . . . . . . . . . . 73.9 Cg_endo -74.15 -29.46 9.78 Favored 'Trans proline' 0 C--N 1.347 0.475 0 C-N-CA 122.625 2.217 . . . . 0.0 112.654 -179.815 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 323' ' ' ASP . . . . . . . . . . . . . 13.8 t70 -68.87 -51.02 44.78 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.332 -0.395 . . . . 0.0 111.084 -179.647 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 324' ' ' ILE . . . . . . . . . . . . . 73.3 mt -68.23 -44.16 84.22 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.16 179.943 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 325' ' ' TYR . . . . . . . . . . . . . 35.3 t80 -58.04 -53.44 58.23 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.855 -179.826 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 326' ' ' LYS . . . . . 0.416 ' O ' ' HG3' ' B' ' 330' ' ' GLU . 86.1 tttt -60.09 -58.44 8.54 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.372 -179.865 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 327' ' ' ALA . . . . . 0.425 ' HB3' HD11 ' B' ' 365' ' ' LEU . . . -45.69 -53.07 9.9 Favored 'General case' 0 C--O 1.234 0.248 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.592 -179.654 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 328' ' ' PHE . . . . . . . . . . . . . 52.2 t80 -54.01 -53.52 51.84 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.146 0.498 . . . . 0.0 110.649 179.947 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 329' ' ' LEU . . . . . 0.573 ' HB3' ' HG3' ' A' ' 362' ' ' MET . 84.6 mt -60.5 -24.38 65.26 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.712 -0.676 . . . . 0.0 110.984 179.891 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 330' ' ' GLU . . . . . 0.416 ' HG3' ' O ' ' B' ' 326' ' ' LYS . 48.0 mt-10 -76.17 -33.38 59.35 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.569 179.587 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 331' ' ' ILE . . . . . 0.432 HG22 HG22 ' B' ' 358' ' ' VAL . 76.8 mt -70.77 -44.53 76.2 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.222 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.275 179.378 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 332' ' ' LEU . . . . . . . . . . . . . 30.1 mt -69.34 -39.91 77.85 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.987 179.569 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 333' ' ' HIS . . . . . . . . . . . . . 53.5 t-80 -62.84 -54.04 44.87 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.977 0.418 . . . . 0.0 110.378 179.641 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 334' ' ' THR . . . . . . . . . . . . . 70.7 m -60.0 -33.69 72.32 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.361 179.545 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 335' ' ' TYR . . . . . 0.408 ' O ' ' HG2' ' B' ' 339' ' ' GLN . 74.7 t80 -61.35 -48.18 82.49 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.664 179.518 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 336' ' ' GLN . . . . . 0.558 ' HB2' HG22 ' A' ' 369' ' ' VAL . 20.6 tt0 -60.75 -46.5 90.21 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.742 179.727 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 337' ' ' LYS . . . . . . . . . . . . . 41.0 ttmt -57.34 -43.08 83.12 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.031 -0.531 . . . . 0.0 111.008 179.985 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 338' ' ' GLU . . . . . . . . . . . . . 29.8 mm-40 -68.04 -36.84 80.57 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.378 -179.664 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 339' ' ' GLN . . . . . 0.408 ' HG2' ' O ' ' B' ' 335' ' ' TYR . 27.0 mm-40 -66.41 -44.33 83.26 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.744 0.307 . . . . 0.0 110.837 179.949 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 340' ' ' ARG . . . . . . . . . . . . . 99.7 mtt180 -62.76 -54.11 44.02 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.738 179.895 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 341' ' ' ASN . . . . . . . . . . . . . 2.7 m-20 -57.52 -44.95 85.49 Favored 'General case' 0 C--O 1.234 0.249 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.947 179.865 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 342' ' ' ALA . . . . . . . . . . . . . . . -63.8 -30.22 71.33 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.846 179.881 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 343' ' ' LYS . . . . . . . . . . . . . 26.8 ttpp -76.1 -31.29 58.63 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.64 179.756 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 344' ' ' GLU . . . . . . . . . . . . . 22.7 mm-40 -69.63 -55.24 10.59 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.03 -0.532 . . . . 0.0 111.076 179.939 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 345' ' ' ALA . . . . . . . . . . . . . . . -74.0 -42.32 60.55 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.814 179.997 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 346' ' ' GLY . . . . . . . . . . . . . . . 43.59 56.34 4.95 Favored Glycine 0 C--N 1.331 0.291 0 CA-C-N 115.915 -0.584 . . . . 0.0 113.066 179.728 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 347' ' ' GLY . . . . . . . . . . . . . . . -174.54 -112.49 0.29 Allowed Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.559 -0.829 . . . . 0.0 112.938 -179.881 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 348' ' ' ASN . . . . . . . . . . . . . 27.5 t-20 -56.78 -30.6 63.8 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.709 0.29 . . . . 0.0 111.4 -179.616 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 349' ' ' TYR . . . . . . . . . . . . . 40.5 t80 -62.67 138.16 58.43 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.806 0.336 . . . . 0.0 110.883 -179.822 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 350' ' ' THR . . . . . . . . . . . . . 90.3 m -128.05 125.11 23.4 Favored Pre-proline 0 C--N 1.329 -0.305 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.849 179.778 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 351' ' ' PRO . . . . . . . . . . . . . 52.7 Cg_exo -55.1 163.31 4.51 Favored 'Trans proline' 0 C--N 1.349 0.564 0 C-N-CA 122.402 2.068 . . . . 0.0 112.262 179.948 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 352' ' ' ALA . . . . . . . . . . . . . . . -93.48 -23.05 18.51 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.163 -179.82 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 353' ' ' LEU . . . . . 0.546 ' HB3' ' HG2' ' B' ' 357' ' ' GLU . 0.2 OUTLIER -159.15 140.31 12.9 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 121.229 0.538 . . . . 0.0 111.743 179.91 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' B' B ' 354' ' ' THR . . . . . . . . . . . . . 60.4 p -114.63 -167.09 1.17 Allowed 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.754 -0.657 . . . . 0.0 110.744 179.733 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 355' ' ' GLU . . . . . 0.4 ' OE1' ' HD2' ' B' ' 381' ' ' PRO . 42.7 mt-10 -56.8 -27.62 60.15 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.957 0.408 . . . . 0.0 110.521 179.547 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 356' ' ' GLN . . . . . . . . . . . . . 87.8 mt-30 -70.55 -49.53 47.08 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.814 -0.63 . . . . 0.0 111.115 -179.828 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 357' ' ' GLU . . . . . 0.546 ' HG2' ' HB3' ' B' ' 353' ' ' LEU . 7.0 tp10 -62.7 -44.06 97.21 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.103 -179.634 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 358' ' ' VAL . . . . . 0.432 HG22 HG22 ' B' ' 331' ' ' ILE . 95.1 t -62.32 -58.08 9.17 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.351 -0.386 . . . . 0.0 111.29 -179.911 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 359' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -58.81 -31.55 68.56 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.523 -179.246 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 360' ' ' ALA . . . . . . . . . . . . . . . -72.16 -60.9 2.0 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.729 0.299 . . . . 0.0 111.252 -179.811 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 361' ' ' GLN . . . . . . . . . . . . . 97.6 mt-30 -55.37 -35.7 65.55 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 121.045 0.45 . . . . 0.0 110.348 179.555 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 362' ' ' VAL . . . . . . . . . . . . . 14.4 t -70.82 -36.85 66.24 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 CA-C-N 115.734 -0.666 . . . . 0.0 110.485 179.316 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 363' ' ' ALA . . . . . 0.698 ' HA ' HD21 ' B' ' 373' ' ' LEU . . . -63.13 -38.33 90.75 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.735 179.903 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 364' ' ' ARG . . . . . . . . . . . . . 36.1 ttt180 -88.71 -18.14 28.48 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.793 179.73 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 365' ' ' LEU . . . . . 0.425 HD11 ' HB3' ' B' ' 327' ' ' ALA . 20.7 tp -56.22 -64.86 0.72 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.019 -0.537 . . . . 0.0 111.011 -179.861 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 366' ' ' PHE . . . . . . . . . . . . . 74.0 m-85 -71.56 167.83 18.89 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.024 -0.535 . . . . 0.0 111.096 -179.675 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 367' ' ' LYS . . . . . . . . . . . . . 35.1 mmtp -82.18 75.32 9.11 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.955 -179.796 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 368' ' ' ASN . . . . . . . . . . . . . 85.3 m-20 58.92 10.42 1.54 Allowed 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.11 -0.496 . . . . 0.0 111.356 179.967 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 369' ' ' GLN . . . . . . . . . . . . . 83.0 mm-40 -61.02 113.25 2.44 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.785 0.326 . . . . 0.0 110.852 179.979 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 370' ' ' GLU . . . . . . . . . . . . . 9.7 tp10 -91.25 -26.77 18.84 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.218 -0.447 . . . . 0.0 110.862 179.916 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 371' ' ' ASP . . . . . . . . . . . . . 18.0 t70 -56.6 -54.6 44.12 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.69 179.91 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 372' ' ' LEU . . . . . 0.461 ' H ' HD12 ' B' ' 372' ' ' LEU . 6.4 mp -65.17 -43.26 92.29 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.777 179.81 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 373' ' ' LEU . . . . . 0.698 HD21 ' HA ' ' B' ' 363' ' ' ALA . 2.1 mp -56.69 -34.53 67.49 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.926 179.789 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 374' ' ' SER . . . . . . . . . . . . . 59.7 m -75.97 -56.25 4.84 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.627 -179.948 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 375' ' ' GLU . . . . . . . . . . . . . 10.1 mm-40 -50.9 -33.53 24.58 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.599 179.647 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 376' ' ' PHE . . . . . 0.418 ' HB2' ' OH ' ' B' ' 310' ' ' TYR . 79.4 t80 -80.76 -38.77 28.02 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.426 179.55 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 377' ' ' GLY . . . . . . . . . . . . . . . -58.61 -28.61 62.84 Favored Glycine 0 N--CA 1.448 -0.519 0 C-N-CA 120.653 -0.784 . . . . 0.0 111.928 179.583 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 378' ' ' GLN . . . . . . . . . . . . . 50.3 mt-30 -61.31 -35.62 77.88 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.729 0.299 . . . . 0.0 110.807 179.603 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 379' ' ' PHE . . . . . . . . . . . . . 68.2 m-85 -58.96 -40.38 84.56 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.772 179.766 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 380' ' ' LEU . . . . . . . . . . . . . 48.7 mt -51.32 131.92 33.24 Favored Pre-proline 0 C--N 1.331 -0.221 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.441 179.907 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 381' ' ' PRO . . . . . 0.451 ' HG3' ' HB3' ' A' ' 376' ' ' GLN . 76.3 Cg_exo -49.59 108.04 0.18 Allowed 'Trans proline' 0 C--N 1.348 0.529 0 C-N-CA 122.235 1.956 . . . . 0.0 112.234 -179.806 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 382' ' ' ASP . . . . . . . . . . . . . 7.8 m-20 -72.86 151.77 41.81 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.961 -179.777 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 383' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.251 1.138 0 CA-C-O 118.159 -0.924 . . . . 0.0 111.09 -179.924 . . . . . . . . 0 0 . 1 stop_ save_